smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COCCCC[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000619292267 1125557987 /nfs/dbraw/zinc/55/79/87/1125557987.db2.gz SNRMQJSASRNAFA-KRWDZBQOSA-N 1 1 369.421 4.384 20 5 FIBDMO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000114563885 1125562004 /nfs/dbraw/zinc/56/20/04/1125562004.db2.gz OQMDYMVBAGJKSS-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000114563885 1125562008 /nfs/dbraw/zinc/56/20/08/1125562008.db2.gz OQMDYMVBAGJKSS-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000619531349 1125609258 /nfs/dbraw/zinc/60/92/58/1125609258.db2.gz QXDJHPDPOREKCC-RXVVDRJESA-N 1 1 370.449 4.203 20 5 FIBDMO CC[NH+](CC)CCCC1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000182782689 1125623466 /nfs/dbraw/zinc/62/34/66/1125623466.db2.gz JANLNGASWYRNNA-UHFFFAOYSA-N 1 1 374.485 4.070 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182817672 1125637492 /nfs/dbraw/zinc/63/74/92/1125637492.db2.gz CEPJUHIPPGBYCA-WFASDCNBSA-N 1 1 368.359 4.208 20 5 FIBDMO CCc1nc(C)c([C@@H](C)[N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000610215084 1079976506 /nfs/dbraw/zinc/97/65/06/1079976506.db2.gz LVBUODQOZMELMY-CQSZACIVSA-N 1 1 363.483 4.384 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000430222993 1080016411 /nfs/dbraw/zinc/01/64/11/1080016411.db2.gz VORPZRCIKYEFSH-YLJYHZDGSA-N 1 1 374.412 4.095 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000430230590 1080036793 /nfs/dbraw/zinc/03/67/93/1080036793.db2.gz ABWBPQXDMBKLCH-UHFFFAOYSA-N 1 1 370.449 4.032 20 5 FIBDMO C[N@@H+](CCCOc1cccc(Cl)c1)CCOc1ccccc1[N+](=O)[O-] ZINC001167094706 1080343381 /nfs/dbraw/zinc/34/33/81/1080343381.db2.gz ZHWXFVHCWVQAQQ-UHFFFAOYSA-N 1 1 364.829 4.028 20 5 FIBDMO Cc1c([C@H](C)NC[C@H]2CC[N@H+](CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000165314597 1080473709 /nfs/dbraw/zinc/47/37/09/1080473709.db2.gz CHRYZXVKITVJDU-AZUAARDMSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1c([C@H](C)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000165314597 1080473714 /nfs/dbraw/zinc/47/37/14/1080473714.db2.gz CHRYZXVKITVJDU-AZUAARDMSA-N 1 1 367.493 4.118 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1n1ccnc1 ZINC000246909968 1080543728 /nfs/dbraw/zinc/54/37/28/1080543728.db2.gz UPUHRQYIASSOMS-DNVCBOLYSA-N 1 1 366.421 4.134 20 5 FIBDMO COc1ccc(C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H](C)C2CC2)cc1 ZINC001167131172 1080659825 /nfs/dbraw/zinc/65/98/25/1080659825.db2.gz LLJDZDFWVAUTKL-MRXNPFEDSA-N 1 1 354.450 4.447 20 5 FIBDMO CC[C@H](C)[N@@H+](CCc1ccccc1F)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001167244068 1080901477 /nfs/dbraw/zinc/90/14/77/1080901477.db2.gz FJYIHZFTANGGGT-MGPUTAFESA-N 1 1 360.429 4.111 20 5 FIBDMO COc1cc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)ccc1SC ZINC000177028705 1081179088 /nfs/dbraw/zinc/17/90/88/1081179088.db2.gz KZPIZCWYLYFMQV-UHFFFAOYSA-N 1 1 373.434 4.099 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)ccc1SC ZINC000177028705 1081179095 /nfs/dbraw/zinc/17/90/95/1081179095.db2.gz KZPIZCWYLYFMQV-UHFFFAOYSA-N 1 1 373.434 4.099 20 5 FIBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000177533127 1081226839 /nfs/dbraw/zinc/22/68/39/1081226839.db2.gz IBJIODAFLRSHSQ-KBXCAEBGSA-N 1 1 364.405 4.023 20 5 FIBDMO C[C@@H]1C[C@H](N(C)Cc2c(F)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000610003579 1081371078 /nfs/dbraw/zinc/37/10/78/1081371078.db2.gz XERCDIVENPXBQU-SJLPKXTDSA-N 1 1 371.456 4.219 20 5 FIBDMO COc1cccc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000379664033 1081851699 /nfs/dbraw/zinc/85/16/99/1081851699.db2.gz NNBVNBWUAUQHGQ-RDJZCZTQSA-N 1 1 355.438 4.068 20 5 FIBDMO COc1cccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000379664032 1081852121 /nfs/dbraw/zinc/85/21/21/1081852121.db2.gz NNBVNBWUAUQHGQ-NVXWUHKLSA-N 1 1 355.438 4.068 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1n1ccnc1 ZINC000247262717 1081931298 /nfs/dbraw/zinc/93/12/98/1081931298.db2.gz XRZSJRUOAFZTHR-HNAYVOBHSA-N 1 1 366.421 4.134 20 5 FIBDMO CC[N@@H+](CC[N+](=O)[O-])Cc1cc(C)c(OCc2cccc(C)c2)c(C)c1 ZINC001167402551 1081953333 /nfs/dbraw/zinc/95/33/33/1081953333.db2.gz ZCALQBHOZBIFBK-UHFFFAOYSA-N 1 1 356.466 4.289 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000119122327 1081961640 /nfs/dbraw/zinc/96/16/40/1081961640.db2.gz AQJSAUYTIHENIY-CQSZACIVSA-N 1 1 357.410 4.050 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)cc(Br)c2)c(Cl)c1 ZINC000580480714 1081967867 /nfs/dbraw/zinc/96/78/67/1081967867.db2.gz FCFWYWPFWOXVDA-UHFFFAOYSA-N 1 1 373.609 4.440 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(Br)cs2)c(Cl)c1 ZINC000071309302 1081969272 /nfs/dbraw/zinc/96/92/72/1081969272.db2.gz DCWBPCXZRIZMMG-UHFFFAOYSA-N 1 1 361.648 4.362 20 5 FIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000610476341 1082300735 /nfs/dbraw/zinc/30/07/35/1082300735.db2.gz OKXFMBDBWPSEGS-PXNSSMCTSA-N 1 1 358.413 4.334 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCS[C@@H](c4ccccc4)C3)nc2c1 ZINC000610582186 1082577543 /nfs/dbraw/zinc/57/75/43/1082577543.db2.gz RDQSUHSSADQJGI-QGZVFWFLSA-N 1 1 355.419 4.026 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCS[C@@H](c4ccccc4)C3)nc2c1 ZINC000610582186 1082577546 /nfs/dbraw/zinc/57/75/46/1082577546.db2.gz RDQSUHSSADQJGI-QGZVFWFLSA-N 1 1 355.419 4.026 20 5 FIBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001167487150 1082956326 /nfs/dbraw/zinc/95/63/26/1082956326.db2.gz GKDZKSQJBPEABD-PZJWPPBQSA-N 1 1 356.466 4.280 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582438 1083212104 /nfs/dbraw/zinc/21/21/04/1083212104.db2.gz HXOIGVKTJSVRTE-PXAZEXFGSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582438 1083212107 /nfs/dbraw/zinc/21/21/07/1083212107.db2.gz HXOIGVKTJSVRTE-PXAZEXFGSA-N 1 1 355.369 4.458 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCS[C@@H]4CCCC[C@@H]43)o2)c1 ZINC000610619587 1083265300 /nfs/dbraw/zinc/26/53/00/1083265300.db2.gz HHJYRIRJLXNVRP-FUHWJXTLSA-N 1 1 373.478 4.152 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCS[C@H]4CCCC[C@@H]43)o2)c1 ZINC000610619589 1083265354 /nfs/dbraw/zinc/26/53/54/1083265354.db2.gz HHJYRIRJLXNVRP-WMZOPIPTSA-N 1 1 373.478 4.152 20 5 FIBDMO O=[N+]([O-])c1sccc1N1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000610808052 1083718398 /nfs/dbraw/zinc/71/83/98/1083718398.db2.gz YBNIISUKXWAFJG-IAGOWNOFSA-N 1 1 357.479 4.147 20 5 FIBDMO C[C@H](NCc1cccc(C[NH+]2CCCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000411464483 1083780690 /nfs/dbraw/zinc/78/06/90/1083780690.db2.gz YFTHZQXAWZEDSY-KRWDZBQOSA-N 1 1 353.466 4.432 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000548934103 1083855275 /nfs/dbraw/zinc/85/52/75/1083855275.db2.gz RIWFJKQOQGGMCX-QGZVFWFLSA-N 1 1 369.465 4.022 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000548934103 1083855288 /nfs/dbraw/zinc/85/52/88/1083855288.db2.gz RIWFJKQOQGGMCX-QGZVFWFLSA-N 1 1 369.465 4.022 20 5 FIBDMO CCOc1ccc(C[NH2+]Cc2c(Br)cccc2[N+](=O)[O-])cc1 ZINC001648924921 1084062804 /nfs/dbraw/zinc/06/28/04/1084062804.db2.gz ZVJORYBQRLRDRZ-UHFFFAOYSA-N 1 1 365.227 4.046 20 5 FIBDMO COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000539094672 1084314699 /nfs/dbraw/zinc/31/46/99/1084314699.db2.gz ZOKALOUHVAEVCS-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO Cc1c(C[N@H+](Cc2cccc(F)c2)C[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000071958739 1084413598 /nfs/dbraw/zinc/41/35/98/1084413598.db2.gz YCIDUGZPELOFFU-LJQANCHMSA-N 1 1 358.413 4.224 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000414156191 1084707044 /nfs/dbraw/zinc/70/70/44/1084707044.db2.gz OXZGYKCPDBHWSV-NEPJUHHUSA-N 1 1 361.467 4.351 20 5 FIBDMO CC(C)c1ccccc1NC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511088416 1084742899 /nfs/dbraw/zinc/74/28/99/1084742899.db2.gz BRCDBBZTXFHQHR-INIZCTEOSA-N 1 1 369.465 4.220 20 5 FIBDMO CC(C)c1ccccc1NC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511088416 1084742907 /nfs/dbraw/zinc/74/29/07/1084742907.db2.gz BRCDBBZTXFHQHR-INIZCTEOSA-N 1 1 369.465 4.220 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511089681 1084750121 /nfs/dbraw/zinc/75/01/21/1084750121.db2.gz GIESVONBVRRNAD-KRWDZBQOSA-N 1 1 369.465 4.022 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511089681 1084750127 /nfs/dbraw/zinc/75/01/27/1084750127.db2.gz GIESVONBVRRNAD-KRWDZBQOSA-N 1 1 369.465 4.022 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC000111040877 1085147666 /nfs/dbraw/zinc/14/76/66/1085147666.db2.gz XGIYMEOCCSQGLG-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)c1 ZINC000472252737 1085616678 /nfs/dbraw/zinc/61/66/78/1085616678.db2.gz WHYPTTKRFOHNKG-MRXNPFEDSA-N 1 1 368.359 4.037 20 5 FIBDMO COc1cc(NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000078338365 1085713204 /nfs/dbraw/zinc/71/32/04/1085713204.db2.gz XDUICTQNRPQRJF-FZKQIMNGSA-N 1 1 361.467 4.160 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccccc1C(F)(F)F ZINC000178729587 1085966743 /nfs/dbraw/zinc/96/67/43/1085966743.db2.gz DTBRDWGKWYGRQB-LLVKDONJSA-N 1 1 354.328 4.473 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(SC)c(OC)c1 ZINC000178730025 1085967973 /nfs/dbraw/zinc/96/79/73/1085967973.db2.gz HSRKLYPNFPONRM-LBPRGKRZSA-N 1 1 362.451 4.185 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000544041302 1086072412 /nfs/dbraw/zinc/07/24/12/1086072412.db2.gz GTMZJFROZDAEPV-CCKFTAQKSA-N 1 1 354.454 4.006 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@@H](C)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000511979648 1086528214 /nfs/dbraw/zinc/52/82/14/1086528214.db2.gz XVYIKAYKOANWEX-OAHLLOKOSA-N 1 1 356.422 4.024 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432341339 1086633232 /nfs/dbraw/zinc/63/32/32/1086633232.db2.gz WIFNPWBIYZNRAY-IAGOWNOFSA-N 1 1 368.481 4.234 20 5 FIBDMO C[C@@H]1Cc2ccccc2N1C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC001167834041 1086679363 /nfs/dbraw/zinc/67/93/63/1086679363.db2.gz CDBNYMJVDVTSCX-OAHLLOKOSA-N 1 1 369.440 4.150 20 5 FIBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)(C)c1ccccc1 ZINC000585754344 1086686857 /nfs/dbraw/zinc/68/68/57/1086686857.db2.gz IQQCGQQSRQPUTM-UHFFFAOYSA-N 1 1 352.394 4.012 20 5 FIBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)(C)c1ccccc1 ZINC000585754344 1086686864 /nfs/dbraw/zinc/68/68/64/1086686864.db2.gz IQQCGQQSRQPUTM-UHFFFAOYSA-N 1 1 352.394 4.012 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@]3(C2)CCCOC3)s1 ZINC000585767895 1086694997 /nfs/dbraw/zinc/69/49/97/1086694997.db2.gz ACPGUCJAFDSFBO-IBGZPJMESA-N 1 1 358.463 4.326 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)CC[C@@H]1c1ccccc1 ZINC000512166172 1086865757 /nfs/dbraw/zinc/86/57/57/1086865757.db2.gz NKXQVVRXFJGGRB-CRAIPNDOSA-N 1 1 367.449 4.315 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)CC[C@@H]1c1ccccc1 ZINC000512166172 1086865766 /nfs/dbraw/zinc/86/57/66/1086865766.db2.gz NKXQVVRXFJGGRB-CRAIPNDOSA-N 1 1 367.449 4.315 20 5 FIBDMO CCC[N@H+](Cc1ccccc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728897376 1086869454 /nfs/dbraw/zinc/86/94/54/1086869454.db2.gz ZKACOWMWIKBTSG-UHFFFAOYSA-N 1 1 350.422 4.328 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@@H](CC(F)(F)F)C3)cs2)c1 ZINC000583673328 1086909480 /nfs/dbraw/zinc/90/94/80/1086909480.db2.gz WECZOEXIWPQDRC-NSHDSACASA-N 1 1 371.384 4.493 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](CC(F)(F)F)C3)cs2)c1 ZINC000583673328 1086909484 /nfs/dbraw/zinc/90/94/84/1086909484.db2.gz WECZOEXIWPQDRC-NSHDSACASA-N 1 1 371.384 4.493 20 5 FIBDMO Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc(C)[nH+]1 ZINC001267356079 1087260596 /nfs/dbraw/zinc/26/05/96/1087260596.db2.gz CCBPRHGSTSLKAJ-UHFFFAOYSA-N 1 1 363.373 4.073 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)Cc1cccc2ccccc21 ZINC000053017011 1087315028 /nfs/dbraw/zinc/31/50/28/1087315028.db2.gz IXBYNFHDWUDPOD-UHFFFAOYSA-N 1 1 363.417 4.127 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)Cc1cccc2ccccc21 ZINC000053017011 1087315037 /nfs/dbraw/zinc/31/50/37/1087315037.db2.gz IXBYNFHDWUDPOD-UHFFFAOYSA-N 1 1 363.417 4.127 20 5 FIBDMO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1cccc2ccccc21 ZINC000053017322 1087315462 /nfs/dbraw/zinc/31/54/62/1087315462.db2.gz UBOMVKISKSGBLT-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1cccc2ccccc21 ZINC000053017322 1087315465 /nfs/dbraw/zinc/31/54/65/1087315465.db2.gz UBOMVKISKSGBLT-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cnn(Cc2ccccc2)c1 ZINC000090853213 1087415635 /nfs/dbraw/zinc/41/56/35/1087415635.db2.gz FYLGRFVCSUXVTF-HOTGVXAUSA-N 1 1 350.422 4.251 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](Cc4ccncc4)C3)o2)c1 ZINC000611983902 1087672919 /nfs/dbraw/zinc/67/29/19/1087672919.db2.gz VZOXQMBAVSDCEB-QGZVFWFLSA-N 1 1 363.417 4.314 20 5 FIBDMO COc1ccc(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cc1O ZINC000180389616 1087877462 /nfs/dbraw/zinc/87/74/62/1087877462.db2.gz KLMSNLWAZRNDFP-NRFANRHFSA-N 1 1 364.401 4.188 20 5 FIBDMO C[C@@H](NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402699 1088638750 /nfs/dbraw/zinc/63/87/50/1088638750.db2.gz UCZSZLWUZPEMMY-MJGOQNOKSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402699 1088638759 /nfs/dbraw/zinc/63/87/59/1088638759.db2.gz UCZSZLWUZPEMMY-MJGOQNOKSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H]([NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402699 1088638775 /nfs/dbraw/zinc/63/87/75/1088638775.db2.gz UCZSZLWUZPEMMY-MJGOQNOKSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000434892611 1089100251 /nfs/dbraw/zinc/10/02/51/1089100251.db2.gz TUFWBPLJRIEKSB-BBRMVZONSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000434892611 1089100258 /nfs/dbraw/zinc/10/02/58/1089100258.db2.gz TUFWBPLJRIEKSB-BBRMVZONSA-N 1 1 373.840 4.065 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434896712 1089113069 /nfs/dbraw/zinc/11/30/69/1089113069.db2.gz QAHCFWVEYSRZSZ-LPHOPBHVSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434898011 1089116599 /nfs/dbraw/zinc/11/65/99/1089116599.db2.gz SYFVQDUVCIFVQR-QFBILLFUSA-N 1 1 367.449 4.110 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(-c2ccccc2)n1 ZINC000549172746 1089118417 /nfs/dbraw/zinc/11/84/17/1089118417.db2.gz SSGAJQGUDGQTDD-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(-c2ccccc2)n1 ZINC000549172746 1089118430 /nfs/dbraw/zinc/11/84/30/1089118430.db2.gz SSGAJQGUDGQTDD-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2cccc(F)c2)n[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC000511522765 1089351291 /nfs/dbraw/zinc/35/12/91/1089351291.db2.gz NFKFKNOQGIBJAL-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO CC(C)c1nc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)c2ccccn21 ZINC000584534177 1089550408 /nfs/dbraw/zinc/55/04/08/1089550408.db2.gz DYMGVPZFUKPXNV-UHFFFAOYSA-N 1 1 352.438 4.391 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c(Cl)c1 ZINC000425367215 1089599899 /nfs/dbraw/zinc/59/98/99/1089599899.db2.gz BQEARCRHZCHXGF-KRWDZBQOSA-N 1 1 350.846 4.029 20 5 FIBDMO C[Si](C)(C)c1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC001167734188 1090264524 /nfs/dbraw/zinc/26/45/24/1090264524.db2.gz KHOKURVNSVNARI-UHFFFAOYSA-N 1 1 354.526 4.305 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@@H](c3ccccc3)C3CCC3)n2)c1 ZINC000104697176 1090302346 /nfs/dbraw/zinc/30/23/46/1090302346.db2.gz PDQIOAXFWAQZPY-IBGZPJMESA-N 1 1 364.405 4.276 20 5 FIBDMO Cc1ccc(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)s1 ZINC000104694617 1090302607 /nfs/dbraw/zinc/30/26/07/1090302607.db2.gz PDAACSJJFZZVMK-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500119713 1091052160 /nfs/dbraw/zinc/05/21/60/1091052160.db2.gz AHNOCBSTDMBEJI-DLBZAZTESA-N 1 1 367.449 4.110 20 5 FIBDMO COc1cccc(C2(F)CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)c1 ZINC000500156974 1091074139 /nfs/dbraw/zinc/07/41/39/1091074139.db2.gz FIWDUVFDSXPNPV-UHFFFAOYSA-N 1 1 350.415 4.126 20 5 FIBDMO COCCCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000418142954 1091081038 /nfs/dbraw/zinc/08/10/38/1091081038.db2.gz YVCFFRYNOOTKOB-UHFFFAOYSA-N 1 1 352.818 4.367 20 5 FIBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000584569563 1091285044 /nfs/dbraw/zinc/28/50/44/1091285044.db2.gz MYUKYPXHNGDJSU-MRXNPFEDSA-N 1 1 369.465 4.103 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000512197139 1091891383 /nfs/dbraw/zinc/89/13/83/1091891383.db2.gz SKDWRPUEZAHDHB-FEEJDJEGSA-N 1 1 357.498 4.194 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[NH+]1CCCC1 ZINC000520955672 1092381521 /nfs/dbraw/zinc/38/15/21/1092381521.db2.gz FUSNVQLMKJIKCL-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000500749501 1092496044 /nfs/dbraw/zinc/49/60/44/1092496044.db2.gz RTFTYKVUDWGKOH-HNNXBMFYSA-N 1 1 353.422 4.079 20 5 FIBDMO Cc1c(C[N@@H+](C)CCCc2cc(-c3ccccc3)n[nH]2)cccc1[N+](=O)[O-] ZINC000728926922 1092581541 /nfs/dbraw/zinc/58/15/41/1092581541.db2.gz SGBCIUKFZAHEMV-UHFFFAOYSA-N 1 1 364.449 4.358 20 5 FIBDMO Cc1n[nH]cc1C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000549686900 1092692805 /nfs/dbraw/zinc/69/28/05/1092692805.db2.gz GKLJSXBEBDZCRT-UHFFFAOYSA-N 1 1 368.359 4.025 20 5 FIBDMO C[N@@H+](CCSc1cc(C(F)(F)F)ncc1[N+](=O)[O-])Cc1ccccc1 ZINC000432928413 1092963695 /nfs/dbraw/zinc/96/36/95/1092963695.db2.gz RQZANVKXMNEQSU-UHFFFAOYSA-N 1 1 371.384 4.233 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](c4ccccc4)C3)o2)cc1 ZINC000433049558 1093159561 /nfs/dbraw/zinc/15/95/61/1093159561.db2.gz VUTUMCFQSKEUOC-KRWDZBQOSA-N 1 1 364.405 4.024 20 5 FIBDMO CC(C)C1CCC([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000433137573 1093318851 /nfs/dbraw/zinc/31/88/51/1093318851.db2.gz OWOKIZBATUHGAB-UHFFFAOYSA-N 1 1 358.442 4.291 20 5 FIBDMO CC(C)(C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1 ZINC001168025314 1093431787 /nfs/dbraw/zinc/43/17/87/1093431787.db2.gz JQDPTYSMDUDLPJ-UHFFFAOYSA-N 1 1 373.428 4.363 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000279961622 1093555456 /nfs/dbraw/zinc/55/54/56/1093555456.db2.gz CHCYPDUTPDNWPF-NWDGAFQWSA-N 1 1 364.243 4.473 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@@H](c4nccs4)C3)cs2)c1 ZINC000895580492 1093618640 /nfs/dbraw/zinc/61/86/40/1093618640.db2.gz GVSWDFDFOAEXFQ-CYBMUJFWSA-N 1 1 372.475 4.164 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](c4nccs4)C3)cs2)c1 ZINC000895580492 1093618644 /nfs/dbraw/zinc/61/86/44/1093618644.db2.gz GVSWDFDFOAEXFQ-CYBMUJFWSA-N 1 1 372.475 4.164 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000513124097 1093861983 /nfs/dbraw/zinc/86/19/83/1093861983.db2.gz ZFSVLBQLXAPVHB-ZLHKHBAESA-N 1 1 366.417 4.216 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513272323 1094042764 /nfs/dbraw/zinc/04/27/64/1094042764.db2.gz QNAGCWYQFRODRF-KXBFYZLASA-N 1 1 353.422 4.007 20 5 FIBDMO CCCc1[nH+]ccn1Cc1cc(OC)c(OC[C@H](C)CC)cc1[N+](=O)[O-] ZINC000513597324 1094231414 /nfs/dbraw/zinc/23/14/14/1094231414.db2.gz IWRASAVAZGSAPX-CQSZACIVSA-N 1 1 361.442 4.226 20 5 FIBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@H+]1CCc2sccc2C1 ZINC000025500404 1094326658 /nfs/dbraw/zinc/32/66/58/1094326658.db2.gz BDQIUUXRZFAOJF-ZDUSSCGKSA-N 1 1 368.462 4.063 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 ZINC000508459849 1095658590 /nfs/dbraw/zinc/65/85/90/1095658590.db2.gz WRXOESRJUDAHCU-UHFFFAOYSA-N 1 1 367.449 4.030 20 5 FIBDMO Cc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cn2cc[nH+]c12 ZINC000502827547 1095889505 /nfs/dbraw/zinc/88/95/05/1095889505.db2.gz OIEKXLYAVFGCFT-UHFFFAOYSA-N 1 1 352.375 4.018 20 5 FIBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000444239933 1095895434 /nfs/dbraw/zinc/89/54/34/1095895434.db2.gz CUTLIIQQFIWKEG-IIDMSEBBSA-N 1 1 355.438 4.445 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(Cl)cc1OC ZINC000421826471 1095939503 /nfs/dbraw/zinc/93/95/03/1095939503.db2.gz SOQSKUMCMDCGHM-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO CCOc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1OCC ZINC000183809440 1096212353 /nfs/dbraw/zinc/21/23/53/1096212353.db2.gz AMFKMDFLUBLOPU-UHFFFAOYSA-N 1 1 364.829 4.335 20 5 FIBDMO C[C@@H]1C[C@@]1([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Cl)cc1 ZINC000503369201 1096369657 /nfs/dbraw/zinc/36/96/57/1096369657.db2.gz OOUXRDPYISUACN-ZMZPIMSZSA-N 1 1 356.813 4.149 20 5 FIBDMO C[C@H]1C[C@@]1([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Cl)cc1 ZINC000503369200 1096370061 /nfs/dbraw/zinc/37/00/61/1096370061.db2.gz OOUXRDPYISUACN-VOJFVSQTSA-N 1 1 356.813 4.149 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1cccs1)C(C)C ZINC000532925434 1098594675 /nfs/dbraw/zinc/59/46/75/1098594675.db2.gz FGROVKZTHLSLNE-UHFFFAOYSA-N 1 1 361.467 4.204 20 5 FIBDMO Cc1ccccc1[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000533242222 1098900083 /nfs/dbraw/zinc/90/00/83/1098900083.db2.gz DXXVKLSEQHPICC-FQEVSTJZSA-N 1 1 367.449 4.377 20 5 FIBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccccc2)[C@H](C)C1 ZINC000533290855 1098939627 /nfs/dbraw/zinc/93/96/27/1098939627.db2.gz SYNAJCITDRVXRZ-NUJGCVRESA-N 1 1 367.449 4.047 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425548226 1099009790 /nfs/dbraw/zinc/00/97/90/1099009790.db2.gz GLZJVEYIIBENOM-HXUWFJFHSA-N 1 1 374.481 4.163 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](c3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000533435582 1099056598 /nfs/dbraw/zinc/05/65/98/1099056598.db2.gz LYBVWMIVCSHKDD-CRAIPNDOSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000505844967 1099107781 /nfs/dbraw/zinc/10/77/81/1099107781.db2.gz JEQXJCHGDLZBFS-BBVFFXRHSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000505844967 1099107784 /nfs/dbraw/zinc/10/77/84/1099107784.db2.gz JEQXJCHGDLZBFS-BBVFFXRHSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000505845042 1099110542 /nfs/dbraw/zinc/11/05/42/1099110542.db2.gz JWCDSAVNYNXWQY-KSEUIEODSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000505845042 1099110549 /nfs/dbraw/zinc/11/05/49/1099110549.db2.gz JWCDSAVNYNXWQY-KSEUIEODSA-N 1 1 365.433 4.020 20 5 FIBDMO C[C@@H](N[C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516926248 1099936560 /nfs/dbraw/zinc/93/65/60/1099936560.db2.gz HJNOEFSJHGLYNP-YLJYHZDGSA-N 1 1 365.477 4.443 20 5 FIBDMO C[C@@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516926248 1099936562 /nfs/dbraw/zinc/93/65/62/1099936562.db2.gz HJNOEFSJHGLYNP-YLJYHZDGSA-N 1 1 365.477 4.443 20 5 FIBDMO CN(C)C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCC1 ZINC000438341497 1100612752 /nfs/dbraw/zinc/61/27/52/1100612752.db2.gz JTVPLLMELMQOHA-UHFFFAOYSA-N 1 1 363.845 4.082 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@H]3Cc3ccccc3)o2)c1 ZINC000437830493 1100799155 /nfs/dbraw/zinc/79/91/55/1100799155.db2.gz VZFOFWYZBHGNFH-SFHVURJKSA-N 1 1 363.417 4.109 20 5 FIBDMO COC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 ZINC000536995164 1101376909 /nfs/dbraw/zinc/37/69/09/1101376909.db2.gz RVPMTXUZJNOUBW-XIKOKIGWSA-N 1 1 350.365 4.220 20 5 FIBDMO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507168604 1101702669 /nfs/dbraw/zinc/70/26/69/1101702669.db2.gz RDFHHDZENDPONI-UHFFFAOYSA-N 1 1 356.470 4.328 20 5 FIBDMO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507168604 1101702685 /nfs/dbraw/zinc/70/26/85/1101702685.db2.gz RDFHHDZENDPONI-UHFFFAOYSA-N 1 1 356.470 4.328 20 5 FIBDMO C[C@@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000152364517 1101783379 /nfs/dbraw/zinc/78/33/79/1101783379.db2.gz IUMYNSVXLBVUDQ-CABCVRRESA-N 1 1 371.506 4.458 20 5 FIBDMO CCN1CCC([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000506691701 1101803488 /nfs/dbraw/zinc/80/34/88/1101803488.db2.gz YODAELUQNUBDNX-UHFFFAOYSA-N 1 1 359.495 4.239 20 5 FIBDMO CC[NH+]1CCC(N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000506691701 1101803507 /nfs/dbraw/zinc/80/35/07/1101803507.db2.gz YODAELUQNUBDNX-UHFFFAOYSA-N 1 1 359.495 4.239 20 5 FIBDMO CC[N@H+](Cc1cccs1)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171124476 1102407321 /nfs/dbraw/zinc/40/73/21/1102407321.db2.gz CVWJVOQLRGGDJQ-LBPRGKRZSA-N 1 1 358.423 4.289 20 5 FIBDMO CC[N@@H+](Cc1cccs1)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171124476 1102407328 /nfs/dbraw/zinc/40/73/28/1102407328.db2.gz CVWJVOQLRGGDJQ-LBPRGKRZSA-N 1 1 358.423 4.289 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H](C)c1ccccc1 ZINC000532516304 1102448841 /nfs/dbraw/zinc/44/88/41/1102448841.db2.gz QZGNBCXYGIUYSK-HUUCEWRRSA-N 1 1 366.421 4.441 20 5 FIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)c1ccc(Cl)cc1 ZINC000025022878 1102616870 /nfs/dbraw/zinc/61/68/70/1102616870.db2.gz BEGAJHIZRWXYIJ-INIZCTEOSA-N 1 1 355.221 4.067 20 5 FIBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)c1ccc(Cl)cc1 ZINC000025022878 1102616871 /nfs/dbraw/zinc/61/68/71/1102616871.db2.gz BEGAJHIZRWXYIJ-INIZCTEOSA-N 1 1 355.221 4.067 20 5 FIBDMO CCOc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OCC)cc1Cl ZINC000551230737 1103003123 /nfs/dbraw/zinc/00/31/23/1103003123.db2.gz CGFVQUDZRHBJSY-UHFFFAOYSA-N 1 1 364.829 4.335 20 5 FIBDMO COc1cc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1OC ZINC000507118891 1103127191 /nfs/dbraw/zinc/12/71/91/1103127191.db2.gz FMRNGCLWSVWVHZ-UHFFFAOYSA-N 1 1 358.438 4.331 20 5 FIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000532744883 1103159661 /nfs/dbraw/zinc/15/96/61/1103159661.db2.gz MQEKTIARXMFDFO-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000532744883 1103159671 /nfs/dbraw/zinc/15/96/71/1103159671.db2.gz MQEKTIARXMFDFO-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO COc1ccc(OC)c(C[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)c1 ZINC000507195940 1103211924 /nfs/dbraw/zinc/21/19/24/1103211924.db2.gz WDJPSTNXWAMSSW-UHFFFAOYSA-N 1 1 356.422 4.085 20 5 FIBDMO COc1ccc(OC)c(C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)c1 ZINC000507195940 1103211931 /nfs/dbraw/zinc/21/19/31/1103211931.db2.gz WDJPSTNXWAMSSW-UHFFFAOYSA-N 1 1 356.422 4.085 20 5 FIBDMO Cn1nccc1-c1ccccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507242788 1103237647 /nfs/dbraw/zinc/23/76/47/1103237647.db2.gz HNTZPTIVJFTRMW-UHFFFAOYSA-N 1 1 362.433 4.160 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@@H]([C@@H](C)O)C3)cc2[N+](=O)[O-])cc1 ZINC000507700953 1103629397 /nfs/dbraw/zinc/62/93/97/1103629397.db2.gz YBUKAKODIWJIAK-NVXWUHKLSA-N 1 1 372.490 4.257 20 5 FIBDMO C[NH+](C)C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000579251586 1104331025 /nfs/dbraw/zinc/33/10/25/1104331025.db2.gz BRFHVIJNDITIEL-MSOLQXFVSA-N 1 1 359.857 4.128 20 5 FIBDMO CCC[N@@H+](CCc1cccs1)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000184512394 1104502465 /nfs/dbraw/zinc/50/24/65/1104502465.db2.gz YXOLUEVWBWHCJX-UHFFFAOYSA-N 1 1 372.450 4.161 20 5 FIBDMO CC[N@H+](C)CCNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000507944282 1105279834 /nfs/dbraw/zinc/27/98/34/1105279834.db2.gz DSAHBNYSQAXDIR-UHFFFAOYSA-N 1 1 363.845 4.082 20 5 FIBDMO CC[N@@H+](C)CCNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000507944282 1105279839 /nfs/dbraw/zinc/27/98/39/1105279839.db2.gz DSAHBNYSQAXDIR-UHFFFAOYSA-N 1 1 363.845 4.082 20 5 FIBDMO C[C@H]([NH2+]Cc1nn(-c2ccccc2)c2c1CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000451102242 1106933042 /nfs/dbraw/zinc/93/30/42/1106933042.db2.gz IPTPMZHVPPSLNM-HNNXBMFYSA-N 1 1 362.433 4.120 20 5 FIBDMO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451543131 1107163557 /nfs/dbraw/zinc/16/35/57/1107163557.db2.gz AYLZMBYVRDHILB-UKRRQHHQSA-N 1 1 361.467 4.138 20 5 FIBDMO CO[C@H](C)c1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451543131 1107163567 /nfs/dbraw/zinc/16/35/67/1107163567.db2.gz AYLZMBYVRDHILB-UKRRQHHQSA-N 1 1 361.467 4.138 20 5 FIBDMO CCCCc1noc([C@@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548489 1107169628 /nfs/dbraw/zinc/16/96/28/1107169628.db2.gz NSMFHUQYSMTGOB-ZBFHGGJFSA-N 1 1 358.442 4.261 20 5 FIBDMO CCCCc1noc([C@@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548489 1107169636 /nfs/dbraw/zinc/16/96/36/1107169636.db2.gz NSMFHUQYSMTGOB-ZBFHGGJFSA-N 1 1 358.442 4.261 20 5 FIBDMO C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1c1cccc(F)c1 ZINC000531104749 1107537098 /nfs/dbraw/zinc/53/70/98/1107537098.db2.gz UYGSNDBOHLYKLA-ORAYPTAESA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1c1cccc(F)c1 ZINC000531104749 1107537107 /nfs/dbraw/zinc/53/71/07/1107537107.db2.gz UYGSNDBOHLYKLA-ORAYPTAESA-N 1 1 372.396 4.184 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CC(N4CCCCC4)C3)s2)cc1 ZINC000475558213 1107731278 /nfs/dbraw/zinc/73/12/78/1107731278.db2.gz DRSOLZDMBFKOSS-UHFFFAOYSA-N 1 1 371.506 4.430 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000531702722 1108084273 /nfs/dbraw/zinc/08/42/73/1108084273.db2.gz OUUSFNKCRVEKOM-YQVWRLOYSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000531702722 1108084288 /nfs/dbraw/zinc/08/42/88/1108084288.db2.gz OUUSFNKCRVEKOM-YQVWRLOYSA-N 1 1 353.466 4.389 20 5 FIBDMO CC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Cl)s1 ZINC000444685059 1108086707 /nfs/dbraw/zinc/08/67/07/1108086707.db2.gz MTGIZNCGDNLKPV-SNVBAGLBSA-N 1 1 350.831 4.427 20 5 FIBDMO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000523444067 1108226606 /nfs/dbraw/zinc/22/66/06/1108226606.db2.gz MSLBKUMCILPVBV-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000523444067 1108226618 /nfs/dbraw/zinc/22/66/18/1108226618.db2.gz MSLBKUMCILPVBV-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO CC(C)c1nnc(C[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000453292889 1108370763 /nfs/dbraw/zinc/37/07/63/1108370763.db2.gz PAMDRFOIBMXYJM-GFCCVEGCSA-N 1 1 371.466 4.416 20 5 FIBDMO C[C@@H](NCc1n[nH]c(C2CC2)n1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000453298024 1108375368 /nfs/dbraw/zinc/37/53/68/1108375368.db2.gz UDVVWFAWVVETEI-LLVKDONJSA-N 1 1 369.450 4.170 20 5 FIBDMO C[C@@H]([NH2+]Cc1nnc(C2CC2)[nH]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000453298024 1108375389 /nfs/dbraw/zinc/37/53/89/1108375389.db2.gz UDVVWFAWVVETEI-LLVKDONJSA-N 1 1 369.450 4.170 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCC[N@@H+]1CCc2ccccc2C1 ZINC000531945370 1108422102 /nfs/dbraw/zinc/42/21/02/1108422102.db2.gz LPZFVNKRRYZWMR-KRWDZBQOSA-N 1 1 353.466 4.002 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cc(Br)ccc1F ZINC000523701990 1108454408 /nfs/dbraw/zinc/45/44/08/1108454408.db2.gz HHEKOMIEMQRQEQ-UHFFFAOYSA-N 1 1 367.218 4.171 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000523841099 1108602915 /nfs/dbraw/zinc/60/29/15/1108602915.db2.gz KRXLKPTZGVUAJP-SFHVURJKSA-N 1 1 360.841 4.429 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000523841099 1108602921 /nfs/dbraw/zinc/60/29/21/1108602921.db2.gz KRXLKPTZGVUAJP-SFHVURJKSA-N 1 1 360.841 4.429 20 5 FIBDMO C[C@H]1SCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000524035664 1108765156 /nfs/dbraw/zinc/76/51/56/1108765156.db2.gz AEPBTNDZKJWZHG-DNVCBOLYSA-N 1 1 358.463 4.152 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H](CO)c1c(Cl)cccc1Cl ZINC000475633958 1108951046 /nfs/dbraw/zinc/95/10/46/1108951046.db2.gz HYGCVPZNCAXMQQ-DRDHIDPGSA-N 1 1 367.232 4.238 20 5 FIBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H](O)C(F)(F)F ZINC000428416078 1108966910 /nfs/dbraw/zinc/96/69/10/1108966910.db2.gz CRZMJEFOFKHSHC-HNNXBMFYSA-N 1 1 374.384 4.068 20 5 FIBDMO CC1(C)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H]1c1ccccc1 ZINC000441076136 1109311357 /nfs/dbraw/zinc/31/13/57/1109311357.db2.gz XLIJQQARLAGFHO-INIZCTEOSA-N 1 1 351.406 4.362 20 5 FIBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000441216438 1109469927 /nfs/dbraw/zinc/46/99/27/1109469927.db2.gz JAKCHHYXNYEMLA-ZDUSSCGKSA-N 1 1 364.829 4.329 20 5 FIBDMO Cc1ccc(C[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)cc1[N+](=O)[O-] ZINC000525696171 1109481387 /nfs/dbraw/zinc/48/13/87/1109481387.db2.gz YANBGZLSZPRVAY-CYBMUJFWSA-N 1 1 353.205 4.433 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000527054952 1109681527 /nfs/dbraw/zinc/68/15/27/1109681527.db2.gz BHTKVTJQTTWVHR-OIQJVACTSA-N 1 1 358.360 4.041 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000527054952 1109681529 /nfs/dbraw/zinc/68/15/29/1109681529.db2.gz BHTKVTJQTTWVHR-OIQJVACTSA-N 1 1 358.360 4.041 20 5 FIBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2nccn21 ZINC000449572348 1110114391 /nfs/dbraw/zinc/11/43/91/1110114391.db2.gz NAJHEMJSHAVGSM-MLGOLLRUSA-N 1 1 354.435 4.315 20 5 FIBDMO Cc1[nH+]ccn1CCCCNc1cc(C)c([N+](=O)[O-])cc1C(F)(F)F ZINC000461944451 1111426155 /nfs/dbraw/zinc/42/61/55/1111426155.db2.gz VKTXXMYMFDTTQW-UHFFFAOYSA-N 1 1 356.348 4.319 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]C2CCN(CCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000552925784 1111851144 /nfs/dbraw/zinc/85/11/44/1111851144.db2.gz JMHSNRJWHVHBRU-SFHVURJKSA-N 1 1 367.493 4.261 20 5 FIBDMO CC[C@@H]([NH2+][C@@H](CN1CCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000480278555 1112370472 /nfs/dbraw/zinc/37/04/72/1112370472.db2.gz PAHYEOBISPWQIK-RTWAWAEBSA-N 1 1 353.466 4.473 20 5 FIBDMO C[C@H](c1cccc(Cl)c1F)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000480767179 1112585933 /nfs/dbraw/zinc/58/59/33/1112585933.db2.gz DLMQKDMVPNPWLU-NEPJUHHUSA-N 1 1 364.808 4.030 20 5 FIBDMO C[C@H](c1cccc(Cl)c1F)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000480767179 1112585939 /nfs/dbraw/zinc/58/59/39/1112585939.db2.gz DLMQKDMVPNPWLU-NEPJUHHUSA-N 1 1 364.808 4.030 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@H](Nc3ccccc3)C2)c1 ZINC000555417057 1112830388 /nfs/dbraw/zinc/83/03/88/1112830388.db2.gz RQFXLPWPNZBVAD-HNNXBMFYSA-N 1 1 365.355 4.300 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](Nc3ccccc3)C2)c1 ZINC000555417057 1112830391 /nfs/dbraw/zinc/83/03/91/1112830391.db2.gz RQFXLPWPNZBVAD-HNNXBMFYSA-N 1 1 365.355 4.300 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCCC(F)(F)CC3)cs2)c1 ZINC000600187852 1112915442 /nfs/dbraw/zinc/91/54/42/1112915442.db2.gz KSBRXBGZGFAQMM-UHFFFAOYSA-N 1 1 353.394 4.340 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCCC(F)(F)CC3)cs2)c1 ZINC000600187852 1112915443 /nfs/dbraw/zinc/91/54/43/1112915443.db2.gz KSBRXBGZGFAQMM-UHFFFAOYSA-N 1 1 353.394 4.340 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482697822 1113334568 /nfs/dbraw/zinc/33/45/68/1113334568.db2.gz WJYGMSIRVVESSF-HUUCEWRRSA-N 1 1 350.422 4.158 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c2c(c1)COCO2 ZINC000111306885 1113348875 /nfs/dbraw/zinc/34/88/75/1113348875.db2.gz KNSHXKUFNQWIHP-AWEZNQCLSA-N 1 1 374.824 4.104 20 5 FIBDMO COc1cc(C[N@H+](C)Cc2ccccc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000027349141 1113599360 /nfs/dbraw/zinc/59/93/60/1113599360.db2.gz JOFVWIZVWQNANO-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2ccccc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000027349141 1113599362 /nfs/dbraw/zinc/59/93/62/1113599362.db2.gz JOFVWIZVWQNANO-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO C[C@@H](c1ccc(F)cc1)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000027557517 1113698439 /nfs/dbraw/zinc/69/84/39/1113698439.db2.gz AFMXOWKFHYIMBD-NSHDSACASA-N 1 1 365.792 4.019 20 5 FIBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000027557517 1113698444 /nfs/dbraw/zinc/69/84/44/1113698444.db2.gz AFMXOWKFHYIMBD-NSHDSACASA-N 1 1 365.792 4.019 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000150324577 1113900695 /nfs/dbraw/zinc/90/06/95/1113900695.db2.gz HBEWCYLRMDZNEI-CQSZACIVSA-N 1 1 359.401 4.064 20 5 FIBDMO Cc1ccc([C@H]2C[C@@H](C)[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000490077283 1114214217 /nfs/dbraw/zinc/21/42/17/1114214217.db2.gz DIOOLVVACPLTBJ-ZBFHGGJFSA-N 1 1 351.406 4.422 20 5 FIBDMO C[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)[C@H]1CCc2ccccc21 ZINC000029312874 1114278458 /nfs/dbraw/zinc/27/84/58/1114278458.db2.gz MSUQMAAJIHTWRP-HNNXBMFYSA-N 1 1 355.419 4.449 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OCC(F)F ZINC000491095628 1114373336 /nfs/dbraw/zinc/37/33/36/1114373336.db2.gz ZUODJRRRWWCVLY-GXTWGEPZSA-N 1 1 370.396 4.012 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000164377513 1114476177 /nfs/dbraw/zinc/47/61/77/1114476177.db2.gz MDWQJJXDOXKJGX-IBGZPJMESA-N 1 1 353.422 4.069 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cn2c3cc([N+](=O)[O-])ccc3oc2=S)n1 ZINC000164831204 1114591247 /nfs/dbraw/zinc/59/12/47/1114591247.db2.gz RANGRODESDGHJY-HNNXBMFYSA-N 1 1 370.434 4.370 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cn2c3cc([N+](=O)[O-])ccc3oc2=S)n1 ZINC000164831204 1114591250 /nfs/dbraw/zinc/59/12/50/1114591250.db2.gz RANGRODESDGHJY-HNNXBMFYSA-N 1 1 370.434 4.370 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2ccccn2)C1 ZINC000590599965 1114952257 /nfs/dbraw/zinc/95/22/57/1114952257.db2.gz HSHJYEKTHYESHK-INIZCTEOSA-N 1 1 355.438 4.157 20 5 FIBDMO Cc1ccc2nc(C[NH2+][C@@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)cn2c1 ZINC000573029494 1115000933 /nfs/dbraw/zinc/00/09/33/1115000933.db2.gz GCIJETQHSSCZAE-GOSISDBHSA-N 1 1 350.422 4.063 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000573046423 1115003225 /nfs/dbraw/zinc/00/32/25/1115003225.db2.gz ZLBDKVFQWRUARH-SJORKVTESA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2c(c1)OCO2)C1CCCC1 ZINC000045841492 1115094851 /nfs/dbraw/zinc/09/48/51/1115094851.db2.gz NCWLGSIRDZFGJC-UHFFFAOYSA-N 1 1 354.406 4.268 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CCC(CO)CC1 ZINC000573727459 1115178756 /nfs/dbraw/zinc/17/87/56/1115178756.db2.gz SKFYIPSQCPUZOY-UHFFFAOYSA-N 1 1 360.479 4.306 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccc(F)c1)[C@H]1CC[C@H](O)CC1 ZINC000592130351 1115204700 /nfs/dbraw/zinc/20/47/00/1115204700.db2.gz DSUXWOFIWFGZQA-WGSAOQKQSA-N 1 1 358.413 4.040 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H](c2ccccc2)C2(CO)CC=CC2)c(F)c1 ZINC000592178136 1115216671 /nfs/dbraw/zinc/21/66/71/1115216671.db2.gz XNLDCRVYBUEZCD-LJQANCHMSA-N 1 1 374.387 4.033 20 5 FIBDMO COc1cc(C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C2CC2)ccc1O ZINC000760992283 1115258443 /nfs/dbraw/zinc/25/84/43/1115258443.db2.gz JARVPNMFDKLFSV-UHFFFAOYSA-N 1 1 362.813 4.127 20 5 FIBDMO COc1cc(C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C2CC2)ccc1O ZINC000760992283 1115258444 /nfs/dbraw/zinc/25/84/44/1115258444.db2.gz JARVPNMFDKLFSV-UHFFFAOYSA-N 1 1 362.813 4.127 20 5 FIBDMO CC(C)[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1F ZINC000594968759 1115499448 /nfs/dbraw/zinc/49/94/48/1115499448.db2.gz KBOHCDKKYPGYGM-SFHVURJKSA-N 1 1 360.385 4.087 20 5 FIBDMO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595003565 1115506467 /nfs/dbraw/zinc/50/64/67/1115506467.db2.gz IMYQVEQRWPVJMA-STQMWFEESA-N 1 1 360.410 4.032 20 5 FIBDMO CCOc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)CCO2 ZINC000595031677 1115510166 /nfs/dbraw/zinc/51/01/66/1115510166.db2.gz BJMFZCOWVMYHFG-FZKQIMNGSA-N 1 1 372.421 4.177 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](c2ccccc2F)C(C)C)c1 ZINC000595686755 1115556857 /nfs/dbraw/zinc/55/68/57/1115556857.db2.gz BFDINVPCUUYTPP-SFHVURJKSA-N 1 1 360.385 4.007 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c(F)c1 ZINC000593123948 1115563713 /nfs/dbraw/zinc/56/37/13/1115563713.db2.gz IRSNOZPJFAKBKE-UFYCRDLUSA-N 1 1 356.397 4.229 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c(F)c1 ZINC000593123948 1115563716 /nfs/dbraw/zinc/56/37/16/1115563716.db2.gz IRSNOZPJFAKBKE-UFYCRDLUSA-N 1 1 356.397 4.229 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1)C(C)C ZINC000060350592 1115621499 /nfs/dbraw/zinc/62/14/99/1115621499.db2.gz XXJLEZDGKSHVPH-UHFFFAOYSA-N 1 1 367.449 4.028 20 5 FIBDMO CC[N@@H+](CCCNC(=O)c1c(Cl)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000593251787 1115631564 /nfs/dbraw/zinc/63/15/64/1115631564.db2.gz UJLZKHTWCWJAGQ-UHFFFAOYSA-N 1 1 367.877 4.023 20 5 FIBDMO Cc1ncc([C@@H](C)[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)s1 ZINC000602734782 1115721977 /nfs/dbraw/zinc/72/19/77/1115721977.db2.gz JKRZNVFRISILEL-ZCFIWIBFSA-N 1 1 362.274 4.035 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1nc2ccccc2n1C(F)F ZINC000603421446 1115772221 /nfs/dbraw/zinc/77/22/21/1115772221.db2.gz DOCKGOBPXGMYLP-LBPRGKRZSA-N 1 1 360.364 4.499 20 5 FIBDMO CN(C)C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(Cl)c1 ZINC000598998949 1115775802 /nfs/dbraw/zinc/77/58/02/1115775802.db2.gz ZJSAJPKHFWFAJX-QGZVFWFLSA-N 1 1 368.264 4.294 20 5 FIBDMO CC(C)O[C@@H]1CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000593660833 1115776111 /nfs/dbraw/zinc/77/61/11/1115776111.db2.gz SKXYWJPWRGQXNY-QGZVFWFLSA-N 1 1 361.467 4.108 20 5 FIBDMO CC(C)O[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000593660833 1115776113 /nfs/dbraw/zinc/77/61/13/1115776113.db2.gz SKXYWJPWRGQXNY-QGZVFWFLSA-N 1 1 361.467 4.108 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](CCO)c2cc(Cl)cc(Cl)c2)c(F)c1 ZINC000599013069 1115778881 /nfs/dbraw/zinc/77/88/81/1115778881.db2.gz JCXBHNAZHKFLJK-INIZCTEOSA-N 1 1 373.211 4.254 20 5 FIBDMO Cc1c(C[N@H+](C)Cc2ccccc2OC(F)(F)F)cccc1[N+](=O)[O-] ZINC000603841029 1115820034 /nfs/dbraw/zinc/82/00/34/1115820034.db2.gz SQYUWCBKHUHIOW-UHFFFAOYSA-N 1 1 354.328 4.434 20 5 FIBDMO Cc1c(C[N@@H+](C)Cc2ccccc2OC(F)(F)F)cccc1[N+](=O)[O-] ZINC000603841029 1115820039 /nfs/dbraw/zinc/82/00/39/1115820039.db2.gz SQYUWCBKHUHIOW-UHFFFAOYSA-N 1 1 354.328 4.434 20 5 FIBDMO C[C@@H](C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000599633221 1115832501 /nfs/dbraw/zinc/83/25/01/1115832501.db2.gz OFVJRMROLDMXSC-AWEZNQCLSA-N 1 1 358.442 4.293 20 5 FIBDMO C[N@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000604506836 1115868349 /nfs/dbraw/zinc/86/83/49/1115868349.db2.gz PITNSEVEEIEICY-QGZVFWFLSA-N 1 1 365.355 4.107 20 5 FIBDMO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000604501381 1115868411 /nfs/dbraw/zinc/86/84/11/1115868411.db2.gz AMTUGVWQAIPWNU-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000604501381 1115868415 /nfs/dbraw/zinc/86/84/15/1115868415.db2.gz AMTUGVWQAIPWNU-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]3CC3CCCC3)o2)cc1 ZINC000594052353 1115979512 /nfs/dbraw/zinc/97/95/12/1115979512.db2.gz FBZMMIHLLUYOCJ-QGZVFWFLSA-N 1 1 356.426 4.190 20 5 FIBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000609063559 1116176812 /nfs/dbraw/zinc/17/68/12/1116176812.db2.gz ODMPWSZLSQSDNM-UHFFFAOYSA-N 1 1 353.422 4.209 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCS[C@H]4CCCC[C@@H]43)co2)cc1 ZINC000089909229 1116352263 /nfs/dbraw/zinc/35/22/63/1116352263.db2.gz AKORIOXFAPTPML-IRXDYDNUSA-N 1 1 359.451 4.110 20 5 FIBDMO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+](C)Cc1ccccc1 ZINC000462841408 1117799564 /nfs/dbraw/zinc/79/95/64/1117799564.db2.gz PDYROLGLIGRKQT-CYBMUJFWSA-N 1 1 365.380 4.129 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@](CO)(Cc3ccccc3)C2)c(Cl)c1 ZINC000463032425 1117935834 /nfs/dbraw/zinc/93/58/34/1117935834.db2.gz GVJZIUIRYCSRLF-HXUWFJFHSA-N 1 1 374.868 4.065 20 5 FIBDMO Cc1cnc(NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)c([N+](=O)[O-])c1 ZINC000463047192 1117939324 /nfs/dbraw/zinc/93/93/24/1117939324.db2.gz CKXHBELNHOAZKT-INIZCTEOSA-N 1 1 354.454 4.285 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)ccc1OC(F)F ZINC000541773693 1118645369 /nfs/dbraw/zinc/64/53/69/1118645369.db2.gz ILOADMUKKFGKHU-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@H](C)C[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000464849743 1118722289 /nfs/dbraw/zinc/72/22/89/1118722289.db2.gz IHBZLVCYRBGHFR-HOCLYGCPSA-N 1 1 360.410 4.048 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(CCc2ccc(O)cc2)CC1 ZINC000609144015 1118736435 /nfs/dbraw/zinc/73/64/35/1118736435.db2.gz SJCKNJVREZMBKS-UHFFFAOYSA-N 1 1 358.413 4.284 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@H+](C)Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000031006326 1119211160 /nfs/dbraw/zinc/21/11/60/1119211160.db2.gz VJDVRBUUXXDYKY-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000031006326 1119211165 /nfs/dbraw/zinc/21/11/65/1119211165.db2.gz VJDVRBUUXXDYKY-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO O=[N+]([O-])c1c(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc2ncccc21 ZINC000312139539 1119406641 /nfs/dbraw/zinc/40/66/41/1119406641.db2.gz VPKRJIYDHOPPOK-KRWDZBQOSA-N 1 1 362.433 4.220 20 5 FIBDMO O=[N+]([O-])c1ccc(CNC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000761524175 1119407334 /nfs/dbraw/zinc/40/73/34/1119407334.db2.gz WUYIQIZZAJZJCF-SFHVURJKSA-N 1 1 373.884 4.250 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000761524175 1119407337 /nfs/dbraw/zinc/40/73/37/1119407337.db2.gz WUYIQIZZAJZJCF-SFHVURJKSA-N 1 1 373.884 4.250 20 5 FIBDMO CC[NH+](CC)Cc1ccc(CNCc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000761520411 1119409317 /nfs/dbraw/zinc/40/93/17/1119409317.db2.gz FEFRLLNVPIUDLA-UHFFFAOYSA-N 1 1 361.873 4.380 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000761528650 1119410512 /nfs/dbraw/zinc/41/05/12/1119410512.db2.gz ZMBKIOPHARWJSD-UHFFFAOYSA-N 1 1 356.165 4.100 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000493904784 1119504452 /nfs/dbraw/zinc/50/44/52/1119504452.db2.gz FHGUCKHRLIUZII-RDJZCZTQSA-N 1 1 368.767 4.146 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cn3cc(Cl)ccc3n2)cc1[N+](=O)[O-] ZINC000152805935 1119506046 /nfs/dbraw/zinc/50/60/46/1119506046.db2.gz CUDKTAHYFALVJH-LBPRGKRZSA-N 1 1 374.828 4.145 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000494103801 1119543025 /nfs/dbraw/zinc/54/30/25/1119543025.db2.gz ADTRISGHSLLBSC-UHFFFAOYSA-N 1 1 360.841 4.429 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000494174766 1119550982 /nfs/dbraw/zinc/55/09/82/1119550982.db2.gz BZIGUJJOORPCKI-UHFFFAOYSA-N 1 1 353.894 4.192 20 5 FIBDMO CCc1ccc([C@H]([NH2+]CCc2cscn2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542475810 1119600267 /nfs/dbraw/zinc/60/02/67/1119600267.db2.gz KBMUDDLFUAFVSZ-GOSISDBHSA-N 1 1 357.435 4.128 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494275415 1119811757 /nfs/dbraw/zinc/81/17/57/1119811757.db2.gz ZJSKHRUGHCUYJR-JQIJEIRASA-N 1 1 367.449 4.267 20 5 FIBDMO CCc1cccnc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494445439 1119862779 /nfs/dbraw/zinc/86/27/79/1119862779.db2.gz JFAHABKDUYWGLT-NSHDSACASA-N 1 1 353.344 4.422 20 5 FIBDMO CCC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(C)cc1 ZINC000027227806 1120781598 /nfs/dbraw/zinc/78/15/98/1120781598.db2.gz ZFXAPTHQUWGUSA-UHFFFAOYSA-N 1 1 366.421 4.365 20 5 FIBDMO CCC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(C)cc1 ZINC000027227806 1120781601 /nfs/dbraw/zinc/78/16/01/1120781601.db2.gz ZFXAPTHQUWGUSA-UHFFFAOYSA-N 1 1 366.421 4.365 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](CCOC)c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000495425621 1120801168 /nfs/dbraw/zinc/80/11/68/1120801168.db2.gz DEPZTSGYQVUMFV-ZBFHGGJFSA-N 1 1 362.426 4.323 20 5 FIBDMO C[N@@H+](CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CCCC1 ZINC000609223701 1121001713 /nfs/dbraw/zinc/00/17/13/1121001713.db2.gz IEOJRPWOFZHASY-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO CN(CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CCCC1 ZINC000609223701 1121001719 /nfs/dbraw/zinc/00/17/19/1121001719.db2.gz IEOJRPWOFZHASY-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO CC[C@@H](c1ccncc1)[N@H+](CC)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000131498320 1121701232 /nfs/dbraw/zinc/70/12/32/1121701232.db2.gz JRUCTNONDSRPPI-FQEVSTJZSA-N 1 1 365.437 4.284 20 5 FIBDMO CC[C@@H](c1ccncc1)[N@@H+](CC)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000131498320 1121701236 /nfs/dbraw/zinc/70/12/36/1121701236.db2.gz JRUCTNONDSRPPI-FQEVSTJZSA-N 1 1 365.437 4.284 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccc(Br)s1 ZINC000084439800 1121797387 /nfs/dbraw/zinc/79/73/87/1121797387.db2.gz WPPLIEXDIBCUAL-UHFFFAOYSA-N 1 1 361.648 4.362 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(Cl)cc1Br ZINC000126556485 1121965161 /nfs/dbraw/zinc/96/51/61/1121965161.db2.gz CXANRCRQRSMHGF-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2c[nH]nc2-c2cccs2)C2CC2)cc1 ZINC000154257063 1122010075 /nfs/dbraw/zinc/01/00/75/1122010075.db2.gz UEYKIOXYKLJIOO-UHFFFAOYSA-N 1 1 354.435 4.211 20 5 FIBDMO C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000301544735 1122218335 /nfs/dbraw/zinc/21/83/35/1122218335.db2.gz OPADDSUAMSUSOR-DZGCQCFKSA-N 1 1 360.845 4.108 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H](C)c3ccncc3)o2)c([N+](=O)[O-])c1 ZINC000542693427 1122290234 /nfs/dbraw/zinc/29/02/34/1122290234.db2.gz ZMXJHMVIWSAISU-CQSZACIVSA-N 1 1 367.405 4.451 20 5 FIBDMO C[C@H](C1CC1)[N@H+](Cc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917437969 1122303987 /nfs/dbraw/zinc/30/39/87/1122303987.db2.gz QJKYQUMRZDTDIT-OAHLLOKOSA-N 1 1 350.422 4.203 20 5 FIBDMO C[N@@H+](Cc1csc2ccccc12)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917455566 1122320160 /nfs/dbraw/zinc/32/01/60/1122320160.db2.gz XSTNPANZKDHWFL-UHFFFAOYSA-N 1 1 352.419 4.249 20 5 FIBDMO C[N@H+](Cc1csc2ccccc12)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917455566 1122320163 /nfs/dbraw/zinc/32/01/63/1122320163.db2.gz XSTNPANZKDHWFL-UHFFFAOYSA-N 1 1 352.419 4.249 20 5 FIBDMO C[N@@H+](Cc1cccc2ccccc21)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000917470094 1122328290 /nfs/dbraw/zinc/32/82/90/1122328290.db2.gz MRSSSWOODSALMM-UHFFFAOYSA-N 1 1 373.416 4.096 20 5 FIBDMO C[N@H+](Cc1cccc2ccccc21)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000917470094 1122328296 /nfs/dbraw/zinc/32/82/96/1122328296.db2.gz MRSSSWOODSALMM-UHFFFAOYSA-N 1 1 373.416 4.096 20 5 FIBDMO Cc1ccccc1C[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000007680839 1122692187 /nfs/dbraw/zinc/69/21/87/1122692187.db2.gz ITHPILZMQJHAFH-CQSZACIVSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccccc1C[N@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000007680839 1122692189 /nfs/dbraw/zinc/69/21/89/1122692189.db2.gz ITHPILZMQJHAFH-CQSZACIVSA-N 1 1 352.394 4.146 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C3(c4ccccc4)CC3)cs2)c1 ZINC000609600791 1123764887 /nfs/dbraw/zinc/76/48/87/1123764887.db2.gz UQJXJQJNUPMSNV-UHFFFAOYSA-N 1 1 351.431 4.497 20 5 FIBDMO Cn1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(-c2ccccc2)n1 ZINC000179695318 1124031931 /nfs/dbraw/zinc/03/19/31/1124031931.db2.gz RXNDUTYPXKEHHQ-UHFFFAOYSA-N 1 1 362.433 4.160 20 5 FIBDMO CN1Cc2ccccc2[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000542776808 1124257021 /nfs/dbraw/zinc/25/70/21/1124257021.db2.gz JONINFBGUWVVJT-PKTZIBPZSA-N 1 1 373.456 4.461 20 5 FIBDMO COC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000091414005 1124384713 /nfs/dbraw/zinc/38/47/13/1124384713.db2.gz UEONOKWEUNLJMW-PXAZEXFGSA-N 1 1 350.365 4.220 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462789373 1124516747 /nfs/dbraw/zinc/51/67/47/1124516747.db2.gz IYHHYHFNRIRRKV-CYBMUJFWSA-N 1 1 357.401 4.263 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301747237 1125194412 /nfs/dbraw/zinc/19/44/12/1125194412.db2.gz QRNLPMULSQZVRL-AWEZNQCLSA-N 1 1 366.893 4.124 20 5 FIBDMO C[C@H](N[C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311820350 1125228536 /nfs/dbraw/zinc/22/85/36/1125228536.db2.gz NDAOMRMOJOKZFD-ZWOKBUDYSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H](N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311820350 1125228538 /nfs/dbraw/zinc/22/85/38/1125228538.db2.gz NDAOMRMOJOKZFD-ZWOKBUDYSA-N 1 1 353.466 4.156 20 5 FIBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)c1ccc(F)cc1 ZINC000053087911 205190274 /nfs/dbraw/zinc/19/02/74/205190274.db2.gz CFZTUIGKLDILOR-CQSZACIVSA-N 1 1 359.401 4.064 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)c1ccc(F)cc1 ZINC000053087911 205190279 /nfs/dbraw/zinc/19/02/79/205190279.db2.gz CFZTUIGKLDILOR-CQSZACIVSA-N 1 1 359.401 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccccc1 ZINC000109093823 206044804 /nfs/dbraw/zinc/04/48/04/206044804.db2.gz CBHCQRPJEZVLOA-IBGZPJMESA-N 1 1 353.422 4.069 20 5 FIBDMO COc1ccc(C[N@H+]2CCCCC[C@@H]2c2c(C)n[nH]c2C)cc1[N+](=O)[O-] ZINC000568918239 568252125 /nfs/dbraw/zinc/25/21/25/568252125.db2.gz WJNXOBRQBMHHRR-MRXNPFEDSA-N 1 1 358.442 4.061 20 5 FIBDMO CCCc1nc(C)c(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)o1 ZINC000291704664 568270206 /nfs/dbraw/zinc/27/02/06/568270206.db2.gz KNFGALVFLCDVMK-UHFFFAOYSA-N 1 1 355.394 4.394 20 5 FIBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541998953 568378334 /nfs/dbraw/zinc/37/83/34/568378334.db2.gz JJWSCOLIJQJFOK-CYBMUJFWSA-N 1 1 368.861 4.192 20 5 FIBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541998953 568378335 /nfs/dbraw/zinc/37/83/35/568378335.db2.gz JJWSCOLIJQJFOK-CYBMUJFWSA-N 1 1 368.861 4.192 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCCC[C@@H]3c3cc[nH]n3)o2)cc1 ZINC000569392321 568400254 /nfs/dbraw/zinc/40/02/54/568400254.db2.gz DVAPUNOCBADFHQ-GOSISDBHSA-N 1 1 352.394 4.305 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCC[C@@H]3c3cc[nH]n3)o2)cc1 ZINC000569392321 568400255 /nfs/dbraw/zinc/40/02/55/568400255.db2.gz DVAPUNOCBADFHQ-GOSISDBHSA-N 1 1 352.394 4.305 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000569629790 568411109 /nfs/dbraw/zinc/41/11/09/568411109.db2.gz IQQPPOSSOZMKEZ-YZGWKJHDSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000569629790 568411114 /nfs/dbraw/zinc/41/11/14/568411114.db2.gz IQQPPOSSOZMKEZ-YZGWKJHDSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000569629790 568411115 /nfs/dbraw/zinc/41/11/15/568411115.db2.gz IQQPPOSSOZMKEZ-YZGWKJHDSA-N 1 1 365.477 4.110 20 5 FIBDMO COCCCC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000619292268 1125557450 /nfs/dbraw/zinc/55/74/50/1125557450.db2.gz SNRMQJSASRNAFA-QGZVFWFLSA-N 1 1 369.421 4.384 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000619722716 1125668689 /nfs/dbraw/zinc/66/86/89/1125668689.db2.gz UZGNKHJUQRPEIQ-CVEARBPZSA-N 1 1 354.454 4.068 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+](C)CCCCc2ccccc2)cccc1[N+](=O)[O-] ZINC001167053803 1079700796 /nfs/dbraw/zinc/70/07/96/1079700796.db2.gz ABCFTPBRPKBMHH-UHFFFAOYSA-N 1 1 369.465 4.187 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)o2)c1 ZINC000535808671 1079791612 /nfs/dbraw/zinc/79/16/12/1079791612.db2.gz QYXFMRVFTSDHBS-IAGOWNOFSA-N 1 1 356.422 4.103 20 5 FIBDMO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccccc1OC(F)F ZINC000430218245 1080004233 /nfs/dbraw/zinc/00/42/33/1080004233.db2.gz JCAWPKNNUPUZGQ-HNNXBMFYSA-N 1 1 366.364 4.446 20 5 FIBDMO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1F ZINC000127117957 1080476949 /nfs/dbraw/zinc/47/69/49/1080476949.db2.gz VSUKCRYZPNPTSB-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO C[N@@H+](Cc1ccco1)Cc1ccccc1CNc1ccc([N+](=O)[O-])s1 ZINC000078335895 1080488073 /nfs/dbraw/zinc/48/80/73/1080488073.db2.gz BBJISPBAUHGDND-UHFFFAOYSA-N 1 1 357.435 4.493 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](CCc3cccc(F)c3)C3CC3)nc2c1 ZINC000083173138 1080561741 /nfs/dbraw/zinc/56/17/41/1080561741.db2.gz AXDGQRLWWQALTI-UHFFFAOYSA-N 1 1 355.369 4.082 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](CSc4ccccc4)C3)nc2c1 ZINC000177161279 1081198800 /nfs/dbraw/zinc/19/88/00/1081198800.db2.gz HXMHHJKYTBVAJD-CQSZACIVSA-N 1 1 369.446 4.350 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3Cc3cccc(F)c3)nc2c1 ZINC000083168764 1081267034 /nfs/dbraw/zinc/26/70/34/1081267034.db2.gz MQTNJEPZQLCTPT-HNNXBMFYSA-N 1 1 355.369 4.082 20 5 FIBDMO CC(C)(C)C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC001167356989 1081619998 /nfs/dbraw/zinc/61/99/98/1081619998.db2.gz PZAZKKUDFIULSC-UHFFFAOYSA-N 1 1 355.438 4.082 20 5 FIBDMO Cc1cc(C)c(NC(=O)CCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000177887786 1082278161 /nfs/dbraw/zinc/27/81/61/1082278161.db2.gz ASLUJJKOWMYELG-UHFFFAOYSA-N 1 1 369.465 4.371 20 5 FIBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H]1C[C@H](OCC)C1(C)C ZINC001167446673 1082318933 /nfs/dbraw/zinc/31/89/33/1082318933.db2.gz BZYNZUXGVNVJMS-ROUUACIJSA-N 1 1 350.459 4.019 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132249 1082734903 /nfs/dbraw/zinc/73/49/03/1082734903.db2.gz VEZKWMBZQUUUKT-PZJWPPBQSA-N 1 1 354.450 4.237 20 5 FIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051131993 1082735735 /nfs/dbraw/zinc/73/57/35/1082735735.db2.gz COUNAAVZKVLLTD-GHTZIAJQSA-N 1 1 370.449 4.073 20 5 FIBDMO Cc1ccc([C@H]2CCCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC001167482243 1082878505 /nfs/dbraw/zinc/87/85/05/1082878505.db2.gz HPFAXDCIPIUWAC-LJQANCHMSA-N 1 1 367.449 4.459 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)s1 ZINC000535799215 1083675073 /nfs/dbraw/zinc/67/50/73/1083675073.db2.gz HAEWTTXBRLNZOP-YOEHRIQHSA-N 1 1 358.463 4.324 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC(C)=C(c3ccco3)C2)cccc1[N+](=O)[O-] ZINC000548930865 1083792726 /nfs/dbraw/zinc/79/27/26/1083792726.db2.gz UYUYDOAEKUQUPY-UHFFFAOYSA-N 1 1 369.421 4.004 20 5 FIBDMO CC[N@@H+](CCc1nccs1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000180026966 1084065338 /nfs/dbraw/zinc/06/53/38/1084065338.db2.gz VMEFXPCNNDMMDA-UHFFFAOYSA-N 1 1 357.435 4.376 20 5 FIBDMO Cc1ccc(C(C)(C)C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC001167505503 1084198456 /nfs/dbraw/zinc/19/84/56/1084198456.db2.gz SZNRMWPVRPNQBL-UHFFFAOYSA-N 1 1 352.438 4.189 20 5 FIBDMO CCC[N@@H+](Cc1ccc(C)cc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000611565455 1084229636 /nfs/dbraw/zinc/22/96/36/1084229636.db2.gz GRYNNGLOIWCKNL-UHFFFAOYSA-N 1 1 356.422 4.182 20 5 FIBDMO C[C@@H]1[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCC12CCOCC2 ZINC000580290954 1084404070 /nfs/dbraw/zinc/40/40/70/1084404070.db2.gz UFDUWNWDOSHJFQ-LBPRGKRZSA-N 1 1 358.360 4.005 20 5 FIBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+](Cc4ccc([N+](=O)[O-])cc4F)C3)nc2c1 ZINC000539247585 1084434166 /nfs/dbraw/zinc/43/41/66/1084434166.db2.gz IDUPLAURYWXVAO-OAHLLOKOSA-N 1 1 368.412 4.298 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@H+](Cc4ccc([N+](=O)[O-])cc4F)C3)[nH]c2c1 ZINC000539247585 1084434176 /nfs/dbraw/zinc/43/41/76/1084434176.db2.gz IDUPLAURYWXVAO-OAHLLOKOSA-N 1 1 368.412 4.298 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@@H+](Cc4ccc([N+](=O)[O-])cc4F)C3)[nH]c2c1 ZINC000539247585 1084434188 /nfs/dbraw/zinc/43/41/88/1084434188.db2.gz IDUPLAURYWXVAO-OAHLLOKOSA-N 1 1 368.412 4.298 20 5 FIBDMO Cc1ccc(C[NH2+]Cc2cc(F)c(C(F)(F)F)cc2F)cc1[N+](=O)[O-] ZINC000581511255 1084563764 /nfs/dbraw/zinc/56/37/64/1084563764.db2.gz DRRJBMTWDXALLY-UHFFFAOYSA-N 1 1 360.282 4.490 20 5 FIBDMO COc1cc(N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000381226684 1084638053 /nfs/dbraw/zinc/63/80/53/1084638053.db2.gz XGCRAGMZDYOZJN-HOCLYGCPSA-N 1 1 373.428 4.065 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)s1 ZINC000551565888 1084679907 /nfs/dbraw/zinc/67/99/07/1084679907.db2.gz XOAVVAXNHITLAS-MSOLQXFVSA-N 1 1 358.463 4.467 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)ccc1OC(F)F ZINC000051472264 1084708692 /nfs/dbraw/zinc/70/86/92/1084708692.db2.gz FSUKPMXUXIMJIZ-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO CCc1ccc([C@@H](NCC[C@@H]2CCC[N@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000414178955 1084744404 /nfs/dbraw/zinc/74/44/04/1084744404.db2.gz KNJKWGUZCHQFIS-KKSFZXQISA-N 1 1 371.481 4.161 20 5 FIBDMO CCc1ccc([C@@H](NCC[C@@H]2CCC[N@@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000414178955 1084744415 /nfs/dbraw/zinc/74/44/15/1084744415.db2.gz KNJKWGUZCHQFIS-KKSFZXQISA-N 1 1 371.481 4.161 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+]Cc2ccc(CO)c(F)c2)c2ccccc2)c1 ZINC000180219952 1084907082 /nfs/dbraw/zinc/90/70/82/1084907082.db2.gz JDFFWKHDMYJJKJ-NRFANRHFSA-N 1 1 366.392 4.105 20 5 FIBDMO Cc1c(C[NH2+][C@@H](C)c2nc3ccc(Cl)cc3n2C)cccc1[N+](=O)[O-] ZINC000478498855 1084954966 /nfs/dbraw/zinc/95/49/66/1084954966.db2.gz PGAGVWMTBFUIMH-LBPRGKRZSA-N 1 1 358.829 4.294 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H]2[C@@H]3CC[C@@H](C3)[C@@]2(C)C1 ZINC000452044522 1085052707 /nfs/dbraw/zinc/05/27/07/1085052707.db2.gz JCAXLKYKWSTQGN-SISWJWMXSA-N 1 1 368.437 4.074 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c(Br)c1 ZINC001167593763 1085309503 /nfs/dbraw/zinc/30/95/03/1085309503.db2.gz DCMDMQJKJCMONI-OAHLLOKOSA-N 1 1 361.239 4.174 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]2Cc2ccccc2)c(Br)c1 ZINC001167593763 1085309514 /nfs/dbraw/zinc/30/95/14/1085309514.db2.gz DCMDMQJKJCMONI-OAHLLOKOSA-N 1 1 361.239 4.174 20 5 FIBDMO Cc1cc(N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549523605 1085327299 /nfs/dbraw/zinc/32/72/99/1085327299.db2.gz BIEYNNQGPYUEIO-AWEZNQCLSA-N 1 1 371.403 4.090 20 5 FIBDMO COc1ccc(C(=O)C2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000075595981 1085532933 /nfs/dbraw/zinc/53/29/33/1085532933.db2.gz KYGDBBCQDDICTP-HNNXBMFYSA-N 1 1 368.433 4.259 20 5 FIBDMO C[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])cc2Cl)[C@@H]1c1cccs1 ZINC000078338212 1085713343 /nfs/dbraw/zinc/71/33/43/1085713343.db2.gz IPYMRDOBTIYYNS-IAQYHMDHSA-N 1 1 366.874 4.200 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc(C)ccc1OC(F)F ZINC000178728827 1085966806 /nfs/dbraw/zinc/96/68/06/1085966806.db2.gz VFIYSXBCPFWPNS-LBPRGKRZSA-N 1 1 366.364 4.364 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(SC)c(OC)c1 ZINC000178730037 1085967537 /nfs/dbraw/zinc/96/75/37/1085967537.db2.gz HSRKLYPNFPONRM-GFCCVEGCSA-N 1 1 362.451 4.185 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H](c3nccs3)C2)c1 ZINC000092789010 1085980361 /nfs/dbraw/zinc/98/03/61/1085980361.db2.gz MXSXJWUPFLCKPD-LLVKDONJSA-N 1 1 369.393 4.032 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCC[C@@H](c3nccs3)C2)c1 ZINC000092789010 1085980367 /nfs/dbraw/zinc/98/03/67/1085980367.db2.gz MXSXJWUPFLCKPD-LLVKDONJSA-N 1 1 369.393 4.032 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCc3ccccc3[C@@H]2C(C)C)c1 ZINC001167656646 1086311872 /nfs/dbraw/zinc/31/18/72/1086311872.db2.gz MXJYABHFCKFAGI-FQEVSTJZSA-N 1 1 368.433 4.137 20 5 FIBDMO Cc1nc2ccccc2n1C[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000535963204 1086414576 /nfs/dbraw/zinc/41/45/76/1086414576.db2.gz KBCCVYAFUINRKT-GOSISDBHSA-N 1 1 364.449 4.226 20 5 FIBDMO CC[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nnc2n1CCCCC2 ZINC000278873788 1086503437 /nfs/dbraw/zinc/50/34/37/1086503437.db2.gz XHZLARAHZYNKNR-MSOLQXFVSA-N 1 1 369.469 4.031 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000110125607 1086509755 /nfs/dbraw/zinc/50/97/55/1086509755.db2.gz XYXQQRQHGVSLNZ-INIZCTEOSA-N 1 1 369.465 4.316 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+](C)C(C)(C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000585754324 1086686882 /nfs/dbraw/zinc/68/68/82/1086686882.db2.gz HOSSCFWMGFXGKQ-UHFFFAOYSA-N 1 1 355.438 4.099 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765562 1086693164 /nfs/dbraw/zinc/69/31/64/1086693164.db2.gz RNNWBZBGSAJIKR-QFBILLFUSA-N 1 1 364.449 4.015 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765561 1086693383 /nfs/dbraw/zinc/69/33/83/1086693383.db2.gz RNNWBZBGSAJIKR-LPHOPBHVSA-N 1 1 364.449 4.015 20 5 FIBDMO COc1cc(C[N@@H+](C)C2CCCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000585767585 1086695610 /nfs/dbraw/zinc/69/56/10/1086695610.db2.gz CWQMLFBWUDIHFR-UHFFFAOYSA-N 1 1 358.385 4.359 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ncc([N+](=O)[O-])cc2Cl)cc1 ZINC000080914839 1087282456 /nfs/dbraw/zinc/28/24/56/1087282456.db2.gz WVNZAQVXXZBTCX-LLVKDONJSA-N 1 1 357.801 4.310 20 5 FIBDMO CC(C)(CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[NH+]1CCCCC1 ZINC000409580453 1087526802 /nfs/dbraw/zinc/52/68/02/1087526802.db2.gz LWCOBWWBXSNSKM-UHFFFAOYSA-N 1 1 357.454 4.209 20 5 FIBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000543856645 1087591062 /nfs/dbraw/zinc/59/10/62/1087591062.db2.gz MATIZRPSCDEMMP-HNNXBMFYSA-N 1 1 373.840 4.099 20 5 FIBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000543856645 1087591064 /nfs/dbraw/zinc/59/10/64/1087591064.db2.gz MATIZRPSCDEMMP-HNNXBMFYSA-N 1 1 373.840 4.099 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000180714920 1088032376 /nfs/dbraw/zinc/03/23/76/1088032376.db2.gz FTBGQCOWZXHNAM-WBMJQRKESA-N 1 1 360.385 4.307 20 5 FIBDMO COc1ccc(F)cc1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000189209402 1088452422 /nfs/dbraw/zinc/45/24/22/1088452422.db2.gz WRTVVGSNEGCCMH-UHFFFAOYSA-N 1 1 356.353 4.292 20 5 FIBDMO COc1cc(C[NH+]2CCC(F)(c3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000434492232 1088678591 /nfs/dbraw/zinc/67/85/91/1088678591.db2.gz NJXJWQQKODNLMF-UHFFFAOYSA-N 1 1 362.376 4.203 20 5 FIBDMO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000434622073 1088841288 /nfs/dbraw/zinc/84/12/88/1088841288.db2.gz AFBPQEPBMXXJGH-IBGZPJMESA-N 1 1 356.401 4.439 20 5 FIBDMO C[C@@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853300 1088884553 /nfs/dbraw/zinc/88/45/53/1088884553.db2.gz WHHCHDLKXLQKPI-UTKZUKDTSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](NC[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853300 1088884571 /nfs/dbraw/zinc/88/45/71/1088884571.db2.gz WHHCHDLKXLQKPI-UTKZUKDTSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](NC[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853300 1088884606 /nfs/dbraw/zinc/88/46/06/1088884606.db2.gz WHHCHDLKXLQKPI-UTKZUKDTSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H]([NH2+]C[C@]1(C)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853300 1088884629 /nfs/dbraw/zinc/88/46/29/1088884629.db2.gz WHHCHDLKXLQKPI-UTKZUKDTSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000434679494 1088928896 /nfs/dbraw/zinc/92/88/96/1088928896.db2.gz PJKDZNYBQJMBGY-AWEZNQCLSA-N 1 1 356.397 4.390 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[C@@H]1c1ccccc1 ZINC000435027205 1089223097 /nfs/dbraw/zinc/22/30/97/1089223097.db2.gz LKKMAZCULYHXPA-PBHICJAKSA-N 1 1 351.406 4.362 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@H+]3CC[C@H](O)C[C@@H]3C)cc2[N+](=O)[O-])cc1 ZINC000430123145 1089367627 /nfs/dbraw/zinc/36/76/27/1089367627.db2.gz PBGDFVBEUGKPCD-RDJZCZTQSA-N 1 1 372.490 4.400 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@H](O)C[C@@H]3C)cc2[N+](=O)[O-])cc1 ZINC000430123145 1089367647 /nfs/dbraw/zinc/36/76/47/1089367647.db2.gz PBGDFVBEUGKPCD-RDJZCZTQSA-N 1 1 372.490 4.400 20 5 FIBDMO Cc1cc(C[C@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)n[nH]1 ZINC000136794029 1089549453 /nfs/dbraw/zinc/54/94/53/1089549453.db2.gz AJRXOQKNWNBIPY-NSHDSACASA-N 1 1 374.828 4.261 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425369757 1089610830 /nfs/dbraw/zinc/61/08/30/1089610830.db2.gz HUSIXFFYJMKZGG-ZRNYNZGJSA-N 1 1 356.466 4.279 20 5 FIBDMO CC(C)CC[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000472834889 1089699819 /nfs/dbraw/zinc/69/98/19/1089699819.db2.gz QFMNBKMGBREDFF-MRXNPFEDSA-N 1 1 358.442 4.436 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1cncc(Br)c1 ZINC000515339534 1089972809 /nfs/dbraw/zinc/97/28/09/1089972809.db2.gz KQLGHCIXPLXQGC-GHMZBOCLSA-N 1 1 350.216 4.164 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCCC[C@H]1c1ccco1 ZINC000072666128 1090314575 /nfs/dbraw/zinc/31/45/75/1090314575.db2.gz OQZDQVDEOWKLGP-KRWDZBQOSA-N 1 1 357.410 4.052 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000072666128 1090314579 /nfs/dbraw/zinc/31/45/79/1090314579.db2.gz OQZDQVDEOWKLGP-KRWDZBQOSA-N 1 1 357.410 4.052 20 5 FIBDMO COC1(C(F)(F)F)CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000418099389 1091061296 /nfs/dbraw/zinc/06/12/96/1091061296.db2.gz ZTAVWDJZBFAFMI-UHFFFAOYSA-N 1 1 360.376 4.262 20 5 FIBDMO COc1cc(NC[C@@]2(C)CC[N@@H+](Cc3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000312672168 1091085455 /nfs/dbraw/zinc/08/54/55/1091085455.db2.gz NPCIBZVRBAXWMK-HXUWFJFHSA-N 1 1 373.428 4.067 20 5 FIBDMO CC[N@H+](CCC(F)(F)F)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000092737696 1091233524 /nfs/dbraw/zinc/23/35/24/1091233524.db2.gz PEGSRGKQOAWBBV-UHFFFAOYSA-N 1 1 355.154 4.132 20 5 FIBDMO CC[N@@H+](CCC(F)(F)F)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000092737696 1091233538 /nfs/dbraw/zinc/23/35/38/1091233538.db2.gz PEGSRGKQOAWBBV-UHFFFAOYSA-N 1 1 355.154 4.132 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCc1nc(-c2ccccc2)no1 ZINC000512214155 1091919360 /nfs/dbraw/zinc/91/93/60/1091919360.db2.gz UWVCQKLRDMZPRG-HNNXBMFYSA-N 1 1 366.421 4.189 20 5 FIBDMO Cc1noc(C)c1C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000520962071 1092389003 /nfs/dbraw/zinc/38/90/03/1092389003.db2.gz OQANONSVYVYSRP-UHFFFAOYSA-N 1 1 371.368 4.421 20 5 FIBDMO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000521402647 1092682631 /nfs/dbraw/zinc/68/26/31/1092682631.db2.gz BPGLYGRVWRJMEV-HNNXBMFYSA-N 1 1 362.433 4.002 20 5 FIBDMO COc1cc(C[NH2+]C(C)(C)c2cccc(Cl)c2F)ccc1[N+](=O)[O-] ZINC000473442683 1092882584 /nfs/dbraw/zinc/88/25/84/1092882584.db2.gz RAUMFHFOWFYGLR-UHFFFAOYSA-N 1 1 352.793 4.421 20 5 FIBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000521813563 1092927624 /nfs/dbraw/zinc/92/76/24/1092927624.db2.gz ZIZRCKPJESWDFH-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CN1CCC[C@H](C)C1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000521813563 1092927630 /nfs/dbraw/zinc/92/76/30/1092927630.db2.gz ZIZRCKPJESWDFH-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO C[N@H+](Cc1cccc2ccccc21)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000051993017 1093258552 /nfs/dbraw/zinc/25/85/52/1093258552.db2.gz MZCKCJLLVWRCEZ-UHFFFAOYSA-N 1 1 364.401 4.247 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000279961625 1093555431 /nfs/dbraw/zinc/55/54/31/1093555431.db2.gz CHCYPDUTPDNWPF-RYUDHWBXSA-N 1 1 364.243 4.473 20 5 FIBDMO COc1ccc(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-] ZINC000052611835 1093836422 /nfs/dbraw/zinc/83/64/22/1093836422.db2.gz CKQXNXPFUJSKHV-HNNXBMFYSA-N 1 1 367.405 4.124 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000513277616 1094044795 /nfs/dbraw/zinc/04/47/95/1094044795.db2.gz YYEXHAKRNPKINL-AUUYWEPGSA-N 1 1 354.406 4.044 20 5 FIBDMO C[C@H]1C[C@@H](CC[NH2+]Cc2csc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000513545573 1094205768 /nfs/dbraw/zinc/20/57/68/1094205768.db2.gz RIIGZUUCJZLXTO-DOTOQJQBSA-N 1 1 359.495 4.047 20 5 FIBDMO O=C(CC[N@H+]1CCC[C@@H]1/C=C\c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000500989010 1094404069 /nfs/dbraw/zinc/40/40/69/1094404069.db2.gz JVSCMJRPDACMND-MENFKHAKSA-N 1 1 365.433 4.101 20 5 FIBDMO Cc1cc(C)cc([C@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)c1 ZINC000501014955 1094431421 /nfs/dbraw/zinc/43/14/21/1094431421.db2.gz OMLPTIIUPSUMLO-KRWDZBQOSA-N 1 1 367.449 4.030 20 5 FIBDMO O=[N+]([O-])c1sc(C[NH2+][C@@H](c2ccccn2)C2CC2)cc1Br ZINC000896609994 1094824068 /nfs/dbraw/zinc/82/40/68/1094824068.db2.gz SBAPPQFYTCMZCY-CYBMUJFWSA-N 1 1 368.256 4.055 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501845380 1094959770 /nfs/dbraw/zinc/95/97/70/1094959770.db2.gz WXJZFNOCGLKQDG-WMZOPIPTSA-N 1 1 367.449 4.192 20 5 FIBDMO COc1ccc(C[NH2+]C(C)(C)c2cccc(Cl)c2F)cc1[N+](=O)[O-] ZINC000185850133 1094971958 /nfs/dbraw/zinc/97/19/58/1094971958.db2.gz VGAOARVCLHKFLT-UHFFFAOYSA-N 1 1 352.793 4.421 20 5 FIBDMO CC[C@@H]([NH2+][C@H](c1cnn(C)c1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000366679738 1095081460 /nfs/dbraw/zinc/08/14/60/1095081460.db2.gz OARPXBACMUNQIB-UXHICEINSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1ccc(Br)cn1 ZINC000281318343 1095526808 /nfs/dbraw/zinc/52/68/08/1095526808.db2.gz ZQKMRTDGSMXQHW-VXGBXAGGSA-N 1 1 364.243 4.473 20 5 FIBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000016442271 1095686109 /nfs/dbraw/zinc/68/61/09/1095686109.db2.gz GUCXTGMNCDXJKJ-LJQANCHMSA-N 1 1 353.422 4.069 20 5 FIBDMO CCc1ccc([C@H](NC2CCC([NH+](C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000421878618 1095972523 /nfs/dbraw/zinc/97/25/23/1095972523.db2.gz NONBVCXWQSTHCW-MYKUNDNFSA-N 1 1 371.481 4.302 20 5 FIBDMO Cc1c([C@@H](C)NC[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000423470676 1096693120 /nfs/dbraw/zinc/69/31/20/1096693120.db2.gz LSHKXQJYTJNDPY-OXFYSEKESA-N 1 1 371.456 4.086 20 5 FIBDMO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425420117 1098570282 /nfs/dbraw/zinc/57/02/82/1098570282.db2.gz LWTFKKQSXWWDNV-HNNXBMFYSA-N 1 1 364.243 4.335 20 5 FIBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425420117 1098570288 /nfs/dbraw/zinc/57/02/88/1098570288.db2.gz LWTFKKQSXWWDNV-HNNXBMFYSA-N 1 1 364.243 4.335 20 5 FIBDMO CC[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])[C@@H]1CCOC(C)(C)C1 ZINC000425445792 1098662336 /nfs/dbraw/zinc/66/23/36/1098662336.db2.gz NLIPWUHBZQRKQS-CQSZACIVSA-N 1 1 371.275 4.137 20 5 FIBDMO O=[N+]([O-])c1cccc(N2CCN(c3cc[nH+]c4cc(Cl)ccc43)CC2)c1 ZINC000515550935 1098693968 /nfs/dbraw/zinc/69/39/68/1098693968.db2.gz YUONSQYKPYJCBK-UHFFFAOYSA-N 1 1 368.824 4.123 20 5 FIBDMO C[C@@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000436330639 1098934333 /nfs/dbraw/zinc/93/43/33/1098934333.db2.gz MCIAMLOULOHRGQ-NEPJUHHUSA-N 1 1 372.391 4.074 20 5 FIBDMO Cn1c2ccccc2nc1[C@@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000533387669 1099017304 /nfs/dbraw/zinc/01/73/04/1099017304.db2.gz KNSOLTPVZHAWNU-FQEVSTJZSA-N 1 1 364.449 4.251 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000505844970 1099107315 /nfs/dbraw/zinc/10/73/15/1099107315.db2.gz JEQXJCHGDLZBFS-QZEKMECESA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000505844970 1099107322 /nfs/dbraw/zinc/10/73/22/1099107322.db2.gz JEQXJCHGDLZBFS-QZEKMECESA-N 1 1 365.433 4.020 20 5 FIBDMO CCc1ccccc1NC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350356 1099342396 /nfs/dbraw/zinc/34/23/96/1099342396.db2.gz OVAJDPRHHPWFSB-UHFFFAOYSA-N 1 1 355.438 4.006 20 5 FIBDMO CCc1ccccc1NC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350356 1099342408 /nfs/dbraw/zinc/34/24/08/1099342408.db2.gz OVAJDPRHHPWFSB-UHFFFAOYSA-N 1 1 355.438 4.006 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccccc1OC)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000508770636 1100047089 /nfs/dbraw/zinc/04/70/89/1100047089.db2.gz AANODHZKTMWTTF-OAHLLOKOSA-N 1 1 371.437 4.015 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1ccccc1OC)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000508770636 1100047099 /nfs/dbraw/zinc/04/70/99/1100047099.db2.gz AANODHZKTMWTTF-OAHLLOKOSA-N 1 1 371.437 4.015 20 5 FIBDMO CCOC[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000536669363 1100125326 /nfs/dbraw/zinc/12/53/26/1100125326.db2.gz ZKBPNTYOGLKIIA-HNNXBMFYSA-N 1 1 374.437 4.112 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@@H+](C4CCCC4)C3)s2)cc1 ZINC000518288133 1101068558 /nfs/dbraw/zinc/06/85/58/1101068558.db2.gz GSQXKFNEDBCQGY-INIZCTEOSA-N 1 1 371.506 4.430 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@H+](C4CCCC4)C3)s2)cc1 ZINC000518288133 1101068568 /nfs/dbraw/zinc/06/85/68/1101068568.db2.gz GSQXKFNEDBCQGY-INIZCTEOSA-N 1 1 371.506 4.430 20 5 FIBDMO CC(C)c1ccc(C(=O)NCCCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000439426864 1101422562 /nfs/dbraw/zinc/42/25/62/1101422562.db2.gz UEOHSUMWLNBDDU-MRXNPFEDSA-N 1 1 361.486 4.103 20 5 FIBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H]2CCCc2ccccc2)c1 ZINC001168153016 1101477410 /nfs/dbraw/zinc/47/74/10/1101477410.db2.gz DGHSRYKOCJYPJT-TZIWHRDSSA-N 1 1 354.450 4.116 20 5 FIBDMO CC[N@@H+]1CCC[C@@H]1CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000518771278 1101533278 /nfs/dbraw/zinc/53/32/78/1101533278.db2.gz RQBDSKYZBLMPDW-QGZVFWFLSA-N 1 1 373.428 4.100 20 5 FIBDMO CC[N@H+]1CCC[C@@H]1CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000518771278 1101533287 /nfs/dbraw/zinc/53/32/87/1101533287.db2.gz RQBDSKYZBLMPDW-QGZVFWFLSA-N 1 1 373.428 4.100 20 5 FIBDMO Cn1cc(C[N@@H+](C)Cc2ccc(Cl)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506758273 1102025345 /nfs/dbraw/zinc/02/53/45/1102025345.db2.gz LBUYWZJFYUGESQ-UHFFFAOYSA-N 1 1 370.840 4.281 20 5 FIBDMO Cn1cc(C[N@H+](C)Cc2ccccc2Cl)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506787847 1102101464 /nfs/dbraw/zinc/10/14/64/1102101464.db2.gz JSFCJMVKUGMPEP-UHFFFAOYSA-N 1 1 370.840 4.281 20 5 FIBDMO Cn1cc(C[N@@H+](C)Cc2ccccc2Cl)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506787847 1102101469 /nfs/dbraw/zinc/10/14/69/1102101469.db2.gz JSFCJMVKUGMPEP-UHFFFAOYSA-N 1 1 370.840 4.281 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC001168192130 1102257074 /nfs/dbraw/zinc/25/70/74/1102257074.db2.gz IDSBPNXSXASJIP-HZPDHXFCSA-N 1 1 373.884 4.343 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-])C1CC1 ZINC000507234943 1102394826 /nfs/dbraw/zinc/39/48/26/1102394826.db2.gz YFXDXVSYHGMPJY-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CC(C)[N@H+](CC(=O)N(C)[C@@H](C)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000140798970 1102569514 /nfs/dbraw/zinc/56/95/14/1102569514.db2.gz HDDTZRZPMBVLRZ-KRWDZBQOSA-N 1 1 369.465 4.025 20 5 FIBDMO CC(C)[N@@H+](CC(=O)N(C)[C@@H](C)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000140798970 1102569522 /nfs/dbraw/zinc/56/95/22/1102569522.db2.gz HDDTZRZPMBVLRZ-KRWDZBQOSA-N 1 1 369.465 4.025 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(-n2cccn2)c(F)c1 ZINC000550228189 1102791937 /nfs/dbraw/zinc/79/19/37/1102791937.db2.gz NUWDNRNCFUYYIB-GFCCVEGCSA-N 1 1 374.803 4.424 20 5 FIBDMO CC(C)[N@@H+](Cc1cccs1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507006742 1103028910 /nfs/dbraw/zinc/02/89/10/1103028910.db2.gz JOUIDVSIKQCTFT-UHFFFAOYSA-N 1 1 370.478 4.467 20 5 FIBDMO COc1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)ccc1SC ZINC000507168702 1103187617 /nfs/dbraw/zinc/18/76/17/1103187617.db2.gz FQFPRPFDDMGOPX-UHFFFAOYSA-N 1 1 358.463 4.490 20 5 FIBDMO CC[N@@H+](Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1)C1CC1 ZINC000507225216 1103227818 /nfs/dbraw/zinc/22/78/18/1103227818.db2.gz BYDHKCMBTHITHC-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000441322692 1104277529 /nfs/dbraw/zinc/27/75/29/1104277529.db2.gz KQYVJQCHEACHLK-IBGZPJMESA-N 1 1 355.438 4.007 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1cccc(N(C)C)c1 ZINC000441322693 1104277865 /nfs/dbraw/zinc/27/78/65/1104277865.db2.gz KQYVJQCHEACHLK-LJQANCHMSA-N 1 1 355.438 4.007 20 5 FIBDMO CC(C)c1ccc(C[NH2+]Cc2ccncc2OCC(F)F)cc1[N+](=O)[O-] ZINC000441372399 1104314279 /nfs/dbraw/zinc/31/42/79/1104314279.db2.gz OYVAPBVRLJSFLC-UHFFFAOYSA-N 1 1 365.380 4.047 20 5 FIBDMO O=C(C[C@@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000441404132 1104345892 /nfs/dbraw/zinc/34/58/92/1104345892.db2.gz MTKANUQVUDULMW-HNNXBMFYSA-N 1 1 360.360 4.110 20 5 FIBDMO O=C(C[C@@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000441404132 1104345904 /nfs/dbraw/zinc/34/59/04/1104345904.db2.gz MTKANUQVUDULMW-HNNXBMFYSA-N 1 1 360.360 4.110 20 5 FIBDMO Cc1ccc(C)c([C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)[C@H](C)CO2)c1 ZINC000441448595 1104740114 /nfs/dbraw/zinc/74/01/14/1104740114.db2.gz LEQZFFCOXSUFMX-DYESRHJHSA-N 1 1 354.450 4.216 20 5 FIBDMO COc1cccc([C@H](C)[NH+]2CCN([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000441480053 1104860710 /nfs/dbraw/zinc/86/07/10/1104860710.db2.gz JFLFNZMDNKMCGH-IRXDYDNUSA-N 1 1 369.465 4.043 20 5 FIBDMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@@H](C)CO1 ZINC000508016242 1105301043 /nfs/dbraw/zinc/30/10/43/1105301043.db2.gz OPJCUQNFZXVYFZ-RYUDHWBXSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@@H](C)CO1 ZINC000508016242 1105301050 /nfs/dbraw/zinc/30/10/50/1105301050.db2.gz OPJCUQNFZXVYFZ-RYUDHWBXSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@]1(O)CCCC[C@@H]1[C@@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000450958328 1106843281 /nfs/dbraw/zinc/84/32/81/1106843281.db2.gz MVSKJDFDIGYJGA-JLSDUUJJSA-N 1 1 352.862 4.154 20 5 FIBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]2CCCC[C@@H]12 ZINC000543906030 1106847737 /nfs/dbraw/zinc/84/77/37/1106847737.db2.gz QRAAUPGEECQNQG-JLSDUUJJSA-N 1 1 355.438 4.303 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c1 ZINC000451358070 1107051516 /nfs/dbraw/zinc/05/15/16/1107051516.db2.gz ZQLCWKXOLAVBEB-OIISXLGYSA-N 1 1 372.387 4.129 20 5 FIBDMO O=c1[nH]c2ccccc2cc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543509 1107161880 /nfs/dbraw/zinc/16/18/80/1107161880.db2.gz CDRBMOIWSXVWGV-QGZVFWFLSA-N 1 1 363.417 4.228 20 5 FIBDMO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544770 1107164145 /nfs/dbraw/zinc/16/41/45/1107164145.db2.gz FSUFXUXHDXSAMQ-HIFRSBDPSA-N 1 1 358.442 4.216 20 5 FIBDMO C[C@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544770 1107164158 /nfs/dbraw/zinc/16/41/58/1107164158.db2.gz FSUFXUXHDXSAMQ-HIFRSBDPSA-N 1 1 358.442 4.216 20 5 FIBDMO O=[N+]([O-])c1cc(CN2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)cs1 ZINC000530865477 1107370419 /nfs/dbraw/zinc/37/04/19/1107370419.db2.gz SJTHQJMETZOOSV-FQEVSTJZSA-N 1 1 371.506 4.144 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](CC(C)(C)C)C1 ZINC000452078964 1107460606 /nfs/dbraw/zinc/46/06/06/1107460606.db2.gz MPQJEPUSCJAMJK-UONOGXRCSA-N 1 1 358.442 4.464 20 5 FIBDMO COCCc1cc[nH+]c(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000508486341 1107535306 /nfs/dbraw/zinc/53/53/06/1107535306.db2.gz HCDJWEOJQNBNPZ-UHFFFAOYSA-N 1 1 353.378 4.051 20 5 FIBDMO CC1(C)OCc2cc(C[N@H+](Cc3ccccc3[N+](=O)[O-])C3CC3)ccc2O1 ZINC000186619317 1107782208 /nfs/dbraw/zinc/78/22/08/1107782208.db2.gz KDAYIHWXIYIBGR-UHFFFAOYSA-N 1 1 368.433 4.405 20 5 FIBDMO CC1(C)OCc2cc(C[N@@H+](Cc3ccccc3[N+](=O)[O-])C3CC3)ccc2O1 ZINC000186619317 1107782224 /nfs/dbraw/zinc/78/22/24/1107782224.db2.gz KDAYIHWXIYIBGR-UHFFFAOYSA-N 1 1 368.433 4.405 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000520208398 1108022108 /nfs/dbraw/zinc/02/21/08/1108022108.db2.gz RGSFAONKLHBWJT-MRXNPFEDSA-N 1 1 357.454 4.209 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[N@@H+](C)C1CC1 ZINC000237579873 1108176225 /nfs/dbraw/zinc/17/62/25/1108176225.db2.gz DCQZYIFEQXKKLH-GFCCVEGCSA-N 1 1 363.845 4.081 20 5 FIBDMO C[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)N(C)C1CC1 ZINC000237579873 1108176227 /nfs/dbraw/zinc/17/62/27/1108176227.db2.gz DCQZYIFEQXKKLH-GFCCVEGCSA-N 1 1 363.845 4.081 20 5 FIBDMO NC(=O)c1ccc(C[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000444808152 1108182572 /nfs/dbraw/zinc/18/25/72/1108182572.db2.gz ZJRGJEKQMVGMQK-KRWDZBQOSA-N 1 1 373.840 4.074 20 5 FIBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000444808152 1108182580 /nfs/dbraw/zinc/18/25/80/1108182580.db2.gz ZJRGJEKQMVGMQK-KRWDZBQOSA-N 1 1 373.840 4.074 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCCc4c[nH]nc43)s2)cc1 ZINC000532209297 1108712664 /nfs/dbraw/zinc/71/26/64/1108712664.db2.gz QHWPWCWJWRUVMP-MRXNPFEDSA-N 1 1 354.435 4.214 20 5 FIBDMO COc1ccc(C[N@@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000524037094 1108768003 /nfs/dbraw/zinc/76/80/03/1108768003.db2.gz UHLYSHINKSFVQG-IFXJQAMLSA-N 1 1 358.463 4.282 20 5 FIBDMO COc1ccc(C[N@H+]2CCS[C@@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000524037094 1108768015 /nfs/dbraw/zinc/76/80/15/1108768015.db2.gz UHLYSHINKSFVQG-IFXJQAMLSA-N 1 1 358.463 4.282 20 5 FIBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H](O)C(F)(F)F ZINC000428424269 1109059652 /nfs/dbraw/zinc/05/96/52/1109059652.db2.gz XCLVQWIISMYCMP-HNNXBMFYSA-N 1 1 374.384 4.068 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cccc(OC4CCCC4)c3)nc2c1 ZINC000446831705 1109354709 /nfs/dbraw/zinc/35/47/09/1109354709.db2.gz HRXIMVHTNVSOCH-UHFFFAOYSA-N 1 1 366.421 4.082 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000441264268 1109549373 /nfs/dbraw/zinc/54/93/73/1109549373.db2.gz XUGQOIKOLFFAHQ-SFHVURJKSA-N 1 1 356.422 4.128 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cn3cc(Cl)ccc3n1)CCC2 ZINC000447538673 1109571754 /nfs/dbraw/zinc/57/17/54/1109571754.db2.gz CJEOBMDLBHPWFW-KRWDZBQOSA-N 1 1 356.813 4.063 20 5 FIBDMO C[N@@H+](CCc1ccccn1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000527108332 1109694489 /nfs/dbraw/zinc/69/44/89/1109694489.db2.gz YOHDKGVSLKYSID-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO CC(C)[N@H+](Cc1ccnn1-c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000448212932 1109742250 /nfs/dbraw/zinc/74/22/50/1109742250.db2.gz KJYVJCQDABPHLX-UHFFFAOYSA-N 1 1 350.422 4.191 20 5 FIBDMO CC(C)[N@@H+](Cc1ccnn1-c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000448212932 1109742253 /nfs/dbraw/zinc/74/22/53/1109742253.db2.gz KJYVJCQDABPHLX-UHFFFAOYSA-N 1 1 350.422 4.191 20 5 FIBDMO COc1ccc(C[NH+]2CCC(C(=O)c3ccc(C)cc3)CC2)cc1[N+](=O)[O-] ZINC000054317693 1109753513 /nfs/dbraw/zinc/75/35/13/1109753513.db2.gz VFBJYRZNJGBXJA-UHFFFAOYSA-N 1 1 368.433 4.007 20 5 FIBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])Nc1cccc([C@@H](C)[NH+]2CCOCC2)c1 ZINC000449053670 1109969381 /nfs/dbraw/zinc/96/93/81/1109969381.db2.gz LLVBZYZKPMVNPS-IAGOWNOFSA-N 1 1 369.465 4.031 20 5 FIBDMO COc1ccc(Br)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000449347449 1110036269 /nfs/dbraw/zinc/03/62/69/1110036269.db2.gz HJZRFYVRTATSLY-NSHDSACASA-N 1 1 365.227 4.217 20 5 FIBDMO O=[N+]([O-])c1cccc(C[NH+]2CCC(c3nc(C(F)(F)F)cs3)CC2)c1 ZINC000449435654 1110077912 /nfs/dbraw/zinc/07/79/12/1110077912.db2.gz DSPDPPDGICCYJK-UHFFFAOYSA-N 1 1 371.384 4.450 20 5 FIBDMO Cc1cc(CNc2nccc3c2cccc3[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000450530247 1110311232 /nfs/dbraw/zinc/31/12/32/1110311232.db2.gz CGCIOLNHFUTVJE-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000538731045 1111268374 /nfs/dbraw/zinc/26/83/74/1111268374.db2.gz RBFNADOEHQIYBL-INIZCTEOSA-N 1 1 374.412 4.385 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](C4CCOCC4)C3)o2)c1 ZINC000538750084 1111280818 /nfs/dbraw/zinc/28/08/18/1111280818.db2.gz ZBYBNBGRVVBZGK-QGZVFWFLSA-N 1 1 356.422 4.103 20 5 FIBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000538752183 1111282127 /nfs/dbraw/zinc/28/21/27/1111282127.db2.gz OMOXXDVATVQJSP-KRWDZBQOSA-N 1 1 369.465 4.019 20 5 FIBDMO CCC[N@@H+](C)C[C@@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000461967247 1111444889 /nfs/dbraw/zinc/44/48/89/1111444889.db2.gz QGVYYZZKPLVJNQ-ZDUSSCGKSA-N 1 1 359.392 4.090 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)N1CCC[C@@H]1c1cccs1 ZINC000539327717 1111523073 /nfs/dbraw/zinc/52/30/73/1111523073.db2.gz BJCVCSIUKNLBIT-GRDNDAEWSA-N 1 1 373.478 4.059 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](CC(C)C)c1ccccc1OC ZINC000539379772 1111544018 /nfs/dbraw/zinc/54/40/18/1111544018.db2.gz RLTKJWZXNKNERQ-SFHVURJKSA-N 1 1 358.438 4.489 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1Cl ZINC000478039088 1111651981 /nfs/dbraw/zinc/65/19/81/1111651981.db2.gz FCMZVNORYJXYPD-UHFFFAOYSA-N 1 1 372.812 4.043 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000552322659 1111668982 /nfs/dbraw/zinc/66/89/82/1111668982.db2.gz VICPOLKNKNLRNI-HNNXBMFYSA-N 1 1 357.429 4.493 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2N2CCCC2)cc1[N+](=O)[O-] ZINC000552322660 1111669107 /nfs/dbraw/zinc/66/91/07/1111669107.db2.gz VICPOLKNKNLRNI-OAHLLOKOSA-N 1 1 357.429 4.493 20 5 FIBDMO C[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+]1CCCC[C@H]1C ZINC000478641290 1111842403 /nfs/dbraw/zinc/84/24/03/1111842403.db2.gz CPELUVHRISAHTG-SJORKVTESA-N 1 1 361.489 4.381 20 5 FIBDMO CC(=O)c1cc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000553076521 1111903100 /nfs/dbraw/zinc/90/31/00/1111903100.db2.gz PQBWISONBPABDB-IFXJQAMLSA-N 1 1 373.478 4.354 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1cc(F)ccc1F)C(C)C ZINC000479075697 1111945106 /nfs/dbraw/zinc/94/51/06/1111945106.db2.gz YAEJTDNUPVHDSW-SFHVURJKSA-N 1 1 350.365 4.369 20 5 FIBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3sccc3Cl)CC2)cc1 ZINC000555014718 1112623040 /nfs/dbraw/zinc/62/30/40/1112623040.db2.gz LDNDWZARALUNPC-UHFFFAOYSA-N 1 1 352.843 4.353 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000600185332 1112919152 /nfs/dbraw/zinc/91/91/52/1112919152.db2.gz LAGWPRDIWCEAST-XNTDXEJSSA-N 1 1 366.465 4.144 20 5 FIBDMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482700413 1113335382 /nfs/dbraw/zinc/33/53/82/1113335382.db2.gz XJYJOBPYWXMSAJ-GFCCVEGCSA-N 1 1 358.829 4.188 20 5 FIBDMO Cc1ccc([C@H]2C[C@@H](C)[N@H+](CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000490039206 1114206689 /nfs/dbraw/zinc/20/66/89/1114206689.db2.gz JBTIZPKKAHKUIU-AEFFLSMTSA-N 1 1 367.449 4.028 20 5 FIBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490044357 1114209529 /nfs/dbraw/zinc/20/95/29/1114209529.db2.gz RMQPEMVKFVUETN-INIZCTEOSA-N 1 1 355.438 4.142 20 5 FIBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490044357 1114209533 /nfs/dbraw/zinc/20/95/33/1114209533.db2.gz RMQPEMVKFVUETN-INIZCTEOSA-N 1 1 355.438 4.142 20 5 FIBDMO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000490087979 1114217057 /nfs/dbraw/zinc/21/70/57/1114217057.db2.gz FCLNMDMRRLFUQE-QGZVFWFLSA-N 1 1 364.829 4.076 20 5 FIBDMO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000490087979 1114217061 /nfs/dbraw/zinc/21/70/61/1114217061.db2.gz FCLNMDMRRLFUQE-QGZVFWFLSA-N 1 1 364.829 4.076 20 5 FIBDMO CCN(Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000490430388 1114290126 /nfs/dbraw/zinc/29/01/26/1114290126.db2.gz HPUIATFMGSLJNC-SFHVURJKSA-N 1 1 371.456 4.078 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCc1ccc(F)cc1 ZINC000055023320 1114412087 /nfs/dbraw/zinc/41/20/87/1114412087.db2.gz OPQSPASLHUXEGT-CYBMUJFWSA-N 1 1 370.384 4.019 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[NH2+]C4(CCC4)C3)s2)cc1 ZINC000591282637 1115054969 /nfs/dbraw/zinc/05/49/69/1115054969.db2.gz ISCKEUVLJXIRBD-HNNXBMFYSA-N 1 1 357.479 4.088 20 5 FIBDMO C[NH+](C)[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)c1ccco1 ZINC000045858337 1115093432 /nfs/dbraw/zinc/09/34/32/1115093432.db2.gz DZUVPXVTRPIUDF-LJQANCHMSA-N 1 1 359.429 4.014 20 5 FIBDMO C[NH+](C)[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)c1ccco1 ZINC000045858335 1115093634 /nfs/dbraw/zinc/09/36/34/1115093634.db2.gz DZUVPXVTRPIUDF-IBGZPJMESA-N 1 1 359.429 4.014 20 5 FIBDMO CC1(C)CCC[C@H]1[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000592153480 1115215926 /nfs/dbraw/zinc/21/59/26/1115215926.db2.gz DLFIUUOOFVGEJJ-WBVHZDCISA-N 1 1 370.453 4.293 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC001168404382 1115434636 /nfs/dbraw/zinc/43/46/36/1115434636.db2.gz SUOHCYMFPYJIHW-DFBGVHRSSA-N 1 1 353.260 4.368 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CO)c1cccc(Cl)c1Cl ZINC000595001144 1115506903 /nfs/dbraw/zinc/50/69/03/1115506903.db2.gz QXPWFZBCSACELY-HNNXBMFYSA-N 1 1 355.221 4.033 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000595005425 1115507339 /nfs/dbraw/zinc/50/73/39/1115507339.db2.gz YMEQRCMRGPORLH-MRXNPFEDSA-N 1 1 369.465 4.050 20 5 FIBDMO COC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccc(Cl)cc1 ZINC000595050863 1115512034 /nfs/dbraw/zinc/51/20/34/1115512034.db2.gz UUAKKPMWNKWLSH-SJCJKPOMSA-N 1 1 364.829 4.295 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2oc3ccccc3c2C)c1 ZINC000593023032 1115540447 /nfs/dbraw/zinc/54/04/47/1115540447.db2.gz NQFKIZQHGQXZFC-ZDUSSCGKSA-N 1 1 368.389 4.287 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+]C1(c2cccc(OC(F)(F)F)c2)CC1 ZINC000595562456 1115540719 /nfs/dbraw/zinc/54/07/19/1115540719.db2.gz OALANCLNOHISRP-UHFFFAOYSA-N 1 1 370.302 4.411 20 5 FIBDMO CC(C)(C)[N@H+](Cc1ccsc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000595603595 1115552925 /nfs/dbraw/zinc/55/29/25/1115552925.db2.gz ZECBIAGKTINVLT-UHFFFAOYSA-N 1 1 362.451 4.324 20 5 FIBDMO CC(C)(C)[N@@H+](Cc1ccsc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000595603595 1115552929 /nfs/dbraw/zinc/55/29/29/1115552929.db2.gz ZECBIAGKTINVLT-UHFFFAOYSA-N 1 1 362.451 4.324 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](c2ccccc2F)C(C)C)c1 ZINC000595686754 1115556694 /nfs/dbraw/zinc/55/66/94/1115556694.db2.gz BFDINVPCUUYTPP-GOSISDBHSA-N 1 1 360.385 4.007 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C2CCC2)C1 ZINC000595838765 1115563943 /nfs/dbraw/zinc/56/39/43/1115563943.db2.gz WATDTMOTTAKMJM-BBRMVZONSA-N 1 1 356.426 4.218 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])s3)cc2)C1 ZINC000060548160 1115663397 /nfs/dbraw/zinc/66/33/97/1115663397.db2.gz ZBVRFXPBHCGWLK-CYBMUJFWSA-N 1 1 359.451 4.141 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+](CCCO)[C@@H]2CCc3ccccc32)ccc1Cl ZINC000761249155 1115702042 /nfs/dbraw/zinc/70/20/42/1115702042.db2.gz HLPSZYVWWXVMGT-GOSISDBHSA-N 1 1 360.841 4.120 20 5 FIBDMO CCc1cnccc1[C@@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602581088 1115712949 /nfs/dbraw/zinc/71/29/49/1115712949.db2.gz HFBRMUYZYYIJPL-SECBINFHSA-N 1 1 370.272 4.227 20 5 FIBDMO Cc1ncc([C@H](C)[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)s1 ZINC000602734780 1115721697 /nfs/dbraw/zinc/72/16/97/1115721697.db2.gz JKRZNVFRISILEL-LURJTMIESA-N 1 1 362.274 4.035 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H](CCO)c2cc(Cl)cc(Cl)c2)cs1 ZINC000599017026 1115779652 /nfs/dbraw/zinc/77/96/52/1115779652.db2.gz VZDMWSIYYGANNS-ZDUSSCGKSA-N 1 1 361.250 4.176 20 5 FIBDMO C[C@@H](Nc1ccc2cnccc2c1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000599066953 1115786581 /nfs/dbraw/zinc/78/65/81/1115786581.db2.gz VJVNNASEMWZBHB-GDBMZVCRSA-N 1 1 354.454 4.208 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576663 1115827956 /nfs/dbraw/zinc/82/79/56/1115827956.db2.gz QAANANBAUBIKND-VFNWGFHPSA-N 1 1 366.417 4.156 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576663 1115827960 /nfs/dbraw/zinc/82/79/60/1115827960.db2.gz QAANANBAUBIKND-VFNWGFHPSA-N 1 1 366.417 4.156 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[NH+]2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 ZINC000604275965 1115861680 /nfs/dbraw/zinc/86/16/80/1115861680.db2.gz CVBHNHBTGNCXIH-VXGBXAGGSA-N 1 1 370.293 4.200 20 5 FIBDMO CC[C@@H](C)[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000061759903 1115872687 /nfs/dbraw/zinc/87/26/87/1115872687.db2.gz NNLFIXHQDJZQLU-OAHLLOKOSA-N 1 1 356.422 4.262 20 5 FIBDMO C[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+]1CCC[C@H](C)C1 ZINC000063749515 1116105442 /nfs/dbraw/zinc/10/54/42/1116105442.db2.gz VJAGHZJMENWWTM-DLBZAZTESA-N 1 1 361.489 4.238 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@@H+]4CCC[C@H]4C3)s2)cc1 ZINC000608836069 1116131299 /nfs/dbraw/zinc/13/12/99/1116131299.db2.gz JLZZNZJTCXJDMV-RDJZCZTQSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@H+]4CCC[C@H]4C3)s2)cc1 ZINC000608836069 1116131301 /nfs/dbraw/zinc/13/13/01/1116131301.db2.gz JLZZNZJTCXJDMV-RDJZCZTQSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccco2)Cc2ccc(O)cc2)cc1 ZINC000609029985 1116141643 /nfs/dbraw/zinc/14/16/43/1116141643.db2.gz YPRIDLZOCKJFQI-UHFFFAOYSA-N 1 1 352.390 4.138 20 5 FIBDMO C[N@H+](Cc1cc(Br)cs1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774613 1116346003 /nfs/dbraw/zinc/34/60/03/1116346003.db2.gz HUBOEUXWQGSBOJ-UHFFFAOYSA-N 1 1 359.220 4.190 20 5 FIBDMO C[N@@H+](Cc1cc(Br)cs1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774613 1116346005 /nfs/dbraw/zinc/34/60/05/1116346005.db2.gz HUBOEUXWQGSBOJ-UHFFFAOYSA-N 1 1 359.220 4.190 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@@H+](CC3CCCC3)C2)o1 ZINC000462735484 1117741814 /nfs/dbraw/zinc/74/18/14/1117741814.db2.gz BKBVWUDKFFVVFW-KRWDZBQOSA-N 1 1 369.465 4.209 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCN(CC3CCCC3)C2)o1 ZINC000462735484 1117741815 /nfs/dbraw/zinc/74/18/15/1117741815.db2.gz BKBVWUDKFFVVFW-KRWDZBQOSA-N 1 1 369.465 4.209 20 5 FIBDMO COC(C)(C)C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000539928302 1117752542 /nfs/dbraw/zinc/75/25/42/1117752542.db2.gz WWBFSLYMOAYMER-UHFFFAOYSA-N 1 1 352.818 4.365 20 5 FIBDMO COc1cc(NCc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)ccc1[N+](=O)[O-] ZINC000462790567 1117774299 /nfs/dbraw/zinc/77/42/99/1117774299.db2.gz OJKRJVDEUBUTLW-MRXNPFEDSA-N 1 1 369.465 4.447 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000539992829 1117790441 /nfs/dbraw/zinc/79/04/41/1117790441.db2.gz HGXXDADKQXZLID-VNHYZAJKSA-N 1 1 369.412 4.038 20 5 FIBDMO COc1ccc(C[NH2+][C@@H](C)c2sccc2Br)cc1[N+](=O)[O-] ZINC000540174436 1117915358 /nfs/dbraw/zinc/91/53/58/1117915358.db2.gz YZPQFQQLNLRZRA-VIFPVBQESA-N 1 1 371.256 4.278 20 5 FIBDMO COc1cc(C[NH+]2CCC(COc3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000463489523 1118180888 /nfs/dbraw/zinc/18/08/88/1118180888.db2.gz FWPXRRWVZXJEFU-UHFFFAOYSA-N 1 1 374.412 4.034 20 5 FIBDMO C[C@@H](c1c(F)cccc1F)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000464770647 1118680892 /nfs/dbraw/zinc/68/08/92/1118680892.db2.gz BZFWTNYWWOIUEX-ZDUSSCGKSA-N 1 1 362.376 4.477 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC3(C2)CCCCCC3)c2c(c1)COCO2 ZINC000464763540 1118685563 /nfs/dbraw/zinc/68/55/63/1118685563.db2.gz BSBIRKSITQYZHL-UHFFFAOYSA-N 1 1 360.454 4.398 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@H](C)C[C@@H]2c2ccc(C)o2)c([N+](=O)[O-])c1 ZINC000464841788 1118718047 /nfs/dbraw/zinc/71/80/47/1118718047.db2.gz XZHYATMQYGIAAY-WMLDXEAASA-N 1 1 374.437 4.357 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000464857600 1118726187 /nfs/dbraw/zinc/72/61/87/1118726187.db2.gz KRAXZGGXAPBMOK-RDTXWAMCSA-N 1 1 371.437 4.298 20 5 FIBDMO CCSc1cccc(C[NH2+]Cc2cc(OC)c(OC)cc2[N+](=O)[O-])c1 ZINC000491534082 1118958394 /nfs/dbraw/zinc/95/83/94/1118958394.db2.gz TZLMBGVWYGALFC-UHFFFAOYSA-N 1 1 362.451 4.014 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+](C)CC3CC(O)C3)cc2[N+](=O)[O-])cc1 ZINC000443849474 1118993383 /nfs/dbraw/zinc/99/33/83/1118993383.db2.gz DMTSYTSYBZHUHT-UHFFFAOYSA-N 1 1 372.490 4.257 20 5 FIBDMO CC(C)([NH2+]Cc1cscc1Br)c1ccccc1[N+](=O)[O-] ZINC000491999183 1119001451 /nfs/dbraw/zinc/00/14/51/1119001451.db2.gz LDYUASKIRWIONC-UHFFFAOYSA-N 1 1 355.257 4.444 20 5 FIBDMO CCOc1cc(C[N@H+](C)[C@@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000492516611 1119113960 /nfs/dbraw/zinc/11/39/60/1119113960.db2.gz VQNPEVXRWTYJSJ-LBPRGKRZSA-N 1 1 350.365 4.465 20 5 FIBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000492516611 1119113962 /nfs/dbraw/zinc/11/39/62/1119113962.db2.gz VQNPEVXRWTYJSJ-LBPRGKRZSA-N 1 1 350.365 4.465 20 5 FIBDMO CCC[C@@H]([NH2+][C@H](C)c1cn(-c2ccccc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000090449820 1119161512 /nfs/dbraw/zinc/16/15/12/1119161512.db2.gz OUGAISAXUXDYHG-DNVCBOLYSA-N 1 1 365.437 4.368 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000761512876 1119405906 /nfs/dbraw/zinc/40/59/06/1119405906.db2.gz YWUWQRXCGVMUAN-IAOVAPTHSA-N 1 1 352.862 4.274 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526570 1119409866 /nfs/dbraw/zinc/40/98/66/1119409866.db2.gz OWFKQDGSUPXMCJ-HNAYVOBHSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526570 1119409868 /nfs/dbraw/zinc/40/98/68/1119409868.db2.gz OWFKQDGSUPXMCJ-HNAYVOBHSA-N 1 1 373.884 4.248 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)[C@@H](CO)C2CC2)cc1Cl ZINC000761535845 1119414391 /nfs/dbraw/zinc/41/43/91/1119414391.db2.gz ZWVISJFEWRZLEN-IBGZPJMESA-N 1 1 360.841 4.021 20 5 FIBDMO CCc1ccc([C@H](NCCC[N@@H+](C)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542476243 1119573512 /nfs/dbraw/zinc/57/35/12/1119573512.db2.gz CVWRLSRDRQSKSS-HXUWFJFHSA-N 1 1 359.470 4.160 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)cc1 ZINC000762562072 1120928668 /nfs/dbraw/zinc/92/86/68/1120928668.db2.gz XNCNLZFCAHITHI-UHFFFAOYSA-N 1 1 351.450 4.087 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cccc3c2OCCCO3)cc1[N+](=O)[O-] ZINC000090546660 1120983293 /nfs/dbraw/zinc/98/32/93/1120983293.db2.gz TZQQRELIPSNYBR-CQSZACIVSA-N 1 1 372.421 4.006 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccnc1OC1CCCC1 ZINC000153887132 1121432279 /nfs/dbraw/zinc/43/22/79/1121432279.db2.gz PUKVCQVQLJLEMP-HNNXBMFYSA-N 1 1 355.438 4.470 20 5 FIBDMO C[N@H+](Cc1ccccc1)CC1CCN(c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000301166328 1121564126 /nfs/dbraw/zinc/56/41/26/1121564126.db2.gz UYNKWTCBUQPQJC-UHFFFAOYSA-N 1 1 357.429 4.082 20 5 FIBDMO C[C@H]1C[C@H](N(C)c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000301452186 1122030259 /nfs/dbraw/zinc/03/02/59/1122030259.db2.gz XQNMYBPHNVFKEA-VHSXEESVSA-N 1 1 365.783 4.186 20 5 FIBDMO CC(=O)c1cc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000553487233 1122132520 /nfs/dbraw/zinc/13/25/20/1122132520.db2.gz OWWMOURIQCTZPW-YWZLYKJASA-N 1 1 367.449 4.120 20 5 FIBDMO CC[N@@H+](C)C[C@H]1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301465700 1122137936 /nfs/dbraw/zinc/13/79/36/1122137936.db2.gz XEFQSIULPONIKZ-SNVBAGLBSA-N 1 1 365.783 4.045 20 5 FIBDMO CCOc1ccc([C@@H](C)NCc2cccc(C[N@H+](C)CC)c2)cc1[N+](=O)[O-] ZINC000153596523 1122198624 /nfs/dbraw/zinc/19/86/24/1122198624.db2.gz CAAVKMIYAMTMKF-MRXNPFEDSA-N 1 1 371.481 4.296 20 5 FIBDMO CCOc1ccc([C@@H](C)NCc2cccc(C[N@@H+](C)CC)c2)cc1[N+](=O)[O-] ZINC000153596523 1122198630 /nfs/dbraw/zinc/19/86/30/1122198630.db2.gz CAAVKMIYAMTMKF-MRXNPFEDSA-N 1 1 371.481 4.296 20 5 FIBDMO COc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000301520574 1122199137 /nfs/dbraw/zinc/19/91/37/1122199137.db2.gz FIYQJCWRHSELJA-QAPCUYQASA-N 1 1 355.438 4.068 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H](C)c3ccncc3)o2)c([N+](=O)[O-])c1 ZINC000542693426 1122289937 /nfs/dbraw/zinc/28/99/37/1122289937.db2.gz ZMXJHMVIWSAISU-AWEZNQCLSA-N 1 1 367.405 4.451 20 5 FIBDMO CO[C@H]1CC[NH2+][C@@H](c2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001212240820 1123006391 /nfs/dbraw/zinc/00/63/91/1123006391.db2.gz CRRUKGLOATWNSG-MGPUTAFESA-N 1 1 359.429 4.483 20 5 FIBDMO C[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000237538577 1123101521 /nfs/dbraw/zinc/10/15/21/1123101521.db2.gz QOBBJNRDNFQZPX-YJBOKZPZSA-N 1 1 373.884 4.391 20 5 FIBDMO CC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 ZINC000064348884 1123706265 /nfs/dbraw/zinc/70/62/65/1123706265.db2.gz XCYISYORXUZYLJ-CYBMUJFWSA-N 1 1 367.405 4.023 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 ZINC000064348884 1123706269 /nfs/dbraw/zinc/70/62/69/1123706269.db2.gz XCYISYORXUZYLJ-CYBMUJFWSA-N 1 1 367.405 4.023 20 5 FIBDMO CC(C)[N@H+](Cc1cn2cc(Cl)ccc2n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350202 1123706340 /nfs/dbraw/zinc/70/63/40/1123706340.db2.gz UXGGACJTQJQDDO-UHFFFAOYSA-N 1 1 358.829 4.307 20 5 FIBDMO CC(C)[N@@H+](Cc1cn2cc(Cl)ccc2n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350202 1123706342 /nfs/dbraw/zinc/70/63/42/1123706342.db2.gz UXGGACJTQJQDDO-UHFFFAOYSA-N 1 1 358.829 4.307 20 5 FIBDMO Cc1ccnc(NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-] ZINC000609669706 1123789437 /nfs/dbraw/zinc/78/94/37/1123789437.db2.gz WHJZBKFMPDDSIA-OAHLLOKOSA-N 1 1 354.454 4.142 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000610004682 1123914934 /nfs/dbraw/zinc/91/49/34/1123914934.db2.gz XJUFFZOTWCDQBA-QGZVFWFLSA-N 1 1 356.397 4.137 20 5 FIBDMO Cc1cc(C[NH2+]Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)[nH]n1 ZINC000610009978 1123915729 /nfs/dbraw/zinc/91/57/29/1123915729.db2.gz NNJLQCMJONBHBR-UHFFFAOYSA-N 1 1 372.812 4.362 20 5 FIBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000615834554 1124127829 /nfs/dbraw/zinc/12/78/29/1124127829.db2.gz ODFUOJQMOZWTMX-TXQCQQFXSA-N 1 1 360.454 4.053 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@@H+]4CCCC[C@@H]34)s2)cc1 ZINC000238003396 1124224939 /nfs/dbraw/zinc/22/49/39/1124224939.db2.gz GSGRQPUHVODOTB-MSOLQXFVSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@H+]4CCCC[C@@H]34)s2)cc1 ZINC000238003396 1124224948 /nfs/dbraw/zinc/22/49/48/1124224948.db2.gz GSGRQPUHVODOTB-MSOLQXFVSA-N 1 1 357.479 4.040 20 5 FIBDMO O=C(Nc1ccccc1)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182020117 1125210206 /nfs/dbraw/zinc/21/02/06/1125210206.db2.gz RTSVKFFHCFGUJN-UHFFFAOYSA-N 1 1 373.840 4.099 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1C(F)(F)F ZINC000301776736 1125255007 /nfs/dbraw/zinc/25/50/07/1125255007.db2.gz LLQAUAVFXAEFDR-MLGOLLRUSA-N 1 1 369.387 4.067 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2c(Cl)n[nH]c2C2CC2)cc(C(F)(F)F)c1 ZINC000922067815 1125281074 /nfs/dbraw/zinc/28/10/74/1125281074.db2.gz JUVYSPKEXROHSL-UHFFFAOYSA-N 1 1 374.750 4.157 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+](C2CC2)[C@H]2CCc3ccccc32)c2c(c1)COCO2 ZINC000065951678 1125436004 /nfs/dbraw/zinc/43/60/04/1125436004.db2.gz JFVXQSFVJPGFJW-FQEVSTJZSA-N 1 1 366.417 4.113 20 5 FIBDMO O=[N+]([O-])c1cccc2c(NC[C@H]3CC[N@@H+](Cc4ccccc4)C3)ccnc21 ZINC000312697206 1125454298 /nfs/dbraw/zinc/45/42/98/1125454298.db2.gz RDDXIHDLYNNGBE-QGZVFWFLSA-N 1 1 362.433 4.077 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000109102600 206046746 /nfs/dbraw/zinc/04/67/46/206046746.db2.gz LPRPWUWTAUQKLC-FQEVSTJZSA-N 1 1 367.449 4.377 20 5 FIBDMO C[C@H](O)c1ccc(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cc1 ZINC000290914182 567818940 /nfs/dbraw/zinc/81/89/40/567818940.db2.gz PRKBIZDOEDIYNS-JTQLQIEISA-N 1 1 355.221 4.245 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000072868712 567906315 /nfs/dbraw/zinc/90/63/15/567906315.db2.gz FHGGGQCDIFMKFL-HKUYNNGSSA-N 1 1 353.466 4.110 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000072868712 567906322 /nfs/dbraw/zinc/90/63/22/567906322.db2.gz FHGGGQCDIFMKFL-HKUYNNGSSA-N 1 1 353.466 4.110 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000072868712 567906324 /nfs/dbraw/zinc/90/63/24/567906324.db2.gz FHGGGQCDIFMKFL-HKUYNNGSSA-N 1 1 353.466 4.110 20 5 FIBDMO CCSCC[C@@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072901557 568056831 /nfs/dbraw/zinc/05/68/31/568056831.db2.gz XWGJWSKPPQLTII-CQSZACIVSA-N 1 1 363.483 4.256 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@@H]3c3ccccc3)n2)cc1 ZINC000568576683 568058571 /nfs/dbraw/zinc/05/85/71/568058571.db2.gz RUAATJIIYYJMIH-GOSISDBHSA-N 1 1 364.405 4.372 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@@H]3c3ccccc3)n2)cc1 ZINC000568576683 568058572 /nfs/dbraw/zinc/05/85/72/568058572.db2.gz RUAATJIIYYJMIH-GOSISDBHSA-N 1 1 364.405 4.372 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481715108 568093846 /nfs/dbraw/zinc/09/38/46/568093846.db2.gz WRFMFPATUWFOEK-IIBYNOLFSA-N 1 1 352.434 4.486 20 5 FIBDMO COc1ccc(C[N@H+]2CCCCC[C@H]2c2c(C)n[nH]c2C)cc1[N+](=O)[O-] ZINC000568918233 568252079 /nfs/dbraw/zinc/25/20/79/568252079.db2.gz WJNXOBRQBMHHRR-INIZCTEOSA-N 1 1 358.442 4.061 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000568933740 568253556 /nfs/dbraw/zinc/25/35/56/568253556.db2.gz RJUIENSMWASPLR-ATTAVLDOSA-N 1 1 364.445 4.113 20 5 FIBDMO O=C(CC[N@H+]1CC2(CCC2)[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000453029733 568255069 /nfs/dbraw/zinc/25/50/69/568255069.db2.gz XUVGUOYASGMEGA-FQEVSTJZSA-N 1 1 365.433 4.151 20 5 FIBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000569072542 568270533 /nfs/dbraw/zinc/27/05/33/568270533.db2.gz CARPSGBYEOJLFO-KRWDZBQOSA-N 1 1 369.465 4.103 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000604520784 568308007 /nfs/dbraw/zinc/30/80/07/568308007.db2.gz PTIRUKPDJCIWLV-UWJYYQICSA-N 1 1 370.449 4.203 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Nc3ccc(F)cc3)CC2)c(Cl)c1 ZINC000541998928 568412666 /nfs/dbraw/zinc/41/26/66/568412666.db2.gz IMXNLGUOGRCLKZ-UHFFFAOYSA-N 1 1 363.820 4.464 20 5 FIBDMO Cn1ccnc1[C@@H]([NH2+]CCCCC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000570189381 568460283 /nfs/dbraw/zinc/46/02/83/568460283.db2.gz PFNAWDNCCGQYPK-IBGZPJMESA-N 1 1 356.470 4.368 20 5 FIBDMO O=[N+]([O-])c1ccc(CNC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000312778837 1125488792 /nfs/dbraw/zinc/48/87/92/1125488792.db2.gz YRDFBCCANIHKPO-SFHVURJKSA-N 1 1 371.456 4.126 20 5 FIBDMO CCC(=O)c1ccc(NCc2ccc(C)[nH+]c2N2CCCC2)c([N+](=O)[O-])c1 ZINC000619489236 1125600100 /nfs/dbraw/zinc/60/01/00/1125600100.db2.gz NRNJFGFOJROAEA-UHFFFAOYSA-N 1 1 368.437 4.103 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000619531692 1125608663 /nfs/dbraw/zinc/60/86/63/1125608663.db2.gz YCDREHZXFAZCGT-HNNXBMFYSA-N 1 1 367.405 4.124 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000619722717 1125668289 /nfs/dbraw/zinc/66/82/89/1125668289.db2.gz UZGNKHJUQRPEIQ-HOTGVXAUSA-N 1 1 354.454 4.068 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000619722860 1125669486 /nfs/dbraw/zinc/66/94/86/1125669486.db2.gz HVUWWALHSVRWKM-HNNXBMFYSA-N 1 1 374.872 4.161 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2ccsc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000619782558 1125694939 /nfs/dbraw/zinc/69/49/39/1125694939.db2.gz CUGXCONWVHMQFK-JTQLQIEISA-N 1 1 372.393 4.160 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000430222990 1080016199 /nfs/dbraw/zinc/01/61/99/1080016199.db2.gz VORPZRCIKYEFSH-FXAWDEMLSA-N 1 1 374.412 4.095 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000134464261 1080239681 /nfs/dbraw/zinc/23/96/81/1080239681.db2.gz PRVWHCBVQRLAGJ-GFCCVEGCSA-N 1 1 371.384 4.450 20 5 FIBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC001167094641 1080340976 /nfs/dbraw/zinc/34/09/76/1080340976.db2.gz XHLAHNRZUKPINI-MRXNPFEDSA-N 1 1 360.841 4.464 20 5 FIBDMO C[C@H](CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)CC(C)(C)C ZINC000560548209 1081427390 /nfs/dbraw/zinc/42/73/90/1081427390.db2.gz DGOPJVFHJMCWKN-CRAIPNDOSA-N 1 1 358.486 4.470 20 5 FIBDMO Cc1ccc(C[NH2+][C@@H](C)c2nc(-c3ccncc3)cs2)cc1[N+](=O)[O-] ZINC000124043997 1081590623 /nfs/dbraw/zinc/59/06/23/1081590623.db2.gz HHBCLOACTQBEPK-ZDUSSCGKSA-N 1 1 354.435 4.273 20 5 FIBDMO C[C@H]1[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCC12CCOCC2 ZINC000580290953 1081802577 /nfs/dbraw/zinc/80/25/77/1081802577.db2.gz UFDUWNWDOSHJFQ-GFCCVEGCSA-N 1 1 358.360 4.005 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+](C)Cc3cnc(C)s3)o2)c([N+](=O)[O-])c1 ZINC000510404042 1082507887 /nfs/dbraw/zinc/50/78/87/1082507887.db2.gz LUJWGTVTRZEGPV-UHFFFAOYSA-N 1 1 373.434 4.260 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)Cc3cnc(C)s3)o2)c([N+](=O)[O-])c1 ZINC000510404042 1082507890 /nfs/dbraw/zinc/50/78/90/1082507890.db2.gz LUJWGTVTRZEGPV-UHFFFAOYSA-N 1 1 373.434 4.260 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510418536 1082544936 /nfs/dbraw/zinc/54/49/36/1082544936.db2.gz XIWNBPLKAFEADA-INIZCTEOSA-N 1 1 356.813 4.045 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510418536 1082544939 /nfs/dbraw/zinc/54/49/39/1082544939.db2.gz XIWNBPLKAFEADA-INIZCTEOSA-N 1 1 356.813 4.045 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC001167464446 1082593338 /nfs/dbraw/zinc/59/33/38/1082593338.db2.gz MAFZDWSPNGDUFQ-GVDBMIGSSA-N 1 1 367.449 4.108 20 5 FIBDMO CCOc1ccc([C@H]2CCC[N@@H+]2Cn2ncc3ccc([N+](=O)[O-])cc32)cc1 ZINC000023855450 1082670111 /nfs/dbraw/zinc/67/01/11/1082670111.db2.gz HWNPUWASPZNLIP-LJQANCHMSA-N 1 1 366.421 4.138 20 5 FIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cn2ncc3ccc([N+](=O)[O-])cc32)cc1 ZINC000023855450 1082670116 /nfs/dbraw/zinc/67/01/16/1082670116.db2.gz HWNPUWASPZNLIP-LJQANCHMSA-N 1 1 366.421 4.138 20 5 FIBDMO C[C@H](N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175910879 1082704585 /nfs/dbraw/zinc/70/45/85/1082704585.db2.gz GGJXWJLSDJASDK-UWVAXJGDSA-N 1 1 353.466 4.299 20 5 FIBDMO C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175910879 1082704591 /nfs/dbraw/zinc/70/45/91/1082704591.db2.gz GGJXWJLSDJASDK-UWVAXJGDSA-N 1 1 353.466 4.299 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1cnn(Cc2ccccc2)c1)c1ccccc1[N+](=O)[O-] ZINC000090853215 1082743189 /nfs/dbraw/zinc/74/31/89/1082743189.db2.gz FYLGRFVCSUXVTF-JKSUJKDBSA-N 1 1 350.422 4.251 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510473142 1082966595 /nfs/dbraw/zinc/96/65/95/1082966595.db2.gz PSOOYRPPTNTGGI-QAPCUYQASA-N 1 1 350.422 4.261 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@@H]4CCC[C@@H]43)o2)c(Cl)c1 ZINC000510632614 1083212837 /nfs/dbraw/zinc/21/28/37/1083212837.db2.gz HQHPFUIRRDJQRL-FUHWJXTLSA-N 1 1 362.813 4.262 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@@H]43)o2)c(Cl)c1 ZINC000510632614 1083212839 /nfs/dbraw/zinc/21/28/39/1083212839.db2.gz HQHPFUIRRDJQRL-FUHWJXTLSA-N 1 1 362.813 4.262 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](CCc1ccccn1)Cc1cccnc1 ZINC000430877461 1083220236 /nfs/dbraw/zinc/22/02/36/1083220236.db2.gz YGGHFAHHNHNQMO-TWGQIWQCSA-N 1 1 374.444 4.143 20 5 FIBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001167496450 1083526841 /nfs/dbraw/zinc/52/68/41/1083526841.db2.gz MBRADGCRQLZHDN-OCCSQVGLSA-N 1 1 373.316 4.463 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]3COCC[C@H]32)s1 ZINC000535799214 1083674532 /nfs/dbraw/zinc/67/45/32/1083674532.db2.gz HAEWTTXBRLNZOP-WMLDXEAASA-N 1 1 358.463 4.324 20 5 FIBDMO Cc1c([C@H](C)[NH2+]C[C@@H]2CCCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805891 1083718080 /nfs/dbraw/zinc/71/80/80/1083718080.db2.gz OCXGRIAPPBFCJH-ICSRJNTNSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c([C@H](C)NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805891 1083718087 /nfs/dbraw/zinc/71/80/87/1083718087.db2.gz OCXGRIAPPBFCJH-ICSRJNTNSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c([C@H](C)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805891 1083718093 /nfs/dbraw/zinc/71/80/93/1083718093.db2.gz OCXGRIAPPBFCJH-ICSRJNTNSA-N 1 1 367.493 4.466 20 5 FIBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])c2cccnc12)Cc1ccccc1 ZINC000024059492 1083721946 /nfs/dbraw/zinc/72/19/46/1083721946.db2.gz XJARTVZLVSYDFV-UHFFFAOYSA-N 1 1 350.422 4.077 20 5 FIBDMO CCc1ccc([C@H](N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407809 1083775790 /nfs/dbraw/zinc/77/57/90/1083775790.db2.gz NSDZXTJWUFYITN-YRISNDGFSA-N 1 1 369.465 4.056 20 5 FIBDMO Cc1ccc(-c2cnc(C[N@H+](C)CCc3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000548933331 1083846769 /nfs/dbraw/zinc/84/67/69/1083846769.db2.gz DHHFCRIDDGYAEW-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO Cc1ccc(-c2cnc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000548933331 1083846778 /nfs/dbraw/zinc/84/67/78/1083846778.db2.gz DHHFCRIDDGYAEW-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000612540006 1083902387 /nfs/dbraw/zinc/90/23/87/1083902387.db2.gz QGBCHCRTJYXEBB-HNAYVOBHSA-N 1 1 362.376 4.225 20 5 FIBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001167517183 1084434293 /nfs/dbraw/zinc/43/42/93/1084434293.db2.gz OJGKHQGWNZKEOR-SFHVURJKSA-N 1 1 369.465 4.103 20 5 FIBDMO COC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000580910889 1084485296 /nfs/dbraw/zinc/48/52/96/1084485296.db2.gz LFYDJGIOMUWMNN-MRXNPFEDSA-N 1 1 354.328 4.091 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(OCC(F)(F)F)c1 ZINC000511076189 1084654740 /nfs/dbraw/zinc/65/47/40/1084654740.db2.gz VUEJCAGBGQPGFH-UHFFFAOYSA-N 1 1 368.355 4.210 20 5 FIBDMO CC(C)[N@@H+](C)CC1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000582162149 1084668577 /nfs/dbraw/zinc/66/85/77/1084668577.db2.gz JASREIJVCQWVIG-UHFFFAOYSA-N 1 1 374.510 4.275 20 5 FIBDMO CCC[C@H](N[C@@H](C[NH+](C)C)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000551556830 1084678571 /nfs/dbraw/zinc/67/85/71/1084678571.db2.gz YATVLCNYOLFIRE-SFTDATJTSA-N 1 1 371.481 4.337 20 5 FIBDMO C[C@H](NCc1ccc(C[NH+]2CCCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000119890209 1084689214 /nfs/dbraw/zinc/68/92/14/1084689214.db2.gz YNWMJUCFCYOMAC-KRWDZBQOSA-N 1 1 353.466 4.432 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H]1c2ccccc2CC12CCOCC2 ZINC000582151289 1084716294 /nfs/dbraw/zinc/71/62/94/1084716294.db2.gz QTKBFJGVCDPCLG-IBGZPJMESA-N 1 1 372.852 4.432 20 5 FIBDMO O=[N+]([O-])c1cccc([C@H]([NH2+]Cc2cccc3c2OCO3)c2ccccc2)c1 ZINC000180191597 1084846681 /nfs/dbraw/zinc/84/66/81/1084846681.db2.gz FOPNKEFGLYAMAH-HXUWFJFHSA-N 1 1 362.385 4.203 20 5 FIBDMO Cn1ncc2c1CCC[C@@H]2[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000180208887 1084898285 /nfs/dbraw/zinc/89/82/85/1084898285.db2.gz ICFGEBCSSDXXMN-SFHVURJKSA-N 1 1 366.421 4.098 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](OC(F)F)C3)o2)cc1 ZINC000611609613 1085031188 /nfs/dbraw/zinc/03/11/88/1085031188.db2.gz TUGCNQHVQILKHA-AWEZNQCLSA-N 1 1 352.337 4.058 20 5 FIBDMO CCC(=O)c1ccc(NC[C@H](C)[N@@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC000479929864 1085348666 /nfs/dbraw/zinc/34/86/66/1085348666.db2.gz LWHXLTOKQCYDME-ZDUSSCGKSA-N 1 1 373.478 4.108 20 5 FIBDMO CCC(=O)c1ccc(NC[C@H](C)[N@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC000479929864 1085348669 /nfs/dbraw/zinc/34/86/69/1085348669.db2.gz LWHXLTOKQCYDME-ZDUSSCGKSA-N 1 1 373.478 4.108 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@](C)(CCc2ccccc2)C1 ZINC001167598739 1085378428 /nfs/dbraw/zinc/37/84/28/1085378428.db2.gz JSZYHRDYEBDEEZ-NRFANRHFSA-N 1 1 354.450 4.448 20 5 FIBDMO COC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccc(F)cc1 ZINC000549536661 1085466973 /nfs/dbraw/zinc/46/69/73/1085466973.db2.gz VFGNTGPFVHUDBZ-INIZCTEOSA-N 1 1 372.318 4.230 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(-c3c(F)cccc3F)n2)cc1[N+](=O)[O-] ZINC000181764266 1085529124 /nfs/dbraw/zinc/52/91/24/1085529124.db2.gz ZPANEHSKKXUOGJ-CYBMUJFWSA-N 1 1 372.375 4.218 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178651797 1085584842 /nfs/dbraw/zinc/58/48/42/1085584842.db2.gz FWVYRNZLRBPSEC-JKSUJKDBSA-N 1 1 359.495 4.219 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178651797 1085584851 /nfs/dbraw/zinc/58/48/51/1085584851.db2.gz FWVYRNZLRBPSEC-JKSUJKDBSA-N 1 1 359.495 4.219 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000045960001 1085647369 /nfs/dbraw/zinc/64/73/69/1085647369.db2.gz RTKXKNVNPRNFSH-ZDUSSCGKSA-N 1 1 368.865 4.024 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCC4(CCCCC4)C3)o2)cc1 ZINC000111324111 1085735651 /nfs/dbraw/zinc/73/56/51/1085735651.db2.gz VDZGVJANAVWYSR-UHFFFAOYSA-N 1 1 356.426 4.191 20 5 FIBDMO CCc1ccc([C@H](N[C@H]2CC[N@H+]3CCC[C@H]3C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407806 1085858311 /nfs/dbraw/zinc/85/83/11/1085858311.db2.gz NSDZXTJWUFYITN-DJPFJPOOSA-N 1 1 369.465 4.056 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H]3[C@@H]3CCCOC3)cs2)c1 ZINC000567472078 1085865609 /nfs/dbraw/zinc/86/56/09/1085865609.db2.gz QNDJNCBIPUNQJD-CRAIPNDOSA-N 1 1 373.478 4.109 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@]3(CCOC3)C2)ccc1Oc1ccc(F)cc1 ZINC000093820518 1086202158 /nfs/dbraw/zinc/20/21/58/1086202158.db2.gz QTLZHXKVZIGFKZ-FQEVSTJZSA-N 1 1 372.396 4.139 20 5 FIBDMO COc1ccc(C[N@H+]2CC[C@@H](C)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000511972694 1086473595 /nfs/dbraw/zinc/47/35/95/1086473595.db2.gz OMUPHUAKTZCTJA-OAHLLOKOSA-N 1 1 356.422 4.024 20 5 FIBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C12CCC2 ZINC001167664833 1086520654 /nfs/dbraw/zinc/52/06/54/1086520654.db2.gz VGBRZRKQNCDONM-HZPDHXFCSA-N 1 1 372.387 4.393 20 5 FIBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C12CCC2 ZINC001167664832 1086521050 /nfs/dbraw/zinc/52/10/50/1086521050.db2.gz VGBRZRKQNCDONM-HOTGVXAUSA-N 1 1 372.387 4.393 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432341341 1086633603 /nfs/dbraw/zinc/63/36/03/1086633603.db2.gz WIFNPWBIYZNRAY-SJORKVTESA-N 1 1 368.481 4.234 20 5 FIBDMO C[C@@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000512154511 1086847946 /nfs/dbraw/zinc/84/79/46/1086847946.db2.gz YOPSQRSUKHZXML-FOIQADDNSA-N 1 1 368.433 4.435 20 5 FIBDMO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000052907282 1087232205 /nfs/dbraw/zinc/23/22/05/1087232205.db2.gz ADULLAFMSJAXMQ-CYBMUJFWSA-N 1 1 361.829 4.188 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000052907282 1087232209 /nfs/dbraw/zinc/23/22/09/1087232209.db2.gz ADULLAFMSJAXMQ-CYBMUJFWSA-N 1 1 361.829 4.188 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+][C@H](CN2CCCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000480282600 1087331700 /nfs/dbraw/zinc/33/17/00/1087331700.db2.gz XLMXYIKAELHJDX-YLJYHZDGSA-N 1 1 353.466 4.391 20 5 FIBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000480410266 1087441259 /nfs/dbraw/zinc/44/12/59/1087441259.db2.gz ZPRAFICGMAHQLM-DOTOQJQBSA-N 1 1 362.433 4.390 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H]1c1cccc(F)c1 ZINC000472357973 1087782603 /nfs/dbraw/zinc/78/26/03/1087782603.db2.gz DGLLIFQKGSXHGF-JLTOFOAXSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H]1c1cccc(F)c1 ZINC000472357973 1087782619 /nfs/dbraw/zinc/78/26/19/1087782619.db2.gz DGLLIFQKGSXHGF-JLTOFOAXSA-N 1 1 371.412 4.064 20 5 FIBDMO C[C@H]([NH2+]Cc1cn2cc(Cl)cc(Cl)c2n1)c1cccc([N+](=O)[O-])c1 ZINC000180445387 1087918909 /nfs/dbraw/zinc/91/89/09/1087918909.db2.gz ZRTQGLIFNSAFCI-JTQLQIEISA-N 1 1 365.220 4.400 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000414566731 1088833365 /nfs/dbraw/zinc/83/33/65/1088833365.db2.gz XHVQIDRUEOOYBR-PNWMKBJFSA-N 1 1 364.445 4.462 20 5 FIBDMO CC[N@@H+](Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[C@H](C)CO ZINC000430090758 1088968826 /nfs/dbraw/zinc/96/88/26/1088968826.db2.gz TUUIGGUUSJGSAJ-CYBMUJFWSA-N 1 1 364.829 4.243 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](c3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000434891565 1089098110 /nfs/dbraw/zinc/09/81/10/1089098110.db2.gz IYAINUNAZZKEDM-RYRKJORJSA-N 1 1 367.449 4.108 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(Br)s1 ZINC000549171210 1089110758 /nfs/dbraw/zinc/11/07/58/1089110758.db2.gz OCNYOLGSWZBJFC-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000434896710 1089114628 /nfs/dbraw/zinc/11/46/28/1089114628.db2.gz QAHCFWVEYSRZSZ-APWZRJJASA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cccc(C)c1NC(=O)CCC[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549172728 1089118582 /nfs/dbraw/zinc/11/85/82/1089118582.db2.gz NYRVEBBQGZSCMP-UHFFFAOYSA-N 1 1 369.465 4.105 20 5 FIBDMO COc1ccc(-c2ccc(C[NH2+][C@@H](C)c3ccncc3F)o2)c([N+](=O)[O-])c1 ZINC000510025291 1089353992 /nfs/dbraw/zinc/35/39/92/1089353992.db2.gz BOCCYRYAACIRSL-LBPRGKRZSA-N 1 1 371.368 4.248 20 5 FIBDMO COc1cc(C)c([C@@H](C)[NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])cc1OC ZINC000119661410 1089679681 /nfs/dbraw/zinc/67/96/81/1089679681.db2.gz ROGUZUVAEMBHHF-GFCCVEGCSA-N 1 1 364.829 4.425 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H](CN1CCCC1)c1ccccc1 ZINC000515072345 1089772365 /nfs/dbraw/zinc/77/23/65/1089772365.db2.gz JFNYBMXVMDLFFB-UXHICEINSA-N 1 1 351.450 4.009 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@H](C)O1 ZINC000435768892 1089927231 /nfs/dbraw/zinc/92/72/31/1089927231.db2.gz SKUSOYXAQMGPDG-TXEJJXNPSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@H](C)O1 ZINC000435768892 1089927233 /nfs/dbraw/zinc/92/72/33/1089927233.db2.gz SKUSOYXAQMGPDG-TXEJJXNPSA-N 1 1 350.802 4.117 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+](Cc3ccccc3)C3CC3)o2)c1 ZINC000104666156 1090289060 /nfs/dbraw/zinc/28/90/60/1090289060.db2.gz AXTJHRAYFBJAFS-UHFFFAOYSA-N 1 1 363.417 4.457 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000511622820 1090855378 /nfs/dbraw/zinc/85/53/78/1090855378.db2.gz LRJMPVKUTJVTFA-GOSISDBHSA-N 1 1 373.840 4.332 20 5 FIBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500133049 1091059399 /nfs/dbraw/zinc/05/93/99/1091059399.db2.gz OXXRZANIKWOKNO-FQEVSTJZSA-N 1 1 355.438 4.253 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)o1 ZINC000566593088 1091081200 /nfs/dbraw/zinc/08/12/00/1091081200.db2.gz WMPXULAXVOZUMY-VQTJNVASSA-N 1 1 368.433 4.388 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)c2ccc(Cl)c(F)c2)C2CC2)cc1 ZINC000759854453 1091336874 /nfs/dbraw/zinc/33/68/74/1091336874.db2.gz XHSNFIRPTVRCHS-GOSISDBHSA-N 1 1 364.804 4.085 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1cccc(Br)n1)c1ccccc1[N+](=O)[O-] ZINC000925693659 1091408395 /nfs/dbraw/zinc/40/83/95/1091408395.db2.gz QNLNMCNNTKNZNE-MNOVXSKESA-N 1 1 350.216 4.164 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@@H]32)c(Cl)c1 ZINC000511764954 1091650379 /nfs/dbraw/zinc/65/03/79/1091650379.db2.gz KGZYDFJGWBDDSD-GGPKGHCWSA-N 1 1 372.852 4.253 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1N1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000432165296 1091775000 /nfs/dbraw/zinc/77/50/00/1091775000.db2.gz SHFOQBMYJCJNCR-CYBMUJFWSA-N 1 1 360.845 4.165 20 5 FIBDMO CCN1CCC([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000236920470 1091923464 /nfs/dbraw/zinc/92/34/64/1091923464.db2.gz LKHBBNSCEXUKHW-UHFFFAOYSA-N 1 1 373.428 4.100 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512291897 1092013159 /nfs/dbraw/zinc/01/31/59/1092013159.db2.gz MRJNOKYWEUVXJG-MRXNPFEDSA-N 1 1 367.449 4.457 20 5 FIBDMO CC[C@H]1C[C@]1([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccc(C)c1 ZINC000500532867 1092195566 /nfs/dbraw/zinc/19/55/66/1092195566.db2.gz LUNJQUVNJLROHF-LAUBAEHRSA-N 1 1 368.433 4.185 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(-c2ccc(F)cc2)o1 ZINC000544185925 1092232616 /nfs/dbraw/zinc/23/26/16/1092232616.db2.gz UXZQGJCDZWFVBN-UHFFFAOYSA-N 1 1 356.353 4.292 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000432769961 1092312957 /nfs/dbraw/zinc/31/29/57/1092312957.db2.gz FMORIIINZMFSAX-AWEZNQCLSA-N 1 1 367.405 4.281 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000432769961 1092312964 /nfs/dbraw/zinc/31/29/64/1092312964.db2.gz FMORIIINZMFSAX-AWEZNQCLSA-N 1 1 367.405 4.281 20 5 FIBDMO CCOc1ccc([C@H]2CCC[N@@H+]2Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015372248 1092455617 /nfs/dbraw/zinc/45/56/17/1092455617.db2.gz RETOSWQNIWOGQQ-LJQANCHMSA-N 1 1 356.422 4.339 20 5 FIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015372248 1092455622 /nfs/dbraw/zinc/45/56/22/1092455622.db2.gz RETOSWQNIWOGQQ-LJQANCHMSA-N 1 1 356.422 4.339 20 5 FIBDMO C[NH+](C)Cc1cc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)ccc1Cl ZINC000500748617 1092493002 /nfs/dbraw/zinc/49/30/02/1092493002.db2.gz HUSYLWCRASQFIW-UHFFFAOYSA-N 1 1 372.812 4.043 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)c1C ZINC001271022834 1092533455 /nfs/dbraw/zinc/53/34/55/1092533455.db2.gz IPYKWOHDCWLXMZ-UHFFFAOYSA-N 1 1 361.829 4.179 20 5 FIBDMO CCN1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000236920731 1092741890 /nfs/dbraw/zinc/74/18/90/1092741890.db2.gz GOGQGQRGAGTPCT-UHFFFAOYSA-N 1 1 363.845 4.082 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC4(CCC4)[C@@H]3[C@H]3CCCO3)o2)cc1 ZINC000572807656 1092907529 /nfs/dbraw/zinc/90/75/29/1092907529.db2.gz CIOACHDBUFQVCA-UXHICEINSA-N 1 1 368.433 4.388 20 5 FIBDMO Cc1ccc(C)c(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000432891778 1092909271 /nfs/dbraw/zinc/90/92/71/1092909271.db2.gz NCWHDKWKACTEEJ-UHFFFAOYSA-N 1 1 364.449 4.244 20 5 FIBDMO COc1ccc(OC)c(C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C(C)(C)C)c1 ZINC001168018780 1093173741 /nfs/dbraw/zinc/17/37/41/1093173741.db2.gz UZTKVKUOCWXADC-UHFFFAOYSA-N 1 1 372.465 4.455 20 5 FIBDMO C[C@@H](CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCCC[C@@H]1C ZINC000522196445 1093201140 /nfs/dbraw/zinc/20/11/40/1093201140.db2.gz ZUDNFUTVYPFUEH-GJZGRUSLSA-N 1 1 374.510 4.071 20 5 FIBDMO C[C@]1(c2ccccc2)CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000522223730 1093218934 /nfs/dbraw/zinc/21/89/34/1093218934.db2.gz CKMATGPEWQIBCR-NRFANRHFSA-N 1 1 368.433 4.015 20 5 FIBDMO Cc1ccc(C)c([C@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000474212786 1093586617 /nfs/dbraw/zinc/58/66/17/1093586617.db2.gz ONBUNQIEEQHKEJ-HXUWFJFHSA-N 1 1 367.449 4.012 20 5 FIBDMO C[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(C2CC2)cc1 ZINC000419333639 1093661568 /nfs/dbraw/zinc/66/15/68/1093661568.db2.gz FUMBVZFUYXVELW-CYBMUJFWSA-N 1 1 364.405 4.373 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](c4c(F)cccc4F)C3)nc2c1 ZINC000185326145 1093702450 /nfs/dbraw/zinc/70/24/50/1093702450.db2.gz HTXFDTPAJXNRQJ-LLVKDONJSA-N 1 1 359.332 4.004 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4c(F)cccc4F)C3)nc2c1 ZINC000185326145 1093702458 /nfs/dbraw/zinc/70/24/58/1093702458.db2.gz HTXFDTPAJXNRQJ-LLVKDONJSA-N 1 1 359.332 4.004 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)cc1 ZINC000052611833 1093836943 /nfs/dbraw/zinc/83/69/43/1093836943.db2.gz FTDYMOSEIYEGKB-INIZCTEOSA-N 1 1 351.406 4.158 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cccnc1OCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000151120297 1093907738 /nfs/dbraw/zinc/90/77/38/1093907738.db2.gz GXWMEGHJDKANPN-OAHLLOKOSA-N 1 1 369.343 4.172 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000513242607 1094033655 /nfs/dbraw/zinc/03/36/55/1094033655.db2.gz VBFNSVOJMDSKPQ-KDOFPFPSSA-N 1 1 364.405 4.228 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000513277619 1094044942 /nfs/dbraw/zinc/04/49/42/1094044942.db2.gz YYEXHAKRNPKINL-LIRRHRJNSA-N 1 1 354.406 4.044 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000501080896 1094496089 /nfs/dbraw/zinc/49/60/89/1094496089.db2.gz ZFHDVTDJVIJRFV-AWEZNQCLSA-N 1 1 359.401 4.146 20 5 FIBDMO C[C@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000413233267 1094765059 /nfs/dbraw/zinc/76/50/59/1094765059.db2.gz CRUGBYBBHAQPMX-NWDGAFQWSA-N 1 1 372.391 4.074 20 5 FIBDMO CC(C)[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccsc1 ZINC000421016771 1095252490 /nfs/dbraw/zinc/25/24/90/1095252490.db2.gz VAEHPQIWJJKDAT-AWEZNQCLSA-N 1 1 361.467 4.091 20 5 FIBDMO CC(C)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccsc1 ZINC000421016771 1095252499 /nfs/dbraw/zinc/25/24/99/1095252499.db2.gz VAEHPQIWJJKDAT-AWEZNQCLSA-N 1 1 361.467 4.091 20 5 FIBDMO Cc1ccc(C(C)(C)C[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000444173661 1095810421 /nfs/dbraw/zinc/81/04/21/1095810421.db2.gz DMEUKGQMTXCYEY-UHFFFAOYSA-N 1 1 369.465 4.060 20 5 FIBDMO Cc1ccc(C(C)(C)C[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000444173661 1095810440 /nfs/dbraw/zinc/81/04/40/1095810440.db2.gz DMEUKGQMTXCYEY-UHFFFAOYSA-N 1 1 369.465 4.060 20 5 FIBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H](C)CC(=O)Nc1ccccc1 ZINC000502938421 1095981182 /nfs/dbraw/zinc/98/11/82/1095981182.db2.gz HQAQPSPWOFFEIT-MRXNPFEDSA-N 1 1 355.438 4.224 20 5 FIBDMO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425420119 1098570505 /nfs/dbraw/zinc/57/05/05/1098570505.db2.gz LWTFKKQSXWWDNV-OAHLLOKOSA-N 1 1 364.243 4.335 20 5 FIBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425420119 1098570515 /nfs/dbraw/zinc/57/05/15/1098570515.db2.gz LWTFKKQSXWWDNV-OAHLLOKOSA-N 1 1 364.243 4.335 20 5 FIBDMO CC(C)[N@H+](Cc1cccs1)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000532926244 1098597161 /nfs/dbraw/zinc/59/71/61/1098597161.db2.gz BYRHZGCQPLCPFU-UHFFFAOYSA-N 1 1 358.423 4.117 20 5 FIBDMO CC(C)[N@@H+](Cc1cccs1)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000532926244 1098597168 /nfs/dbraw/zinc/59/71/68/1098597168.db2.gz BYRHZGCQPLCPFU-UHFFFAOYSA-N 1 1 358.423 4.117 20 5 FIBDMO Cc1ccc([C@H](C)[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c(C)c1 ZINC000532930493 1098603815 /nfs/dbraw/zinc/60/38/15/1098603815.db2.gz QBPOSHPPDIOUEN-INIZCTEOSA-N 1 1 355.438 4.152 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c(C)c1 ZINC000532930493 1098603822 /nfs/dbraw/zinc/60/38/22/1098603822.db2.gz QBPOSHPPDIOUEN-INIZCTEOSA-N 1 1 355.438 4.152 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+](CC3CCCCC3)C3CC3)n2)cc1 ZINC000532920762 1098610733 /nfs/dbraw/zinc/61/07/33/1098610733.db2.gz UGTJMOLHOWKUFI-UHFFFAOYSA-N 1 1 356.426 4.190 20 5 FIBDMO C[C@H](C[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-])c1nccs1 ZINC000425453267 1098695833 /nfs/dbraw/zinc/69/58/33/1098695833.db2.gz DXBHIAOUFCNEBJ-SNVBAGLBSA-N 1 1 370.272 4.049 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@H]3C3CCCC3)o2)c1 ZINC000533251897 1098913329 /nfs/dbraw/zinc/91/33/29/1098913329.db2.gz APVSIEQTALSROH-GOSISDBHSA-N 1 1 355.438 4.447 20 5 FIBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000533293961 1098941949 /nfs/dbraw/zinc/94/19/49/1098941949.db2.gz BNLBCBBJGWBMGI-OAHLLOKOSA-N 1 1 366.421 4.016 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000533400046 1099008155 /nfs/dbraw/zinc/00/81/55/1099008155.db2.gz CRYUEYVEJZMEJS-GOSISDBHSA-N 1 1 367.449 4.111 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000533438756 1099041903 /nfs/dbraw/zinc/04/19/03/1099041903.db2.gz OYDKAOHLGOBCOR-SJORKVTESA-N 1 1 367.449 4.028 20 5 FIBDMO COc1ccc2[nH]cc(C3=CC[N@@H+](Cc4cccc([N+](=O)[O-])c4)CC3)c2c1 ZINC000533487933 1099109466 /nfs/dbraw/zinc/10/94/66/1099109466.db2.gz UXSSMFUAOMRPOE-UHFFFAOYSA-N 1 1 363.417 4.374 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000505845043 1099109972 /nfs/dbraw/zinc/10/99/72/1099109972.db2.gz JWCDSAVNYNXWQY-NCUBBLFSSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000505845043 1099109976 /nfs/dbraw/zinc/10/99/76/1099109976.db2.gz JWCDSAVNYNXWQY-NCUBBLFSSA-N 1 1 365.433 4.020 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000192464111 1099772054 /nfs/dbraw/zinc/77/20/54/1099772054.db2.gz SFJHIZLDCCQWTD-AWEZNQCLSA-N 1 1 356.397 4.390 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000192464121 1099772576 /nfs/dbraw/zinc/77/25/76/1099772576.db2.gz SFJHIZLDCCQWTD-CQSZACIVSA-N 1 1 356.397 4.390 20 5 FIBDMO O=[N+]([O-])c1ccc(NCCC[N@H+]2CCc3ccccc3C2)c2ncccc12 ZINC000506046924 1099911487 /nfs/dbraw/zinc/91/14/87/1099911487.db2.gz DWXXJAIYXWXISD-UHFFFAOYSA-N 1 1 362.433 4.003 20 5 FIBDMO Cc1ccc(C[N@H+](C)Cc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000506088796 1100055018 /nfs/dbraw/zinc/05/50/18/1100055018.db2.gz ZQCDNHIJFFAFRC-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000506088796 1100055028 /nfs/dbraw/zinc/05/50/28/1100055028.db2.gz ZQCDNHIJFFAFRC-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO O=C(CC[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000517108642 1100076339 /nfs/dbraw/zinc/07/63/39/1100076339.db2.gz GOSBHIRHOCHIOZ-HNNXBMFYSA-N 1 1 373.840 4.066 20 5 FIBDMO CC[C@H]([NH2+]Cc1cccc(O)c1Br)c1cccc([N+](=O)[O-])c1 ZINC000459414510 1100139131 /nfs/dbraw/zinc/13/91/31/1100139131.db2.gz AABKOYHTVRUPOJ-AWEZNQCLSA-N 1 1 365.227 4.304 20 5 FIBDMO C[N@H+](Cc1ccc[nH]1)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000536667284 1100142894 /nfs/dbraw/zinc/14/28/94/1100142894.db2.gz WCFGCVKCFWMOOL-UHFFFAOYSA-N 1 1 355.369 4.486 20 5 FIBDMO C[N@@H+](Cc1ccc[nH]1)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000536667284 1100142901 /nfs/dbraw/zinc/14/29/01/1100142901.db2.gz WCFGCVKCFWMOOL-UHFFFAOYSA-N 1 1 355.369 4.486 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000459650295 1100393182 /nfs/dbraw/zinc/39/31/82/1100393182.db2.gz XLLPIRSQQQPIQC-CZUORRHYSA-N 1 1 372.387 4.337 20 5 FIBDMO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc(Br)o1 ZINC000506232782 1100655888 /nfs/dbraw/zinc/65/58/88/1100655888.db2.gz LBJCNFWBOOKDOU-GQCTYLIASA-N 1 1 351.200 4.096 20 5 FIBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc(Br)o1 ZINC000506232782 1100655889 /nfs/dbraw/zinc/65/58/89/1100655889.db2.gz LBJCNFWBOOKDOU-GQCTYLIASA-N 1 1 351.200 4.096 20 5 FIBDMO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCO1 ZINC000506368527 1100933774 /nfs/dbraw/zinc/93/37/74/1100933774.db2.gz IXNJJXTZQYMSJK-CYBMUJFWSA-N 1 1 350.802 4.119 20 5 FIBDMO CC[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCO1 ZINC000506368527 1100933779 /nfs/dbraw/zinc/93/37/79/1100933779.db2.gz IXNJJXTZQYMSJK-CYBMUJFWSA-N 1 1 350.802 4.119 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@H]23)s1 ZINC000518267715 1101050344 /nfs/dbraw/zinc/05/03/44/1101050344.db2.gz QQOUACLRJNBPEV-SJLPKXTDSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@H+]3CCCC[C@H]23)s1 ZINC000518267715 1101050352 /nfs/dbraw/zinc/05/03/52/1101050352.db2.gz QQOUACLRJNBPEV-SJLPKXTDSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2CCN(C3CCC3)CC2)s1 ZINC000518276841 1101070835 /nfs/dbraw/zinc/07/08/35/1101070835.db2.gz VYASUKATDHMTKU-UHFFFAOYSA-N 1 1 371.506 4.430 20 5 FIBDMO CC(C)[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1cccc(F)c1 ZINC000518600077 1101346416 /nfs/dbraw/zinc/34/64/16/1101346416.db2.gz CTIDEBDHGYMFAL-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO CC(C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1cccc(F)c1 ZINC000518600077 1101346432 /nfs/dbraw/zinc/34/64/32/1101346432.db2.gz CTIDEBDHGYMFAL-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO COc1cc(C[NH2+][C@H](C)c2cc3cccc(F)c3o2)c([N+](=O)[O-])cc1F ZINC000475706227 1101387676 /nfs/dbraw/zinc/38/76/76/1101387676.db2.gz WKUUFTLFYHSMCK-SNVBAGLBSA-N 1 1 362.332 4.479 20 5 FIBDMO C[C@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000152364614 1101783424 /nfs/dbraw/zinc/78/34/24/1101783424.db2.gz IUMYNSVXLBVUDQ-LSDHHAIUSA-N 1 1 371.506 4.458 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCOC(C)(C)C1 ZINC000550105054 1102493807 /nfs/dbraw/zinc/49/38/07/1102493807.db2.gz GMNDLDFNIVIYJG-CQSZACIVSA-N 1 1 360.376 4.393 20 5 FIBDMO COc1cc(C[NH+]2CCC(Nc3cccc(C)c3)CC2)c([N+](=O)[O-])cc1F ZINC000184262657 1102674275 /nfs/dbraw/zinc/67/42/75/1102674275.db2.gz JFHRPAIDJSITOF-UHFFFAOYSA-N 1 1 373.428 4.127 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2cccc(OC(C)C)c2)c([N+](=O)[O-])cc1F ZINC000184302667 1102807007 /nfs/dbraw/zinc/80/70/07/1102807007.db2.gz WKVDSNAYGACHLX-ZDUSSCGKSA-N 1 1 362.401 4.381 20 5 FIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(Br)c(F)c1 ZINC000507119968 1103126727 /nfs/dbraw/zinc/12/67/27/1103126727.db2.gz ITBUPCPIYLFLHN-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(Br)c(F)c1 ZINC000507119968 1103126734 /nfs/dbraw/zinc/12/67/34/1103126734.db2.gz ITBUPCPIYLFLHN-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO Cc1cccc(-c2n[nH]cc2C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000507166817 1103166903 /nfs/dbraw/zinc/16/69/03/1103166903.db2.gz FOAHOODZKOHXMR-UHFFFAOYSA-N 1 1 362.433 4.458 20 5 FIBDMO Cc1cccc(-c2n[nH]cc2C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000507166817 1103166906 /nfs/dbraw/zinc/16/69/06/1103166906.db2.gz FOAHOODZKOHXMR-UHFFFAOYSA-N 1 1 362.433 4.458 20 5 FIBDMO COc1cc(OC)c(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(OC)c1 ZINC000507151468 1103169361 /nfs/dbraw/zinc/16/93/61/1103169361.db2.gz GKMRSPUHZSUZJQ-UHFFFAOYSA-N 1 1 374.437 4.031 20 5 FIBDMO COc1cc(OC)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(OC)c1 ZINC000507151468 1103169369 /nfs/dbraw/zinc/16/93/69/1103169369.db2.gz GKMRSPUHZSUZJQ-UHFFFAOYSA-N 1 1 374.437 4.031 20 5 FIBDMO Cc1nn(-c2ccccc2)cc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507155638 1103174374 /nfs/dbraw/zinc/17/43/74/1103174374.db2.gz PSFZCRVVOBGDCR-UHFFFAOYSA-N 1 1 362.433 4.254 20 5 FIBDMO Cc1nn(-c2ccccc2)cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507155638 1103174380 /nfs/dbraw/zinc/17/43/80/1103174380.db2.gz PSFZCRVVOBGDCR-UHFFFAOYSA-N 1 1 362.433 4.254 20 5 FIBDMO C[C@H]([NH2+]Cc1cc(F)c(F)cc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000507242328 1103237198 /nfs/dbraw/zinc/23/71/98/1103237198.db2.gz FLEHVRVIFDWQFV-VIFPVBQESA-N 1 1 371.181 4.486 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]3[C@@H]3CCCO3)s2)cc1 ZINC000551563860 1103365604 /nfs/dbraw/zinc/36/56/04/1103365604.db2.gz KWVVDPFFISGUPZ-ROUUACIJSA-N 1 1 358.463 4.467 20 5 FIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)C2CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000507432602 1103385804 /nfs/dbraw/zinc/38/58/04/1103385804.db2.gz INBRUESQMSLSEL-HNNXBMFYSA-N 1 1 370.449 4.413 20 5 FIBDMO Cc1c([C@H](C)[NH2+][C@H](CO)c2cccc(Cl)c2F)cccc1[N+](=O)[O-] ZINC000467414316 1104061033 /nfs/dbraw/zinc/06/10/33/1104061033.db2.gz SRJCMWZUYXBCPA-XHDPSFHLSA-N 1 1 352.793 4.080 20 5 FIBDMO CCc1ccc(C[NH+]2CCN([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)s1 ZINC000441409222 1104336310 /nfs/dbraw/zinc/33/63/10/1104336310.db2.gz ZKMJCRLGTNBUNG-HNNXBMFYSA-N 1 1 359.495 4.098 20 5 FIBDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000428079062 1105365831 /nfs/dbraw/zinc/36/58/31/1105365831.db2.gz OWXWWUOQTDCFMB-IBGZPJMESA-N 1 1 374.412 4.262 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H](c3ccncc3)C2)c1 ZINC000451006958 1106884466 /nfs/dbraw/zinc/88/44/66/1106884466.db2.gz WSRFJBGEPOJLQR-CQSZACIVSA-N 1 1 365.355 4.388 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nnc(-c4ccccc4)o3)C2)cc1 ZINC000451546391 1107166477 /nfs/dbraw/zinc/16/64/77/1107166477.db2.gz JFROACGATGQNEY-KRWDZBQOSA-N 1 1 364.405 4.024 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2c2cc(C)ccc2C)c1 ZINC001168134159 1107431340 /nfs/dbraw/zinc/43/13/40/1107431340.db2.gz JFQYYLXVCFXILN-FQEVSTJZSA-N 1 1 368.433 4.335 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC001168135012 1107487920 /nfs/dbraw/zinc/48/79/20/1107487920.db2.gz UGGQEDIPZVOQQE-OAHLLOKOSA-N 1 1 358.438 4.151 20 5 FIBDMO Cc1cccc(CC2(O)CC[NH+](Cc3ccc([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000475510147 1107604911 /nfs/dbraw/zinc/60/49/11/1107604911.db2.gz GBOQRTNBQDLZGH-UHFFFAOYSA-N 1 1 374.868 4.126 20 5 FIBDMO CCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1ccccc1OC ZINC000444610616 1108018413 /nfs/dbraw/zinc/01/84/13/1108018413.db2.gz OWTMDRPXLGCGBA-AWEZNQCLSA-N 1 1 368.437 4.453 20 5 FIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1ccccc1OC ZINC000444610616 1108018425 /nfs/dbraw/zinc/01/84/25/1108018425.db2.gz OWTMDRPXLGCGBA-AWEZNQCLSA-N 1 1 368.437 4.453 20 5 FIBDMO CC(C)[C@@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)N1CCCC1 ZINC000520207393 1108022197 /nfs/dbraw/zinc/02/21/97/1108022197.db2.gz URLOEBLIBCPPDI-LJQANCHMSA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1cc(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)ccc1F ZINC000444736858 1108123059 /nfs/dbraw/zinc/12/30/59/1108123059.db2.gz POPQDDUJDBDIPQ-UHFFFAOYSA-N 1 1 369.396 4.372 20 5 FIBDMO CCC[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CC(C)(C)C(N)=O)C1 ZINC000453282842 1108359416 /nfs/dbraw/zinc/35/94/16/1108359416.db2.gz OIRVTEFUUOPZHJ-YJBOKZPZSA-N 1 1 361.486 4.050 20 5 FIBDMO COc1ccc(C[NH2+]Cc2sc(C)cc2Br)cc1[N+](=O)[O-] ZINC000453588836 1108646394 /nfs/dbraw/zinc/64/63/94/1108646394.db2.gz MHQWFFWPRTTXCY-UHFFFAOYSA-N 1 1 371.256 4.026 20 5 FIBDMO Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)o1 ZINC000524752946 1109138403 /nfs/dbraw/zinc/13/84/03/1109138403.db2.gz MEELWDUPZIFESX-FZKQIMNGSA-N 1 1 372.421 4.336 20 5 FIBDMO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)o1 ZINC000524752946 1109138405 /nfs/dbraw/zinc/13/84/05/1109138405.db2.gz MEELWDUPZIFESX-FZKQIMNGSA-N 1 1 372.421 4.336 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H](c1ncc[nH]1)c1ccc(F)cc1 ZINC000446887435 1109383938 /nfs/dbraw/zinc/38/39/38/1109383938.db2.gz SVEISOBYXPYFAJ-KRWDZBQOSA-N 1 1 374.803 4.032 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccccc1)C(C)(C)CO ZINC000429726110 1109606908 /nfs/dbraw/zinc/60/69/08/1109606908.db2.gz QHUFVYMLEKXJLT-FQEVSTJZSA-N 1 1 372.465 4.231 20 5 FIBDMO CSCc1cnc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449500399 1110094061 /nfs/dbraw/zinc/09/40/61/1110094061.db2.gz NLMIRMBZWJXDFF-CQSZACIVSA-N 1 1 363.508 4.294 20 5 FIBDMO CSCc1cnc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449500399 1110094065 /nfs/dbraw/zinc/09/40/65/1110094065.db2.gz NLMIRMBZWJXDFF-CQSZACIVSA-N 1 1 363.508 4.294 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000026363314 1110244292 /nfs/dbraw/zinc/24/42/92/1110244292.db2.gz NAMYQKHEEJQDOB-STQMWFEESA-N 1 1 361.829 4.234 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cccc(C(=O)OC)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000450680801 1110329077 /nfs/dbraw/zinc/32/90/77/1110329077.db2.gz LLQYSMLVIFVSRM-MRXNPFEDSA-N 1 1 362.813 4.276 20 5 FIBDMO COc1cc(C[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000538721073 1111261975 /nfs/dbraw/zinc/26/19/75/1111261975.db2.gz MIMIUDILAJAACG-ZFWWWQNUSA-N 1 1 374.412 4.129 20 5 FIBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000538738174 1111271522 /nfs/dbraw/zinc/27/15/22/1111271522.db2.gz DRFGHHJCASADIF-MAUKXSAKSA-N 1 1 357.454 4.159 20 5 FIBDMO CCN1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000538738174 1111271533 /nfs/dbraw/zinc/27/15/33/1111271533.db2.gz DRFGHHJCASADIF-MAUKXSAKSA-N 1 1 357.454 4.159 20 5 FIBDMO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000538738174 1111271537 /nfs/dbraw/zinc/27/15/37/1111271537.db2.gz DRFGHHJCASADIF-MAUKXSAKSA-N 1 1 357.454 4.159 20 5 FIBDMO C[C@H]1C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCCO1 ZINC000538740383 1111273462 /nfs/dbraw/zinc/27/34/62/1111273462.db2.gz KPZORINNOFEZIX-AWEZNQCLSA-N 1 1 360.385 4.137 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCCO1 ZINC000538740383 1111273464 /nfs/dbraw/zinc/27/34/64/1111273464.db2.gz KPZORINNOFEZIX-AWEZNQCLSA-N 1 1 360.385 4.137 20 5 FIBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)cc1[N+](=O)[O-] ZINC000539070520 1111417896 /nfs/dbraw/zinc/41/78/96/1111417896.db2.gz GXFSQPRFSQVDSA-JTQLQIEISA-N 1 1 370.327 4.195 20 5 FIBDMO Cc1cc(NC[C@@H]2CCCn3cc[nH+]c32)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461936099 1111432010 /nfs/dbraw/zinc/43/20/10/1111432010.db2.gz QLQMCVRMHXAEHW-NSHDSACASA-N 1 1 354.332 4.108 20 5 FIBDMO C[C@@H]1CCC[C@H](CC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552042456 1111554824 /nfs/dbraw/zinc/55/48/24/1111554824.db2.gz GONRTSQOSRRXNL-MDZRGWNJSA-N 1 1 356.470 4.224 20 5 FIBDMO C[C@H](CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000552048927 1111557686 /nfs/dbraw/zinc/55/76/86/1111557686.db2.gz DCOUHQISXOOXMT-UZLBHIALSA-N 1 1 364.449 4.201 20 5 FIBDMO Cn1ccnc1[C@@H]([NH2+]CCCC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000552253632 1111645520 /nfs/dbraw/zinc/64/55/20/1111645520.db2.gz MSRFJYMIXGRDJD-IBGZPJMESA-N 1 1 356.470 4.368 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)CCOc1cccc([N+](=O)[O-])c1)CCC2 ZINC000478047015 1111664113 /nfs/dbraw/zinc/66/41/13/1111664113.db2.gz KVIFQAGGHKSSJP-MRXNPFEDSA-N 1 1 361.467 4.002 20 5 FIBDMO C[C@@H](O)CC[N@@H+](C)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000552300449 1111666012 /nfs/dbraw/zinc/66/60/12/1111666012.db2.gz HMDQQOQMNHRRGU-CYBMUJFWSA-N 1 1 364.829 4.243 20 5 FIBDMO Cn1cc(C[N@H+]2CC(C)(C)[C@H]3CCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000552406907 1111697969 /nfs/dbraw/zinc/69/79/69/1111697969.db2.gz XCRVOCSAUXNJDT-ROUUACIJSA-N 1 1 354.454 4.006 20 5 FIBDMO CC(C)=CC[NH2+][C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000479484175 1112040381 /nfs/dbraw/zinc/04/03/81/1112040381.db2.gz ZPJXUVZIUFANFS-GOSISDBHSA-N 1 1 373.840 4.484 20 5 FIBDMO C[C@H](NCc1ccccc1C[NH+]1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000480435745 1112425140 /nfs/dbraw/zinc/42/51/40/1112425140.db2.gz GZJDFLMWEAQBAC-KRWDZBQOSA-N 1 1 353.466 4.432 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@H](Nc3ccccc3)C2)c1 ZINC000555417058 1112830646 /nfs/dbraw/zinc/83/06/46/1112830646.db2.gz RQFXLPWPNZBVAD-OAHLLOKOSA-N 1 1 365.355 4.300 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](Nc3ccccc3)C2)c1 ZINC000555417058 1112830653 /nfs/dbraw/zinc/83/06/53/1112830653.db2.gz RQFXLPWPNZBVAD-OAHLLOKOSA-N 1 1 365.355 4.300 20 5 FIBDMO C[C@H](NC[C@@H](C1CC1)[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481304156 1112878098 /nfs/dbraw/zinc/87/80/98/1112878098.db2.gz DAFXQVZQUYZJQA-GUYCJALGSA-N 1 1 359.495 4.314 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H]4CC[C@@H](C3)S4)cs2)c1 ZINC000600188161 1112915342 /nfs/dbraw/zinc/91/53/42/1112915342.db2.gz DWFNHJKFMAOISI-CVEARBPZSA-N 1 1 361.492 4.188 20 5 FIBDMO C[C@H]1C[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)C1(F)F ZINC000600183734 1112918669 /nfs/dbraw/zinc/91/86/69/1112918669.db2.gz LSECVYSIYXFLKG-RYUDHWBXSA-N 1 1 367.421 4.441 20 5 FIBDMO CC1(C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]2CCC[C@H]21 ZINC000555721351 1112978584 /nfs/dbraw/zinc/97/85/84/1112978584.db2.gz LNMNNRVKNBLXBB-IAGOWNOFSA-N 1 1 355.438 4.303 20 5 FIBDMO CCC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)c1nnc2ccccn21 ZINC000129193724 1113659525 /nfs/dbraw/zinc/65/95/25/1113659525.db2.gz XQWIANXTRREHSC-GDBMZVCRSA-N 1 1 353.426 4.138 20 5 FIBDMO COc1cc(C[N@H+](Cc2ccccc2)CC2CCOCC2)ccc1[N+](=O)[O-] ZINC000489233859 1114074600 /nfs/dbraw/zinc/07/46/00/1114074600.db2.gz QPHKOGLCVIBHLQ-UHFFFAOYSA-N 1 1 370.449 4.032 20 5 FIBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)C(=O)Nc1ccccc1C ZINC000490049813 1114210493 /nfs/dbraw/zinc/21/04/93/1114210493.db2.gz WWWISHZFCRCCEJ-MRXNPFEDSA-N 1 1 355.438 4.142 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)C(=O)Nc1ccccc1C ZINC000490049813 1114210496 /nfs/dbraw/zinc/21/04/96/1114210496.db2.gz WWWISHZFCRCCEJ-MRXNPFEDSA-N 1 1 355.438 4.142 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccnc1OCC(F)(F)F ZINC000151117313 1114297538 /nfs/dbraw/zinc/29/75/38/1114297538.db2.gz JADDQTJLQWYCJJ-GFCCVEGCSA-N 1 1 369.343 4.090 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000573046422 1115003085 /nfs/dbraw/zinc/00/30/85/1115003085.db2.gz ZLBDKVFQWRUARH-IRXDYDNUSA-N 1 1 367.449 4.110 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]C2(c3ccccc3OC)CC2)cc1[N+](=O)[O-] ZINC000592393432 1115223101 /nfs/dbraw/zinc/22/31/01/1115223101.db2.gz IHFPSTCOYOCRBI-AWEZNQCLSA-N 1 1 356.422 4.342 20 5 FIBDMO C[C@H](CSc1ccccc1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000593046932 1115282110 /nfs/dbraw/zinc/28/21/10/1115282110.db2.gz UYJNXIQBRXUAMZ-CQSZACIVSA-N 1 1 374.462 4.074 20 5 FIBDMO C[C@H](CSc1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000593046932 1115282113 /nfs/dbraw/zinc/28/21/13/1115282113.db2.gz UYJNXIQBRXUAMZ-CQSZACIVSA-N 1 1 374.462 4.074 20 5 FIBDMO C[N@H+](Cc1cccc(F)c1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157793436 1115319801 /nfs/dbraw/zinc/31/98/01/1115319801.db2.gz UKWLOOMXQVUQKA-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO C[N@@H+](Cc1cccc(F)c1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157793436 1115319804 /nfs/dbraw/zinc/31/98/04/1115319804.db2.gz UKWLOOMXQVUQKA-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000226514725 1115391318 /nfs/dbraw/zinc/39/13/18/1115391318.db2.gz URCZDPZBQYBLHH-YPMHNXCESA-N 1 1 363.767 4.306 20 5 FIBDMO COc1cncc(/C=C\CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000574515300 1115417095 /nfs/dbraw/zinc/41/70/95/1115417095.db2.gz VRWUFGWOAKYONI-XQRVVYSFSA-N 1 1 353.422 4.066 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000595016966 1115503952 /nfs/dbraw/zinc/50/39/52/1115503952.db2.gz SQNWXVNGTBOIID-YHJVDBJQSA-N 1 1 374.412 4.313 20 5 FIBDMO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595003562 1115506527 /nfs/dbraw/zinc/50/65/27/1115506527.db2.gz IMYQVEQRWPVJMA-OLZOCXBDSA-N 1 1 360.410 4.032 20 5 FIBDMO Cc1ccc(C[NH2+][C@@H](CO)c2cccc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000595000145 1115506719 /nfs/dbraw/zinc/50/67/19/1115506719.db2.gz JHUHKQPNEFWEBC-AWEZNQCLSA-N 1 1 355.221 4.033 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCOc2c(Cl)cccc21 ZINC000595008674 1115508150 /nfs/dbraw/zinc/50/81/50/1115508150.db2.gz QNINEJLPUMONRZ-BZNIZROVSA-N 1 1 362.813 4.431 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000595052174 1115512491 /nfs/dbraw/zinc/51/24/91/1115512491.db2.gz QPWOYPDDMHIKPA-YVEFUNNKSA-N 1 1 364.829 4.031 20 5 FIBDMO Cn1cc[nH+]c1C[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000078558805 1115518376 /nfs/dbraw/zinc/51/83/76/1115518376.db2.gz RKDLONCJFJPBII-MRXNPFEDSA-N 1 1 356.813 4.378 20 5 FIBDMO COc1cc(C[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000575026888 1115530328 /nfs/dbraw/zinc/53/03/28/1115530328.db2.gz FCZCDGDHHFVNIU-RHSMWYFYSA-N 1 1 356.422 4.195 20 5 FIBDMO Cc1noc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)c1[N+](=O)[O-] ZINC000595416365 1115534843 /nfs/dbraw/zinc/53/48/43/1115534843.db2.gz VVEUFHVPJUNUTA-CQSZACIVSA-N 1 1 357.332 4.397 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1OCC ZINC000595418574 1115534887 /nfs/dbraw/zinc/53/48/87/1115534887.db2.gz CXCLFRLZWNNAEH-CYBMUJFWSA-N 1 1 362.401 4.382 20 5 FIBDMO CC(C)n1cc(C2=CCC[N@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)nn1 ZINC000595518285 1115539984 /nfs/dbraw/zinc/53/99/84/1115539984.db2.gz UNRRMYFZJVKNSF-HNNXBMFYSA-N 1 1 355.442 4.008 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCC[C@@H]3CC3CCC3)o2)cc1 ZINC000595866171 1115564886 /nfs/dbraw/zinc/56/48/86/1115564886.db2.gz FUFWVJFYDMBQTL-QGZVFWFLSA-N 1 1 356.426 4.190 20 5 FIBDMO CC1(C)CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CCS1 ZINC000228092186 1115637247 /nfs/dbraw/zinc/63/72/47/1115637247.db2.gz UQGYYGFEVPDENN-UHFFFAOYSA-N 1 1 359.289 4.075 20 5 FIBDMO CC1(C)CC[N@@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)CCS1 ZINC000228092186 1115637251 /nfs/dbraw/zinc/63/72/51/1115637251.db2.gz UQGYYGFEVPDENN-UHFFFAOYSA-N 1 1 359.289 4.075 20 5 FIBDMO CC[C@H](C)[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000060471675 1115645150 /nfs/dbraw/zinc/64/51/50/1115645150.db2.gz BKRSTQIIJNWNIG-INIZCTEOSA-N 1 1 355.438 4.142 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000597217317 1115648527 /nfs/dbraw/zinc/64/85/27/1115648527.db2.gz CCNUMFMZKYYEOH-ZRNYNZGJSA-N 1 1 368.433 4.445 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cn2nc(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000761276408 1115723960 /nfs/dbraw/zinc/72/39/60/1115723960.db2.gz WZEVYKGOMPAXLC-IBGZPJMESA-N 1 1 366.421 4.056 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cn2nc(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000761276408 1115723961 /nfs/dbraw/zinc/72/39/61/1115723961.db2.gz WZEVYKGOMPAXLC-IBGZPJMESA-N 1 1 366.421 4.056 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2CC2CCCCC2)c2c(c1)COCO2 ZINC000060892980 1115725574 /nfs/dbraw/zinc/72/55/74/1115725574.db2.gz WKJRESVPVXXGKR-GOSISDBHSA-N 1 1 360.454 4.396 20 5 FIBDMO Cc1c(C[NH2+]Cc2cccc(F)c2OCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000598979046 1115774970 /nfs/dbraw/zinc/77/49/70/1115774970.db2.gz ZAQUZKHRWBYRBQ-UHFFFAOYSA-N 1 1 372.318 4.273 20 5 FIBDMO CN(C)C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(Cl)c1 ZINC000598998120 1115775932 /nfs/dbraw/zinc/77/59/32/1115775932.db2.gz NQUAIMSVSNLRGY-QGZVFWFLSA-N 1 1 368.264 4.294 20 5 FIBDMO COc1ccc(C[NH2+][C@H]2CC(C)(C)Oc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000593674415 1115787980 /nfs/dbraw/zinc/78/79/80/1115787980.db2.gz SJXJOHQIQKVKNW-HNNXBMFYSA-N 1 1 360.385 4.135 20 5 FIBDMO CC(C)(C)OC(=O)[C@H]1C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000593687014 1115794810 /nfs/dbraw/zinc/79/48/10/1115794810.db2.gz FTWVLBWLMAHCSC-ROUUACIJSA-N 1 1 368.433 4.255 20 5 FIBDMO CC(C)(C)OC(=O)[C@H]1C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)c2ccccc21 ZINC000593691724 1115797086 /nfs/dbraw/zinc/79/70/86/1115797086.db2.gz SAWMCIVKPFGWCJ-HOTGVXAUSA-N 1 1 374.462 4.316 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]2CCCC[C@@H]12 ZINC000603846836 1115820755 /nfs/dbraw/zinc/82/07/55/1115820755.db2.gz CXDPQLUKNNYLJA-XOKHGSTOSA-N 1 1 356.426 4.045 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 ZINC000599598982 1115827384 /nfs/dbraw/zinc/82/73/84/1115827384.db2.gz CTPLFNKFMZPUSC-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO Cc1cccc([C@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C(C)C)c1 ZINC000599628467 1115832240 /nfs/dbraw/zinc/83/22/40/1115832240.db2.gz UFNIJHIXEVCGGY-LJQANCHMSA-N 1 1 366.421 4.440 20 5 FIBDMO Cc1c(C[NH+]2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000604276804 1115861395 /nfs/dbraw/zinc/86/13/95/1115861395.db2.gz UVDMOIGQLMMIJS-VXGBXAGGSA-N 1 1 370.293 4.466 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+](Cc2ccc(F)cc2)C(C)C)cccc1[N+](=O)[O-] ZINC000604492273 1115867585 /nfs/dbraw/zinc/86/75/85/1115867585.db2.gz NMUIHVIYPDFQLP-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO COc1cccc(C[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC(C)C)c1 ZINC000604494597 1115868099 /nfs/dbraw/zinc/86/80/99/1115868099.db2.gz CMLZUBWRZPXYDV-UHFFFAOYSA-N 1 1 358.438 4.270 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000063254751 1116032014 /nfs/dbraw/zinc/03/20/14/1116032014.db2.gz NWLFMMOCAIFSFF-UHFFFAOYSA-N 1 1 360.776 4.494 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)s1 ZINC000064029357 1116135077 /nfs/dbraw/zinc/13/50/77/1116135077.db2.gz XWWWOIDQBBQGBN-UHFFFAOYSA-N 1 1 351.859 4.022 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)s1 ZINC000064029357 1116135078 /nfs/dbraw/zinc/13/50/78/1116135078.db2.gz XWWWOIDQBBQGBN-UHFFFAOYSA-N 1 1 351.859 4.022 20 5 FIBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000534499536 1116207904 /nfs/dbraw/zinc/20/79/04/1116207904.db2.gz DEQFRKQEVIPTBL-UHFFFAOYSA-N 1 1 359.392 4.170 20 5 FIBDMO Cc1nc2ccccc2n1C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000535207645 1116281412 /nfs/dbraw/zinc/28/14/12/1116281412.db2.gz SUZONTRMMMLYQG-KRWDZBQOSA-N 1 1 368.412 4.057 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000089910021 1116351816 /nfs/dbraw/zinc/35/18/16/1116351816.db2.gz XQWQRQJUHROQRF-LJQANCHMSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000089910021 1116351818 /nfs/dbraw/zinc/35/18/18/1116351818.db2.gz XQWQRQJUHROQRF-LJQANCHMSA-N 1 1 364.405 4.290 20 5 FIBDMO CCc1ccc(C(=O)Nc2ccc(-n3c[nH+]c(C)c3C)cc2)cc1[N+](=O)[O-] ZINC000462780593 1117764097 /nfs/dbraw/zinc/76/40/97/1117764097.db2.gz ZAZACVFZWFQGAZ-UHFFFAOYSA-N 1 1 364.405 4.212 20 5 FIBDMO Cc1[nH+]cn(-c2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)cc2)c1C ZINC000462772091 1117767033 /nfs/dbraw/zinc/76/70/33/1117767033.db2.gz IUCJWTNXQALJIY-UHFFFAOYSA-N 1 1 370.796 4.303 20 5 FIBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+](C)Cc1ccccc1 ZINC000462841410 1117799881 /nfs/dbraw/zinc/79/98/81/1117799881.db2.gz PDYROLGLIGRKQT-ZDUSSCGKSA-N 1 1 365.380 4.129 20 5 FIBDMO CCc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000540146507 1117898170 /nfs/dbraw/zinc/89/81/70/1117898170.db2.gz ZVENMMTYSXQJCB-VXGBXAGGSA-N 1 1 371.466 4.416 20 5 FIBDMO C[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000540366123 1118016908 /nfs/dbraw/zinc/01/69/08/1118016908.db2.gz NEYKQDZDEBRJBD-ZDUSSCGKSA-N 1 1 370.384 4.111 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000463433791 1118153249 /nfs/dbraw/zinc/15/32/49/1118153249.db2.gz YJESBRCOWWQDAB-GCJKJVERSA-N 1 1 368.477 4.281 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@](CO)(Cc2ccccc2)C1 ZINC000463433792 1118153412 /nfs/dbraw/zinc/15/34/12/1118153412.db2.gz YJESBRCOWWQDAB-PGRDOPGGSA-N 1 1 368.477 4.281 20 5 FIBDMO COc1cc(C[N@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)c([N+](=O)[O-])cc1F ZINC000463452591 1118161622 /nfs/dbraw/zinc/16/16/22/1118161622.db2.gz CLGBZNMYKKCTML-YPMHNXCESA-N 1 1 364.339 4.295 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)c([N+](=O)[O-])cc1F ZINC000463452591 1118161624 /nfs/dbraw/zinc/16/16/24/1118161624.db2.gz CLGBZNMYKKCTML-YPMHNXCESA-N 1 1 364.339 4.295 20 5 FIBDMO C[C@H](NC1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356479 1118390492 /nfs/dbraw/zinc/39/04/92/1118390492.db2.gz OHKBNDGTILCCCR-BZSNNMDCSA-N 1 1 367.493 4.402 20 5 FIBDMO C[C@H]([NH2+]C1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356479 1118390495 /nfs/dbraw/zinc/39/04/95/1118390495.db2.gz OHKBNDGTILCCCR-BZSNNMDCSA-N 1 1 367.493 4.402 20 5 FIBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)c([N+](=O)[O-])cc1F ZINC000464677942 1118648697 /nfs/dbraw/zinc/64/86/97/1118648697.db2.gz NTBPGIILIKULHI-GOSISDBHSA-N 1 1 373.428 4.146 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)c([N+](=O)[O-])cc1F ZINC000464677942 1118648700 /nfs/dbraw/zinc/64/87/00/1118648700.db2.gz NTBPGIILIKULHI-GOSISDBHSA-N 1 1 373.428 4.146 20 5 FIBDMO C[C@H](c1cc(F)ccc1F)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000464781678 1118692915 /nfs/dbraw/zinc/69/29/15/1118692915.db2.gz ZXWAOTYQEQOQKW-CYBMUJFWSA-N 1 1 362.376 4.477 20 5 FIBDMO COC(=O)c1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)s1 ZINC000464867278 1118729791 /nfs/dbraw/zinc/72/97/91/1118729791.db2.gz UNFPFNRPYQLJSD-UHFFFAOYSA-N 1 1 362.451 4.162 20 5 FIBDMO COC(=O)c1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)s1 ZINC000464867278 1118729794 /nfs/dbraw/zinc/72/97/94/1118729794.db2.gz UNFPFNRPYQLJSD-UHFFFAOYSA-N 1 1 362.451 4.162 20 5 FIBDMO Cc1ccc([C@H]2CC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC000542319693 1118903921 /nfs/dbraw/zinc/90/39/21/1118903921.db2.gz LHGRTYNPSVKJCF-SFHVURJKSA-N 1 1 367.449 4.030 20 5 FIBDMO Cc1nn(-c2ccccc2)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000492000214 1119001918 /nfs/dbraw/zinc/00/19/18/1119001918.db2.gz NUDCCNBOSUWHAR-UHFFFAOYSA-N 1 1 350.422 4.114 20 5 FIBDMO CCOc1cc(C[N@@H+](CCOC)[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000492718783 1119172594 /nfs/dbraw/zinc/17/25/94/1119172594.db2.gz BVJWJDRXARGYFG-MRXNPFEDSA-N 1 1 358.438 4.203 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2OC)ccc1[N+](=O)[O-] ZINC000492768384 1119183599 /nfs/dbraw/zinc/18/35/99/1119183599.db2.gz ISPLQOVXKRBHJV-QGZVFWFLSA-N 1 1 356.422 4.339 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](CCOC)c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000495425618 1120801342 /nfs/dbraw/zinc/80/13/42/1120801342.db2.gz DEPZTSGYQVUMFV-GDBMZVCRSA-N 1 1 362.426 4.323 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000915211486 1120870233 /nfs/dbraw/zinc/87/02/33/1120870233.db2.gz UEZVYKJBXBWCKE-VIFPVBQESA-N 1 1 363.767 4.163 20 5 FIBDMO COc1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC(F)F ZINC000026453281 1121091460 /nfs/dbraw/zinc/09/14/60/1121091460.db2.gz UXMAPKHEWHWIOA-GFCCVEGCSA-N 1 1 366.364 4.398 20 5 FIBDMO C[C@H](NCc1ccccc1C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000153842963 1121412487 /nfs/dbraw/zinc/41/24/87/1121412487.db2.gz PGDBYRWRUFIVIK-KRWDZBQOSA-N 1 1 353.466 4.432 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)ccc1Cl ZINC000154166791 1121840720 /nfs/dbraw/zinc/84/07/20/1121840720.db2.gz ICUQQEZKQYFWMB-CZUORRHYSA-N 1 1 366.870 4.398 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000917134000 1122190902 /nfs/dbraw/zinc/19/09/02/1122190902.db2.gz LSXHFQMDVPPMAB-INIZCTEOSA-N 1 1 365.433 4.464 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000301510030 1122193021 /nfs/dbraw/zinc/19/30/21/1122193021.db2.gz DXNNHVSAUJQYRD-UZLBHIALSA-N 1 1 369.465 4.064 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000301510027 1122193142 /nfs/dbraw/zinc/19/31/42/1122193142.db2.gz DXNNHVSAUJQYRD-JXFKEZNVSA-N 1 1 369.465 4.064 20 5 FIBDMO COc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000301520572 1122199545 /nfs/dbraw/zinc/19/95/45/1122199545.db2.gz FIYQJCWRHSELJA-MAUKXSAKSA-N 1 1 355.438 4.068 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000301534464 1122202165 /nfs/dbraw/zinc/20/21/65/1122202165.db2.gz LHOBUQJYUJIELY-GFCCVEGCSA-N 1 1 367.365 4.170 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)C1 ZINC000154329069 1122234418 /nfs/dbraw/zinc/23/44/18/1122234418.db2.gz GJQMSIYZHJXOFL-CQSZACIVSA-N 1 1 371.412 4.218 20 5 FIBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@H](COCc1ccccc1)c1ccccc1 ZINC001168633919 1122244148 /nfs/dbraw/zinc/24/41/48/1122244148.db2.gz VMCRMRMDQLOJQX-HXUWFJFHSA-N 1 1 363.417 4.038 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000542709033 1122311019 /nfs/dbraw/zinc/31/10/19/1122311019.db2.gz GECWAOKPVYBTOW-AZUAARDMSA-N 1 1 358.413 4.394 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@H]1c1ccccc1OC ZINC000609280826 1122679915 /nfs/dbraw/zinc/67/99/15/1122679915.db2.gz QMSSZLAKYNPVFG-SFHVURJKSA-N 1 1 356.422 4.339 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1c1ccccc1OC ZINC000609280826 1122679919 /nfs/dbraw/zinc/67/99/19/1122679919.db2.gz QMSSZLAKYNPVFG-SFHVURJKSA-N 1 1 356.422 4.339 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])C1CCCC1 ZINC000556508815 1122932007 /nfs/dbraw/zinc/93/20/07/1122932007.db2.gz QYZDMCZBWRRSSO-UHFFFAOYSA-N 1 1 358.385 4.012 20 5 FIBDMO O=[N+]([O-])c1c(F)cccc1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000301235740 1123764280 /nfs/dbraw/zinc/76/42/80/1123764280.db2.gz HOOBIAZFXRQIBG-ALOPSCKCSA-N 1 1 355.413 4.341 20 5 FIBDMO CCc1nc(C[NH+]2CCC(CNc3ccc([N+](=O)[O-])c(C)c3)CC2)cs1 ZINC000301238341 1123787915 /nfs/dbraw/zinc/78/79/15/1123787915.db2.gz IPRYZDHITCNNJC-UHFFFAOYSA-N 1 1 374.510 4.246 20 5 FIBDMO Cc1ccnc(NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c1[N+](=O)[O-] ZINC000609669652 1123789522 /nfs/dbraw/zinc/78/95/22/1123789522.db2.gz QKGLXJYYLPPNJN-MRXNPFEDSA-N 1 1 354.454 4.285 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Oc2cc(C)ccc2C)CC1 ZINC000064632024 1123875917 /nfs/dbraw/zinc/87/59/17/1123875917.db2.gz GLKSNWDUXYECOC-UHFFFAOYSA-N 1 1 370.449 4.264 20 5 FIBDMO CC(C)([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc(F)c1 ZINC000179577873 1124002684 /nfs/dbraw/zinc/00/26/84/1124002684.db2.gz FPBMJKCPJKIWGY-UHFFFAOYSA-N 1 1 355.369 4.414 20 5 FIBDMO C[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000542820452 1124391179 /nfs/dbraw/zinc/39/11/79/1124391179.db2.gz ZLENPFJIWVCIMF-GOEBONIOSA-N 1 1 374.412 4.119 20 5 FIBDMO CCOc1cc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000617201112 1124481516 /nfs/dbraw/zinc/48/15/16/1124481516.db2.gz MADMNHJYWWISGA-LJQANCHMSA-N 1 1 358.463 4.284 20 5 FIBDMO O=C(c1ccccc1)C1CC[NH+](CC=Cc2ccccc2[N+](=O)[O-])CC1 ZINC000255015940 1125113124 /nfs/dbraw/zinc/11/31/24/1125113124.db2.gz IMBBNSDXXGFFRT-POHAHGRESA-N 1 1 350.418 4.203 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1C(F)(F)F ZINC000301776735 1125254899 /nfs/dbraw/zinc/25/48/99/1125254899.db2.gz LLQAUAVFXAEFDR-LRDDRELGSA-N 1 1 369.387 4.067 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1C(F)(F)F ZINC000301776734 1125264111 /nfs/dbraw/zinc/26/41/11/1125264111.db2.gz LLQAUAVFXAEFDR-BLLLJJGKSA-N 1 1 369.387 4.067 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCc2sc(Br)cc21 ZINC000312615791 1125426539 /nfs/dbraw/zinc/42/65/39/1125426539.db2.gz GHGAXTYXBQAQOZ-LLVKDONJSA-N 1 1 353.241 4.196 20 5 FIBDMO CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](C)c1ccc(F)cc1 ZINC000053088883 205189922 /nfs/dbraw/zinc/18/99/22/205189922.db2.gz JGIIGDKVLNIDGL-ZDUSSCGKSA-N 1 1 370.384 4.367 20 5 FIBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](C)c1ccc(F)cc1 ZINC000053088883 205189927 /nfs/dbraw/zinc/18/99/27/205189927.db2.gz JGIIGDKVLNIDGL-ZDUSSCGKSA-N 1 1 370.384 4.367 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000109103712 206047482 /nfs/dbraw/zinc/04/74/82/206047482.db2.gz YPRAGBWHRAJQJX-INIZCTEOSA-N 1 1 355.438 4.233 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1)C(C)C ZINC000110123731 206070747 /nfs/dbraw/zinc/07/07/47/206070747.db2.gz GWAQKPRWRWITIV-UHFFFAOYSA-N 1 1 359.401 4.217 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000072868717 567906388 /nfs/dbraw/zinc/90/63/88/567906388.db2.gz FHGGGQCDIFMKFL-MJGOQNOKSA-N 1 1 353.466 4.110 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000072868717 567906390 /nfs/dbraw/zinc/90/63/90/567906390.db2.gz FHGGGQCDIFMKFL-MJGOQNOKSA-N 1 1 353.466 4.110 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000072868717 567906391 /nfs/dbraw/zinc/90/63/91/567906391.db2.gz FHGGGQCDIFMKFL-MJGOQNOKSA-N 1 1 353.466 4.110 20 5 FIBDMO COCC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccc(C)o1 ZINC000568400727 568030552 /nfs/dbraw/zinc/03/05/52/568030552.db2.gz METLESRSLNPYHG-HNNXBMFYSA-N 1 1 372.343 4.382 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](Oc4cccc(Cl)c4)C3)nc2c1 ZINC000120372779 568068407 /nfs/dbraw/zinc/06/84/07/568068407.db2.gz FASNQCBAGSNKOK-OAHLLOKOSA-N 1 1 373.796 4.043 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](Oc4cccc(Cl)c4)C3)nc2c1 ZINC000120372779 568068408 /nfs/dbraw/zinc/06/84/08/568068408.db2.gz FASNQCBAGSNKOK-OAHLLOKOSA-N 1 1 373.796 4.043 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000541951232 568272742 /nfs/dbraw/zinc/27/27/42/568272742.db2.gz CYQJEKXXKUQJLT-PJIJBLCYSA-N 1 1 356.426 4.218 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000570607356 568490711 /nfs/dbraw/zinc/49/07/11/568490711.db2.gz RFCSOCWLWUUFKN-QFBILLFUSA-N 1 1 351.450 4.101 20 5 FIBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000078562243 1125562298 /nfs/dbraw/zinc/56/22/98/1125562298.db2.gz SZTFHDZSFGPRIR-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000078562243 1125562308 /nfs/dbraw/zinc/56/23/08/1125562308.db2.gz SZTFHDZSFGPRIR-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000619722719 1125668120 /nfs/dbraw/zinc/66/81/20/1125668120.db2.gz UZGNKHJUQRPEIQ-JKSUJKDBSA-N 1 1 354.454 4.068 20 5 FIBDMO Cn1cc(-c2ccc(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)s2)cn1 ZINC000619843828 1125713082 /nfs/dbraw/zinc/71/30/82/1125713082.db2.gz OUWKDLPHJSMRIV-UHFFFAOYSA-N 1 1 368.462 4.221 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H]3c3ccncc3)o2)c1 ZINC000154037094 1079927081 /nfs/dbraw/zinc/92/70/81/1079927081.db2.gz YLRNIFWFLDCBQJ-SFHVURJKSA-N 1 1 364.405 4.024 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccc(F)cc2F)CCCC1 ZINC000430206025 1079937325 /nfs/dbraw/zinc/93/73/25/1079937325.db2.gz VMQHUXPBXUVMSZ-UHFFFAOYSA-N 1 1 362.376 4.441 20 5 FIBDMO CS[C@@H]1CCCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000134548677 1080271615 /nfs/dbraw/zinc/27/16/15/1080271615.db2.gz GGMWYKFXKDCCJS-MRXNPFEDSA-N 1 1 361.467 4.010 20 5 FIBDMO COc1cc(C[NH2+]Cc2ccc(OC(C)(C)C)cc2)c([N+](=O)[O-])cc1OC ZINC000608782075 1080478888 /nfs/dbraw/zinc/47/88/88/1080478888.db2.gz UAPLSQYJSQZVMK-UHFFFAOYSA-N 1 1 374.437 4.079 20 5 FIBDMO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1F ZINC000127117742 1080480911 /nfs/dbraw/zinc/48/09/11/1080480911.db2.gz VSUKCRYZPNPTSB-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@@H+]2CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC001167138845 1080684046 /nfs/dbraw/zinc/68/40/46/1080684046.db2.gz RRVRAMANYHJCJU-KRWDZBQOSA-N 1 1 373.840 4.332 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC001167138845 1080684050 /nfs/dbraw/zinc/68/40/50/1080684050.db2.gz RRVRAMANYHJCJU-KRWDZBQOSA-N 1 1 373.840 4.332 20 5 FIBDMO Cc1ccc(C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C(C)C)s1 ZINC001167158066 1080763762 /nfs/dbraw/zinc/76/37/62/1080763762.db2.gz RYXGCSUGDVPIBW-UHFFFAOYSA-N 1 1 372.450 4.425 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C(C)C)s1 ZINC001167158066 1080763766 /nfs/dbraw/zinc/76/37/66/1080763766.db2.gz RYXGCSUGDVPIBW-UHFFFAOYSA-N 1 1 372.450 4.425 20 5 FIBDMO Cn1cc[nH+]c1C[C@@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1ccccc1 ZINC000610282364 1081204002 /nfs/dbraw/zinc/20/40/02/1081204002.db2.gz OMGRJMSOOHHELX-LJQANCHMSA-N 1 1 373.416 4.272 20 5 FIBDMO Cc1c(CNC[C@H](c2ccccc2)[NH+]2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC001648895532 1081353507 /nfs/dbraw/zinc/35/35/07/1081353507.db2.gz RYRSNRIQGPADLF-JOCHJYFZSA-N 1 1 367.493 4.466 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000175827162 1081369442 /nfs/dbraw/zinc/36/94/42/1081369442.db2.gz VKBYHJYIYZLYSV-GOEBONIOSA-N 1 1 366.870 4.398 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000175827194 1081369815 /nfs/dbraw/zinc/36/98/15/1081369815.db2.gz VKBYHJYIYZLYSV-GDBMZVCRSA-N 1 1 366.870 4.398 20 5 FIBDMO CC(C)n1cc([C@@H](C)[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)cn1 ZINC000602560063 1081392456 /nfs/dbraw/zinc/39/24/56/1081392456.db2.gz BAEWYBVABAIBCU-SECBINFHSA-N 1 1 373.276 4.047 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+](CCc2cccc(F)c2)C2CC2)cc1 ZINC001167433659 1082129393 /nfs/dbraw/zinc/12/93/93/1082129393.db2.gz JGZKXTHSWQGCHG-UHFFFAOYSA-N 1 1 358.413 4.210 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](c3ncc[nH]3)C2)s1 ZINC000510539746 1083149076 /nfs/dbraw/zinc/14/90/76/1083149076.db2.gz RFXSCFKZBLVHTF-AWEZNQCLSA-N 1 1 368.462 4.426 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@H]4CCC[C@@H]43)o2)c(Cl)c1 ZINC000510632618 1083213059 /nfs/dbraw/zinc/21/30/59/1083213059.db2.gz HQHPFUIRRDJQRL-WMZOPIPTSA-N 1 1 362.813 4.262 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@@H]43)o2)c(Cl)c1 ZINC000510632618 1083213063 /nfs/dbraw/zinc/21/30/63/1083213063.db2.gz HQHPFUIRRDJQRL-WMZOPIPTSA-N 1 1 362.813 4.262 20 5 FIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccc(OC(F)F)c1 ZINC000179585691 1083570075 /nfs/dbraw/zinc/57/00/75/1083570075.db2.gz HKKNSRJXFCMJIO-JTQLQIEISA-N 1 1 363.320 4.188 20 5 FIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)c1ccc(F)cc1 ZINC000053087989 1083670883 /nfs/dbraw/zinc/67/08/83/1083670883.db2.gz OWSPLUKQBHFORX-ZDUSSCGKSA-N 1 1 360.385 4.184 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)c1ccc(F)cc1 ZINC000053087989 1083670888 /nfs/dbraw/zinc/67/08/88/1083670888.db2.gz OWSPLUKQBHFORX-ZDUSSCGKSA-N 1 1 360.385 4.184 20 5 FIBDMO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C1CCOCC1 ZINC000535799027 1083674896 /nfs/dbraw/zinc/67/48/96/1083674896.db2.gz VHIRVEMWDXRMAO-UHFFFAOYSA-N 1 1 360.385 4.137 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2ccco2)Cc2ccccc2)cc1 ZINC000065208775 1083894188 /nfs/dbraw/zinc/89/41/88/1083894188.db2.gz NLGSEFSMSGBIDC-UHFFFAOYSA-N 1 1 352.390 4.269 20 5 FIBDMO C[C@@H](c1ccc2ccccc2c1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000472440355 1083908462 /nfs/dbraw/zinc/90/84/62/1083908462.db2.gz SHRGTXQONRULCC-HNNXBMFYSA-N 1 1 350.422 4.170 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+]Cc2ccc3c(c2)OCO3)c2ccccc2)c1 ZINC000179970802 1083945330 /nfs/dbraw/zinc/94/53/30/1083945330.db2.gz CGHCCTLJPJKJIN-NRFANRHFSA-N 1 1 362.385 4.203 20 5 FIBDMO Cn1nc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc21 ZINC000612692050 1083989614 /nfs/dbraw/zinc/98/96/14/1083989614.db2.gz KPMBRZLDABGJRO-UHFFFAOYSA-N 1 1 362.389 4.031 20 5 FIBDMO Cn1ccnc1[C@@H]([NH2+]CCCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000611560404 1084047567 /nfs/dbraw/zinc/04/75/67/1084047567.db2.gz VTABMUIEGOSHGG-FQEVSTJZSA-N 1 1 364.449 4.030 20 5 FIBDMO CC[N@@H+](CCc1nccs1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000180027571 1084067850 /nfs/dbraw/zinc/06/78/50/1084067850.db2.gz YNIZZRCTTYDWOB-UHFFFAOYSA-N 1 1 357.435 4.376 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@]4(CCCOC4)C3)o2)c1 ZINC000538718897 1084183439 /nfs/dbraw/zinc/18/34/39/1084183439.db2.gz VNSFZLZMSAGISC-HXUWFJFHSA-N 1 1 356.422 4.247 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCCC[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000613025623 1084275296 /nfs/dbraw/zinc/27/52/96/1084275296.db2.gz CHAXLMJYZBYHNB-FQEVSTJZSA-N 1 1 367.449 4.459 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1Cl ZINC000478034296 1084549031 /nfs/dbraw/zinc/54/90/31/1084549031.db2.gz GZHFEMGUUXKOSC-UHFFFAOYSA-N 1 1 368.220 4.216 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC000478057250 1084900724 /nfs/dbraw/zinc/90/07/24/1084900724.db2.gz IRTXBCLZUQFFTI-HNNXBMFYSA-N 1 1 361.467 4.002 20 5 FIBDMO C[C@@H]1c2ccccc2CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000106862134 1085234971 /nfs/dbraw/zinc/23/49/71/1085234971.db2.gz MRCPVMBJDNRVHL-OAHLLOKOSA-N 1 1 363.417 4.412 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](CCO)C2)ccc1Oc1ccc(F)cc1 ZINC000093106843 1085320919 /nfs/dbraw/zinc/32/09/19/1085320919.db2.gz NJSMNSJBRHIOHE-OAHLLOKOSA-N 1 1 374.412 4.121 20 5 FIBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000472245321 1085442251 /nfs/dbraw/zinc/44/22/51/1085442251.db2.gz XBYZAUNCOGDRER-FQEVSTJZSA-N 1 1 368.412 4.042 20 5 FIBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](C)Cc1ccsc1 ZINC000187802660 1085567400 /nfs/dbraw/zinc/56/74/00/1085567400.db2.gz LKEONEDPKBLIAT-CYBMUJFWSA-N 1 1 372.450 4.159 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@H]2C[C@@H](O)c2ccco2)c(F)c1 ZINC000121873897 1085584201 /nfs/dbraw/zinc/58/42/01/1085584201.db2.gz BWNKJSPLXOHZJM-MAUKXSAKSA-N 1 1 362.401 4.195 20 5 FIBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)c1 ZINC000472257833 1085705821 /nfs/dbraw/zinc/70/58/21/1085705821.db2.gz LSCCPPXUBAMCJF-INIZCTEOSA-N 1 1 368.359 4.037 20 5 FIBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)c1 ZINC000472257833 1085705829 /nfs/dbraw/zinc/70/58/29/1085705829.db2.gz LSCCPPXUBAMCJF-INIZCTEOSA-N 1 1 368.359 4.037 20 5 FIBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1cccc2ccccc21 ZINC000051993062 1085921005 /nfs/dbraw/zinc/92/10/05/1085921005.db2.gz ALTUTRZCFACESI-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1cccc2ccccc21 ZINC000051993062 1085921011 /nfs/dbraw/zinc/92/10/11/1085921011.db2.gz ALTUTRZCFACESI-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO C[C@@H](c1cccc(Cl)c1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052162331 1086354209 /nfs/dbraw/zinc/35/42/09/1086354209.db2.gz GZZVCBCDEBNMSD-LBPRGKRZSA-N 1 1 362.813 4.308 20 5 FIBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052162331 1086354220 /nfs/dbraw/zinc/35/42/20/1086354220.db2.gz GZZVCBCDEBNMSD-LBPRGKRZSA-N 1 1 362.813 4.308 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(OCc2ccc(F)cc2)CC1 ZINC000091888786 1086385855 /nfs/dbraw/zinc/38/58/55/1086385855.db2.gz ZPAOMHZDHVRMDE-UHFFFAOYSA-N 1 1 362.376 4.054 20 5 FIBDMO C[N@H+](Cc1ccccc1)CC1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000728570494 1086860601 /nfs/dbraw/zinc/86/06/01/1086860601.db2.gz MPTIAPIEKYJLTO-UHFFFAOYSA-N 1 1 371.456 4.078 20 5 FIBDMO CCn1c(=O)c2cc3ccccc3cc2nc1SCC[C@H]1CCC[N@H+]1C ZINC000536090009 1086873864 /nfs/dbraw/zinc/87/38/64/1086873864.db2.gz CWGQAAANBWPMEW-QGZVFWFLSA-N 1 1 367.518 4.146 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC=C(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000583922387 1087039126 /nfs/dbraw/zinc/03/91/26/1087039126.db2.gz OYJGARVJXHMBGK-INIZCTEOSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC=C(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000583922387 1087039130 /nfs/dbraw/zinc/03/91/30/1087039130.db2.gz OYJGARVJXHMBGK-INIZCTEOSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000052803857 1087168225 /nfs/dbraw/zinc/16/82/25/1087168225.db2.gz NHIYLNBAGXNDRT-KRWDZBQOSA-N 1 1 359.451 4.130 20 5 FIBDMO C[NH+](C)C[C@@H](N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000584223783 1087223861 /nfs/dbraw/zinc/22/38/61/1087223861.db2.gz ZHRUXUTYDCRNQP-VQTJNVASSA-N 1 1 371.456 4.349 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2nc3ccccc3s2)CC1 ZINC000302847293 1087336038 /nfs/dbraw/zinc/33/60/38/1087336038.db2.gz LZUANXSFYKBUFD-AWEZNQCLSA-N 1 1 368.462 4.088 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000511277671 1087544173 /nfs/dbraw/zinc/54/41/73/1087544173.db2.gz NMCKSZBPKUEQAC-UHFFFAOYSA-N 1 1 369.465 4.099 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c(Cl)c1 ZINC000424293209 1087902468 /nfs/dbraw/zinc/90/24/68/1087902468.db2.gz CQVPZAAXBVOJOZ-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1n1ccnc1 ZINC000180611027 1087980717 /nfs/dbraw/zinc/98/07/17/1087980717.db2.gz JBWQQRWQPNIUJO-BEFAXECRSA-N 1 1 366.421 4.134 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2CCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000180714937 1088033200 /nfs/dbraw/zinc/03/32/00/1088033200.db2.gz FTBGQCOWZXHNAM-LRDDRELGSA-N 1 1 360.385 4.307 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1OCC ZINC000181391705 1088427828 /nfs/dbraw/zinc/42/78/28/1088427828.db2.gz OLCQNPCMWMTRKI-ZDUSSCGKSA-N 1 1 362.401 4.382 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1OCC ZINC000181391685 1088428143 /nfs/dbraw/zinc/42/81/43/1088428143.db2.gz OLCQNPCMWMTRKI-CYBMUJFWSA-N 1 1 362.401 4.382 20 5 FIBDMO COc1cnccc1[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000189567046 1088492169 /nfs/dbraw/zinc/49/21/69/1088492169.db2.gz UDCOOVYWOMWUSV-ZDUSSCGKSA-N 1 1 353.378 4.109 20 5 FIBDMO COc1cnccc1[C@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000189553391 1088492581 /nfs/dbraw/zinc/49/25/81/1088492581.db2.gz OTRWFMGWEKNNEH-ZDUSSCGKSA-N 1 1 353.378 4.109 20 5 FIBDMO C[C@@H](NC[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402698 1088644508 /nfs/dbraw/zinc/64/45/08/1088644508.db2.gz UCZSZLWUZPEMMY-IEBWSBKVSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402698 1088644514 /nfs/dbraw/zinc/64/45/14/1088644514.db2.gz UCZSZLWUZPEMMY-IEBWSBKVSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402698 1088644523 /nfs/dbraw/zinc/64/45/23/1088644523.db2.gz UCZSZLWUZPEMMY-IEBWSBKVSA-N 1 1 353.466 4.158 20 5 FIBDMO Cc1ccc(-c2nc(C[N@H+](C)CCc3cccc([N+](=O)[O-])c3)cs2)o1 ZINC000549167117 1089087085 /nfs/dbraw/zinc/08/70/85/1089087085.db2.gz DSTDLDAFJRCCSJ-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO Cc1ccc(-c2nc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)cs2)o1 ZINC000549167117 1089087103 /nfs/dbraw/zinc/08/71/03/1089087103.db2.gz DSTDLDAFJRCCSJ-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000514486289 1089132280 /nfs/dbraw/zinc/13/22/80/1089132280.db2.gz DQUKPSZCOLKCND-UHFFFAOYSA-N 1 1 363.820 4.100 20 5 FIBDMO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000435039231 1089216256 /nfs/dbraw/zinc/21/62/56/1089216256.db2.gz CQVYDKANKNFWMC-GDBMZVCRSA-N 1 1 351.406 4.189 20 5 FIBDMO CC(C)(C)c1nn(-c2ccccc2)cc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000236655102 1089237476 /nfs/dbraw/zinc/23/74/76/1089237476.db2.gz NWQKPVWXZZHYFJ-UHFFFAOYSA-N 1 1 364.449 4.368 20 5 FIBDMO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H]1CCCOC1 ZINC000514972105 1089676802 /nfs/dbraw/zinc/67/68/02/1089676802.db2.gz GKIPKWOSDALJHB-MRXNPFEDSA-N 1 1 360.385 4.137 20 5 FIBDMO COc1ccc(-c2ccc(C[NH2+]Cc3cc(F)cc(F)c3)o2)c([N+](=O)[O-])c1 ZINC000517538625 1089756645 /nfs/dbraw/zinc/75/66/45/1089756645.db2.gz FHMDZFJCDLYKKR-UHFFFAOYSA-N 1 1 374.343 4.431 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@@H](c3ccccc3)C3CCC3)n2)cc1 ZINC000104696772 1090303005 /nfs/dbraw/zinc/30/30/05/1090303005.db2.gz ZZLHOLPMGWITPQ-IBGZPJMESA-N 1 1 364.405 4.276 20 5 FIBDMO C[N@H+]1CCCC12CCN(C(=O)c1cc3ccccc3c3cccnc13)CC2 ZINC000378509552 1090395392 /nfs/dbraw/zinc/39/53/92/1090395392.db2.gz AVPHYXVFAJBTJB-UHFFFAOYSA-N 1 1 359.473 4.088 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1CNCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000236853459 1090714885 /nfs/dbraw/zinc/71/48/85/1090714885.db2.gz NYEAQOYWSKDZAJ-UHFFFAOYSA-N 1 1 371.481 4.124 20 5 FIBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000302035182 1090939764 /nfs/dbraw/zinc/93/97/64/1090939764.db2.gz FGEZMSAMLZOEJO-CHWSQXEVSA-N 1 1 369.412 4.261 20 5 FIBDMO Cc1cc(NCCC[N@@H+]2CCCC[C@@H]2C)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001167751463 1091151622 /nfs/dbraw/zinc/15/16/22/1091151622.db2.gz IUPCSVFJKTVOOI-INIZCTEOSA-N 1 1 369.469 4.037 20 5 FIBDMO C[C@@H](C[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000066854217 1091363311 /nfs/dbraw/zinc/36/33/11/1091363311.db2.gz QZGNBCXYGIUYSK-GJZGRUSLSA-N 1 1 366.421 4.441 20 5 FIBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000053722073 1091417965 /nfs/dbraw/zinc/41/79/65/1091417965.db2.gz GRVXJSAXNSOXLM-ZDUSSCGKSA-N 1 1 359.451 4.283 20 5 FIBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000508315652 1092240055 /nfs/dbraw/zinc/24/00/55/1092240055.db2.gz VQKVQPRSJJVXQY-IAGOWNOFSA-N 1 1 361.489 4.238 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])s3)cc2)C1 ZINC000500772720 1092544353 /nfs/dbraw/zinc/54/43/53/1092544353.db2.gz ZBVRFXPBHCGWLK-ZDUSSCGKSA-N 1 1 359.451 4.141 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1 ZINC000521276165 1092615963 /nfs/dbraw/zinc/61/59/63/1092615963.db2.gz WNEYQNWHCYFENU-OAHLLOKOSA-N 1 1 358.360 4.028 20 5 FIBDMO CC(C)[C@@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)N1CCCC1 ZINC000521819680 1092937148 /nfs/dbraw/zinc/93/71/48/1092937148.db2.gz VKUPUAZCYOMFAH-LJQANCHMSA-N 1 1 357.454 4.065 20 5 FIBDMO CCC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(F)cc1 ZINC000521821586 1092938659 /nfs/dbraw/zinc/93/86/59/1092938659.db2.gz KVYMZAHBVGQFFZ-UHFFFAOYSA-N 1 1 370.384 4.196 20 5 FIBDMO CCC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(F)cc1 ZINC000521821586 1092938664 /nfs/dbraw/zinc/93/86/64/1092938664.db2.gz KVYMZAHBVGQFFZ-UHFFFAOYSA-N 1 1 370.384 4.196 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC(F)(F)F)cc1 ZINC000522268800 1093255281 /nfs/dbraw/zinc/25/52/81/1093255281.db2.gz FUSYYZWZGBNXKS-UHFFFAOYSA-N 1 1 354.328 4.168 20 5 FIBDMO O=[N+]([O-])c1c(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)ccc2ncccc21 ZINC000383873357 1093292080 /nfs/dbraw/zinc/29/20/80/1093292080.db2.gz ZYCKWXZCXXAYTL-QGZVFWFLSA-N 1 1 362.433 4.077 20 5 FIBDMO C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(C2CC2)cc1 ZINC000419333640 1093661903 /nfs/dbraw/zinc/66/19/03/1093661903.db2.gz FUMBVZFUYXVELW-ZDUSSCGKSA-N 1 1 364.405 4.373 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000397994577 1093799504 /nfs/dbraw/zinc/79/95/04/1093799504.db2.gz RTWHSRYXVYHRIN-BEFAXECRSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000397994577 1093799511 /nfs/dbraw/zinc/79/95/11/1093799511.db2.gz RTWHSRYXVYHRIN-BEFAXECRSA-N 1 1 373.884 4.248 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000513267015 1094040698 /nfs/dbraw/zinc/04/06/98/1094040698.db2.gz NJFIHXJWOODKLH-MGPUTAFESA-N 1 1 367.449 4.315 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000513277618 1094044466 /nfs/dbraw/zinc/04/44/66/1094044466.db2.gz YYEXHAKRNPKINL-KUHUBIRLSA-N 1 1 354.406 4.044 20 5 FIBDMO CC(C)[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@@H](C)O ZINC000513648946 1094253809 /nfs/dbraw/zinc/25/38/09/1094253809.db2.gz WIEIYVDEZOUSBI-CQSZACIVSA-N 1 1 362.401 4.117 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000501122639 1094518254 /nfs/dbraw/zinc/51/82/54/1094518254.db2.gz RWUIPGYWXPYEGR-OAHLLOKOSA-N 1 1 354.454 4.007 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1CCNC1CC[NH+](C2CCCCC2)CC1 ZINC000419689466 1094560923 /nfs/dbraw/zinc/56/09/23/1094560923.db2.gz IVPIZGSLVRUQTH-UHFFFAOYSA-N 1 1 365.905 4.177 20 5 FIBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CC(OCc2ccccc2)C1 ZINC001168042667 1094706006 /nfs/dbraw/zinc/70/60/06/1094706006.db2.gz FPNRLXNLOJOZJD-UHFFFAOYSA-N 1 1 360.841 4.428 20 5 FIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CC(OCc2ccccc2)C1 ZINC001168042667 1094706019 /nfs/dbraw/zinc/70/60/19/1094706019.db2.gz FPNRLXNLOJOZJD-UHFFFAOYSA-N 1 1 360.841 4.428 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(-c2ccc(C)cc2)o1 ZINC000237201122 1095553457 /nfs/dbraw/zinc/55/34/57/1095553457.db2.gz ZAPFUYUAJKRIOB-UHFFFAOYSA-N 1 1 352.390 4.462 20 5 FIBDMO CC[C@@H]1C[C@]1([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1cccc(C)c1 ZINC000502555371 1095586926 /nfs/dbraw/zinc/58/69/26/1095586926.db2.gz YGMHYQFQCIPBPT-FOIQADDNSA-N 1 1 358.413 4.466 20 5 FIBDMO C[N@@H+](Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[C@H]1CCOC1 ZINC000513750900 1095713899 /nfs/dbraw/zinc/71/38/99/1095713899.db2.gz RDSCUMZPCGUPMW-AWEZNQCLSA-N 1 1 362.813 4.261 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000444166754 1095805557 /nfs/dbraw/zinc/80/55/57/1095805557.db2.gz JYXQUSAGMATTDE-ORAYPTAESA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000444166754 1095805569 /nfs/dbraw/zinc/80/55/69/1095805569.db2.gz JYXQUSAGMATTDE-ORAYPTAESA-N 1 1 371.412 4.064 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1)C(C)C ZINC000133631877 1096048620 /nfs/dbraw/zinc/04/86/20/1096048620.db2.gz ROEGDLJHVFWQHJ-UHFFFAOYSA-N 1 1 371.437 4.086 20 5 FIBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1csc2ccccc12 ZINC000532918200 1098607614 /nfs/dbraw/zinc/60/76/14/1098607614.db2.gz JTXOUYWWLKJNOY-ZDUSSCGKSA-N 1 1 369.446 4.269 20 5 FIBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1csc2ccccc12 ZINC000532918200 1098607622 /nfs/dbraw/zinc/60/76/22/1098607622.db2.gz JTXOUYWWLKJNOY-ZDUSSCGKSA-N 1 1 369.446 4.269 20 5 FIBDMO CC[C@@H](C)[C@H](C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000532966464 1098635807 /nfs/dbraw/zinc/63/58/07/1098635807.db2.gz JHGWGKNAFOMNCU-NEPJUHHUSA-N 1 1 353.850 4.086 20 5 FIBDMO C[C@H](C(=O)Nc1ccc(Cl)c(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000533039043 1098703346 /nfs/dbraw/zinc/70/33/46/1098703346.db2.gz MYZMRKGACPWIMW-LBPRGKRZSA-N 1 1 361.829 4.052 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+](Cc2cccc(F)c2)C(C)C)cccc1[N+](=O)[O-] ZINC000533252390 1098913120 /nfs/dbraw/zinc/91/31/20/1098913120.db2.gz VXQGWEFKEDRBCL-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO CCCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000533289394 1098939149 /nfs/dbraw/zinc/93/91/49/1098939149.db2.gz IFBFBZYVPCZZRZ-OAHLLOKOSA-N 1 1 355.438 4.057 20 5 FIBDMO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000533380298 1098995791 /nfs/dbraw/zinc/99/57/91/1098995791.db2.gz HUDQYWZKFZPFND-YPMHNXCESA-N 1 1 364.808 4.030 20 5 FIBDMO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000533380298 1098995792 /nfs/dbraw/zinc/99/57/92/1098995792.db2.gz HUDQYWZKFZPFND-YPMHNXCESA-N 1 1 364.808 4.030 20 5 FIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(F)cc2c1OCOC2 ZINC000064350197 1099342491 /nfs/dbraw/zinc/34/24/91/1099342491.db2.gz OKJHGFWCCYSTHJ-UHFFFAOYSA-N 1 1 360.385 4.011 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(F)cc2c1OCOC2 ZINC000064350197 1099342507 /nfs/dbraw/zinc/34/25/07/1099342507.db2.gz OKJHGFWCCYSTHJ-UHFFFAOYSA-N 1 1 360.385 4.011 20 5 FIBDMO Cc1ccc(CN2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1[N+](=O)[O-] ZINC000516815283 1099824204 /nfs/dbraw/zinc/82/42/04/1099824204.db2.gz MLUQKWWPAZJJQT-QFIPXVFZSA-N 1 1 365.477 4.001 20 5 FIBDMO C[C@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000516814881 1099824996 /nfs/dbraw/zinc/82/49/96/1099824996.db2.gz JAVIPOMJYVCKRC-KSSFIOAISA-N 1 1 359.495 4.095 20 5 FIBDMO COc1cc(C[N@@H+](C)C2CCC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000536680230 1100173402 /nfs/dbraw/zinc/17/34/02/1100173402.db2.gz ITMULWQBHWVBHS-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO Cc1nc2scc(C3CC3)n2c1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000459464884 1100208655 /nfs/dbraw/zinc/20/86/55/1100208655.db2.gz NBXFNNOOUNERCA-LLVKDONJSA-N 1 1 356.451 4.341 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H]2CCCc2ccccc2)c1 ZINC001168153010 1101470938 /nfs/dbraw/zinc/47/09/38/1101470938.db2.gz DGHSRYKOCJYPJT-FPOVZHCZSA-N 1 1 354.450 4.116 20 5 FIBDMO C[N@@H+](CCc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1)C1CC1 ZINC000537129966 1101484983 /nfs/dbraw/zinc/48/49/83/1101484983.db2.gz PVADZVLOQPYOFZ-UHFFFAOYSA-N 1 1 373.840 4.137 20 5 FIBDMO C[C@H](c1ccccc1)[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000506601054 1101510681 /nfs/dbraw/zinc/51/06/81/1101510681.db2.gz OMOKFQNODYLDQM-CQSZACIVSA-N 1 1 354.406 4.187 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000506601054 1101510685 /nfs/dbraw/zinc/51/06/85/1101510685.db2.gz OMOKFQNODYLDQM-CQSZACIVSA-N 1 1 354.406 4.187 20 5 FIBDMO Cc1csc(C[NH2+]Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000518770242 1101548599 /nfs/dbraw/zinc/54/85/99/1101548599.db2.gz FKCUOWBCHSZKFP-UHFFFAOYSA-N 1 1 368.462 4.417 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2C/C=C/c2ccccc2[N+](=O)[O-])cc1OC ZINC000506636065 1101632178 /nfs/dbraw/zinc/63/21/78/1101632178.db2.gz ZSHMXNHGJZHCAE-MOTZXUDYSA-N 1 1 368.433 4.462 20 5 FIBDMO Cc1[nH+]ccn1CCCSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000537316565 1101649024 /nfs/dbraw/zinc/64/90/24/1101649024.db2.gz CDOYTYGPZUNZIJ-UHFFFAOYSA-N 1 1 358.423 4.078 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccncc1OCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000506660839 1101711284 /nfs/dbraw/zinc/71/12/84/1101711284.db2.gz LIIXQQXRXXLTIF-MRXNPFEDSA-N 1 1 363.417 4.420 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+](C)[C@H](C)c3ccccn3)o2)c([N+](=O)[O-])c1 ZINC000508648753 1102028869 /nfs/dbraw/zinc/02/88/69/1102028869.db2.gz OBBVQANQFWYABU-CQSZACIVSA-N 1 1 367.405 4.451 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H](C)c3ccccn3)o2)c([N+](=O)[O-])c1 ZINC000508648753 1102028882 /nfs/dbraw/zinc/02/88/82/1102028882.db2.gz OBBVQANQFWYABU-CQSZACIVSA-N 1 1 367.405 4.451 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@@H]23)s1 ZINC000237966015 1102371796 /nfs/dbraw/zinc/37/17/96/1102371796.db2.gz QQOUACLRJNBPEV-WMZOPIPTSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@H+]3CCCC[C@@H]23)s1 ZINC000237966015 1102371800 /nfs/dbraw/zinc/37/18/00/1102371800.db2.gz QQOUACLRJNBPEV-WMZOPIPTSA-N 1 1 357.479 4.040 20 5 FIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc(-c2ccccc2)nc1 ZINC000532490812 1102436003 /nfs/dbraw/zinc/43/60/03/1102436003.db2.gz UHJDVTYPAJFXCW-UHFFFAOYSA-N 1 1 362.433 4.462 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc(-c2ccccc2)nc1 ZINC000532490812 1102436006 /nfs/dbraw/zinc/43/60/06/1102436006.db2.gz UHJDVTYPAJFXCW-UHFFFAOYSA-N 1 1 362.433 4.462 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000532585887 1102506812 /nfs/dbraw/zinc/50/68/12/1102506812.db2.gz VVZRUCJMECIMPD-GOSISDBHSA-N 1 1 371.437 4.442 20 5 FIBDMO C[N@H+](Cc1ccc(OCc2cccnc2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000507116109 1103123904 /nfs/dbraw/zinc/12/39/04/1103123904.db2.gz NUXCRBRHMMJOLR-UHFFFAOYSA-N 1 1 363.417 4.201 20 5 FIBDMO C[N@@H+](Cc1ccc(OCc2cccnc2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000507116109 1103123907 /nfs/dbraw/zinc/12/39/07/1103123907.db2.gz NUXCRBRHMMJOLR-UHFFFAOYSA-N 1 1 363.417 4.201 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cc(F)cc2cccnc21)C1CC1 ZINC000507117178 1103125887 /nfs/dbraw/zinc/12/58/87/1103125887.db2.gz PAIGITRMQMMSLN-UHFFFAOYSA-N 1 1 351.381 4.447 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cc(F)cc2cccnc21)C1CC1 ZINC000507117178 1103125891 /nfs/dbraw/zinc/12/58/91/1103125891.db2.gz PAIGITRMQMMSLN-UHFFFAOYSA-N 1 1 351.381 4.447 20 5 FIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000507160825 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FVDUEXMXTDHWEM-SJCJKPOMSA-N 1 1 364.829 4.101 20 5 FIBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000441463401 1104795386 /nfs/dbraw/zinc/79/53/86/1104795386.db2.gz FIULONBKFRERPN-DYEKYZERSA-N 1 1 370.396 4.358 20 5 FIBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCc2sccc2C1 ZINC000520747956 1105193147 /nfs/dbraw/zinc/19/31/47/1105193147.db2.gz QUHAAWNKGWLDML-LLVKDONJSA-N 1 1 351.859 4.168 20 5 FIBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCc2sccc2C1 ZINC000520747956 1105193151 /nfs/dbraw/zinc/19/31/51/1105193151.db2.gz QUHAAWNKGWLDML-LLVKDONJSA-N 1 1 351.859 4.168 20 5 FIBDMO COc1ccc(C[NH+]2CCC(Oc3ccc(C)c(C)c3)CC2)cc1[N+](=O)[O-] ZINC000520042474 1107671987 /nfs/dbraw/zinc/67/19/87/1107671987.db2.gz JGLYNAYFMQZJHI-UHFFFAOYSA-N 1 1 370.449 4.264 20 5 FIBDMO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444672055 1108073377 /nfs/dbraw/zinc/07/33/77/1108073377.db2.gz FBONXZUPCZTGSB-KRWDZBQOSA-N 1 1 368.437 4.357 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(CO)(Cc2ccccc2)CC1 ZINC000444783959 1108170555 /nfs/dbraw/zinc/17/05/55/1108170555.db2.gz MDIVIPQFEWLYLN-UHFFFAOYSA-N 1 1 374.868 4.065 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ncc(-c2ccccc2)n1C ZINC000453226763 1108299332 /nfs/dbraw/zinc/29/93/32/1108299332.db2.gz PCCHFBDQSVOANZ-GJZGRUSLSA-N 1 1 350.422 4.407 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000523842302 1108603700 /nfs/dbraw/zinc/60/37/00/1108603700.db2.gz UTQTWIAUYHNOES-UHFFFAOYSA-N 1 1 360.841 4.429 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCCc4c[nH]nc43)s2)cc1 ZINC000532209296 1108712085 /nfs/dbraw/zinc/71/20/85/1108712085.db2.gz QHWPWCWJWRUVMP-INIZCTEOSA-N 1 1 354.435 4.214 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCC[N@@H+](Cc4ccccc4)C3)n2)s1 ZINC000445476286 1108815662 /nfs/dbraw/zinc/81/56/62/1108815662.db2.gz ASZDHVAEOTTWLQ-CQSZACIVSA-N 1 1 370.434 4.086 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000508534186 1108852452 /nfs/dbraw/zinc/85/24/52/1108852452.db2.gz WTWHISDORIWBOI-UHFFFAOYSA-N 1 1 355.438 4.387 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCC2CCCCC2)CC1 ZINC000525271572 1109318685 /nfs/dbraw/zinc/31/86/85/1109318685.db2.gz IZZQMELJPCIQGB-UHFFFAOYSA-N 1 1 362.470 4.165 20 5 FIBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000441229725 1109483179 /nfs/dbraw/zinc/48/31/79/1109483179.db2.gz JHPRFDXFHBIKBV-HNNXBMFYSA-N 1 1 374.437 4.074 20 5 FIBDMO C[C@H]1C[C@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000525709016 1109488016 /nfs/dbraw/zinc/48/80/16/1109488016.db2.gz DCFGVVLHPVLAAA-WMLDXEAASA-N 1 1 373.428 4.099 20 5 FIBDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCN1C ZINC000525709016 1109488018 /nfs/dbraw/zinc/48/80/18/1109488018.db2.gz DCFGVVLHPVLAAA-WMLDXEAASA-N 1 1 373.428 4.099 20 5 FIBDMO CC[C@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000428483947 1109531342 /nfs/dbraw/zinc/53/13/42/1109531342.db2.gz KUSDYMUAALSMJV-IBGZPJMESA-N 1 1 360.479 4.308 20 5 FIBDMO COc1ccc(OCC[N@@H+](Cc2ccccc2F)C(C)C)c([N+](=O)[O-])c1 ZINC000441275272 1109564861 /nfs/dbraw/zinc/56/48/61/1109564861.db2.gz IPSAJCXRUPOLBE-UHFFFAOYSA-N 1 1 362.401 4.032 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000527054954 1109681277 /nfs/dbraw/zinc/68/12/77/1109681277.db2.gz BHTKVTJQTTWVHR-WDBUWWRISA-N 1 1 358.360 4.041 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000527054954 1109681283 /nfs/dbraw/zinc/68/12/83/1109681283.db2.gz BHTKVTJQTTWVHR-WDBUWWRISA-N 1 1 358.360 4.041 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)cs1 ZINC000449369707 1110044726 /nfs/dbraw/zinc/04/47/26/1110044726.db2.gz UXVLUNGPSWYCMC-UHFFFAOYSA-N 1 1 358.341 4.334 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H](CCCO)C3)o2)c(Cl)c1 ZINC000449790912 1110172918 /nfs/dbraw/zinc/17/29/18/1110172918.db2.gz MSTQFNIXQWNETP-CYBMUJFWSA-N 1 1 364.829 4.103 20 5 FIBDMO CC[N@H+]1CC[C@@H](N(C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000538718097 1111260389 /nfs/dbraw/zinc/26/03/89/1111260389.db2.gz URSZNHBZTXIYMM-WMLDXEAASA-N 1 1 374.510 4.023 20 5 FIBDMO COc1cc(C[N@H+]2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c([N+](=O)[O-])cc1OC ZINC000538721070 1111261839 /nfs/dbraw/zinc/26/18/39/1111261839.db2.gz MIMIUDILAJAACG-DZGCQCFKSA-N 1 1 374.412 4.129 20 5 FIBDMO COc1cc(C[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000538721071 1111262184 /nfs/dbraw/zinc/26/21/84/1111262184.db2.gz MIMIUDILAJAACG-HIFRSBDPSA-N 1 1 374.412 4.129 20 5 FIBDMO CS[C@H]1CCCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000538799858 1111297278 /nfs/dbraw/zinc/29/72/78/1111297278.db2.gz ZLHULVVTEUPUCT-INIZCTEOSA-N 1 1 363.508 4.436 20 5 FIBDMO COc1ccc(Br)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000539066435 1111415900 /nfs/dbraw/zinc/41/59/00/1111415900.db2.gz HJZRFYVRTATSLY-LLVKDONJSA-N 1 1 365.227 4.217 20 5 FIBDMO COc1ccc(C2([NH2+]Cc3cc([N+](=O)[O-])ccc3OC(C)C)CC2)cc1 ZINC000539260894 1111497965 /nfs/dbraw/zinc/49/79/65/1111497965.db2.gz JMADBHLCHOIPEG-UHFFFAOYSA-N 1 1 356.422 4.170 20 5 FIBDMO C[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+]1CCCC[C@@H]1C ZINC000478641289 1111842448 /nfs/dbraw/zinc/84/24/48/1111842448.db2.gz CPELUVHRISAHTG-IRXDYDNUSA-N 1 1 361.489 4.381 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC000480204261 1112330810 /nfs/dbraw/zinc/33/08/10/1112330810.db2.gz SSYLIEVEGLALSP-ZFWWWQNUSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000480204261 1112330816 /nfs/dbraw/zinc/33/08/16/1112330816.db2.gz SSYLIEVEGLALSP-ZFWWWQNUSA-N 1 1 373.840 4.065 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2C2CCOCC2)c1 ZINC000555422398 1112828427 /nfs/dbraw/zinc/82/84/27/1112828427.db2.gz YOUDTCLUXSZFDS-INIZCTEOSA-N 1 1 358.360 4.005 20 5 FIBDMO CC1(C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]2CCC[C@@H]21 ZINC000555721350 1112978666 /nfs/dbraw/zinc/97/86/66/1112978666.db2.gz LNMNNRVKNBLXBB-DLBZAZTESA-N 1 1 355.438 4.303 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccnc(Oc3ccccc3F)c2)cs1 ZINC000486811374 1113650929 /nfs/dbraw/zinc/65/09/29/1113650929.db2.gz UHWOVLGKTSCDGA-UHFFFAOYSA-N 1 1 359.382 4.273 20 5 FIBDMO Cc1cc(F)ccc1C[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000488559927 1113953891 /nfs/dbraw/zinc/95/38/91/1113953891.db2.gz OLRLKINRPZGDGP-UHFFFAOYSA-N 1 1 368.412 4.075 20 5 FIBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)C(=O)Nc1ccccc1C ZINC000490033907 1114205435 /nfs/dbraw/zinc/20/54/35/1114205435.db2.gz ALULWWPDRDDTHA-QGZVFWFLSA-N 1 1 369.465 4.451 20 5 FIBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)C(=O)Nc1ccccc1C ZINC000490033907 1114205438 /nfs/dbraw/zinc/20/54/38/1114205438.db2.gz ALULWWPDRDDTHA-QGZVFWFLSA-N 1 1 369.465 4.451 20 5 FIBDMO Cc1ccc([C@H]2C[C@H](C)[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000490077282 1114213913 /nfs/dbraw/zinc/21/39/13/1114213913.db2.gz DIOOLVVACPLTBJ-HOCLYGCPSA-N 1 1 351.406 4.422 20 5 FIBDMO O=[N+]([O-])c1cccc([C@H](N[C@H]2CC[N@H+](C3CCCC3)C2)c2ccccc2)c1 ZINC000491060506 1114368732 /nfs/dbraw/zinc/36/87/32/1114368732.db2.gz ODLKPGXYMVLHPR-SIKLNZKXSA-N 1 1 365.477 4.291 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H](N[C@H]2CC[N@H+](C3CCCC3)C2)c2ccccc2)c1 ZINC000491060507 1114369038 /nfs/dbraw/zinc/36/90/38/1114369038.db2.gz ODLKPGXYMVLHPR-UGKGYDQZSA-N 1 1 365.477 4.291 20 5 FIBDMO CCOC1CC2(C1)CC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C2 ZINC000590183039 1114904841 /nfs/dbraw/zinc/90/48/41/1114904841.db2.gz MQUSJSCWHSGUGT-UHFFFAOYSA-N 1 1 358.360 4.005 20 5 FIBDMO CCOC1CC2(C1)CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C2 ZINC000590183039 1114904845 /nfs/dbraw/zinc/90/48/45/1114904845.db2.gz MQUSJSCWHSGUGT-UHFFFAOYSA-N 1 1 358.360 4.005 20 5 FIBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(F)c(Br)c1 ZINC000590193318 1114905563 /nfs/dbraw/zinc/90/55/63/1114905563.db2.gz LUFYUEFQHZAIFU-MRVPVSSYSA-N 1 1 359.220 4.409 20 5 FIBDMO COCc1ccccc1/C=C(/C)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000590353967 1114924204 /nfs/dbraw/zinc/92/42/04/1114924204.db2.gz VGIFPCYCNWFWJF-VBKFSLOCSA-N 1 1 352.434 4.203 20 5 FIBDMO COCc1ccccc1/C=C(/C)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000590353967 1114924208 /nfs/dbraw/zinc/92/42/08/1114924208.db2.gz VGIFPCYCNWFWJF-VBKFSLOCSA-N 1 1 352.434 4.203 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](CCc3ccccc3)C3CC3)co2)cc1 ZINC000760818594 1115046471 /nfs/dbraw/zinc/04/64/71/1115046471.db2.gz GYPCKRMRAIMGAQ-UHFFFAOYSA-N 1 1 363.417 4.457 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2Br)[C@H]2CCCC[C@H]12 ZINC001168400985 1115107586 /nfs/dbraw/zinc/10/75/86/1115107586.db2.gz GMKAWOOGORHIOG-BNOWGMLFSA-N 1 1 353.260 4.368 20 5 FIBDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1cc2ccccc2c2cccnc12 ZINC000592777153 1115261970 /nfs/dbraw/zinc/26/19/70/1115261970.db2.gz MPHGLNGVNDUGAS-KRWDZBQOSA-N 1 1 359.473 4.135 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccccc3Cl)CCC2)c2c(c1)COCO2 ZINC000593042969 1115281725 /nfs/dbraw/zinc/28/17/25/1115281725.db2.gz VILARNBRHVOUAK-UHFFFAOYSA-N 1 1 374.824 4.284 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccccc1OC1CCC1 ZINC000595018662 1115503945 /nfs/dbraw/zinc/50/39/45/1115503945.db2.gz CQOBZLZQTKTEHM-CQSZACIVSA-N 1 1 356.422 4.386 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1csc(Br)c1 ZINC000595007223 1115507838 /nfs/dbraw/zinc/50/78/38/1115507838.db2.gz KHXVJFSLHNKMOE-SECBINFHSA-N 1 1 371.256 4.278 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccccc1OCC1CC1 ZINC000595008667 1115508141 /nfs/dbraw/zinc/50/81/41/1115508141.db2.gz PRALPDGMAZOESS-CQSZACIVSA-N 1 1 356.422 4.243 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000595358216 1115533831 /nfs/dbraw/zinc/53/38/31/1115533831.db2.gz SHJFQONFZUDMEI-AWEZNQCLSA-N 1 1 355.369 4.255 20 5 FIBDMO CC(C)([NH2+]Cc1cc(F)ccc1OC(F)F)c1ccccc1[N+](=O)[O-] ZINC000595513252 1115539586 /nfs/dbraw/zinc/53/95/86/1115539586.db2.gz YNAKMALVEZODAH-UHFFFAOYSA-N 1 1 354.328 4.360 20 5 FIBDMO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595550066 1115541887 /nfs/dbraw/zinc/54/18/87/1115541887.db2.gz OOMHVBAVINMHPZ-UHFFFAOYSA-N 1 1 352.793 4.421 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000593123892 1115564064 /nfs/dbraw/zinc/56/40/64/1115564064.db2.gz GHAJVEBMELFRCO-UFYCRDLUSA-N 1 1 356.397 4.229 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000593123892 1115564065 /nfs/dbraw/zinc/56/40/65/1115564065.db2.gz GHAJVEBMELFRCO-UFYCRDLUSA-N 1 1 356.397 4.229 20 5 FIBDMO C[C@@H]([NH2+][C@H](CO)c1cccc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000595827442 1115565050 /nfs/dbraw/zinc/56/50/50/1115565050.db2.gz BXPAMCPWFBUBCQ-MEBBXXQBSA-N 1 1 355.221 4.286 20 5 FIBDMO O=C(c1ccc(Cl)cc1)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000060482358 1115646296 /nfs/dbraw/zinc/64/62/96/1115646296.db2.gz OBOLWOXKCZTEFT-UHFFFAOYSA-N 1 1 358.825 4.343 20 5 FIBDMO Cc1nn(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761292271 1115765602 /nfs/dbraw/zinc/76/56/02/1115765602.db2.gz QOSWLPVDYNEMDW-LJQANCHMSA-N 1 1 368.462 4.001 20 5 FIBDMO Cc1nn(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761292271 1115765609 /nfs/dbraw/zinc/76/56/09/1115765609.db2.gz QOSWLPVDYNEMDW-LJQANCHMSA-N 1 1 368.462 4.001 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C)c(Br)cn2)cc1[N+](=O)[O-] ZINC000598964945 1115771726 /nfs/dbraw/zinc/77/17/26/1115771726.db2.gz IGOSORVOQVZOLW-GFCCVEGCSA-N 1 1 364.243 4.220 20 5 FIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(OC(F)(F)F)cc1 ZINC000603840723 1115818506 /nfs/dbraw/zinc/81/85/06/1115818506.db2.gz ZJHQSMZTLOBOCF-UHFFFAOYSA-N 1 1 370.327 4.004 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]2CCCC[C@@H]12 ZINC000603846834 1115820879 /nfs/dbraw/zinc/82/08/79/1115820879.db2.gz CXDPQLUKNNYLJA-COXVUDFISA-N 1 1 356.426 4.045 20 5 FIBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000603860471 1115820905 /nfs/dbraw/zinc/82/09/05/1115820905.db2.gz CRJSDJRBTGPSAE-IYBDPMFKSA-N 1 1 356.470 4.313 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1ccccc1)C(C)C ZINC000063483746 1116073615 /nfs/dbraw/zinc/07/36/15/1116073615.db2.gz ABRBLWSPJJWACT-UHFFFAOYSA-N 1 1 355.438 4.142 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000608835522 1116130934 /nfs/dbraw/zinc/13/09/34/1116130934.db2.gz RHXFMBPAKJPEKE-INIZCTEOSA-N 1 1 357.454 4.209 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H]3Cc3ccccc3)co2)cc1 ZINC000534079381 1116156870 /nfs/dbraw/zinc/15/68/70/1116156870.db2.gz GFQLDLKGXUYQEJ-FQEVSTJZSA-N 1 1 363.417 4.457 20 5 FIBDMO CCS[C@H]1CCCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089897594 1116338632 /nfs/dbraw/zinc/33/86/32/1116338632.db2.gz VCPMTOHRKWSATD-KRWDZBQOSA-N 1 1 361.467 4.357 20 5 FIBDMO Cn1ncc(C2CC2)c1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000595078042 1116393753 /nfs/dbraw/zinc/39/37/53/1116393753.db2.gz SIAVOUNEQRICGK-NRFANRHFSA-N 1 1 362.433 4.085 20 5 FIBDMO CC(C)c1ccc(C[NH+]2CCC(c3noc(C4CC4)n3)CC2)cc1[N+](=O)[O-] ZINC000463060143 1117946948 /nfs/dbraw/zinc/94/69/48/1117946948.db2.gz WGKSUTKUODYJOO-UHFFFAOYSA-N 1 1 370.453 4.358 20 5 FIBDMO C[C@@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[N@H+]1C ZINC000540610965 1118150309 /nfs/dbraw/zinc/15/03/09/1118150309.db2.gz YVKWQWNKCHLRIJ-CHWSQXEVSA-N 1 1 363.845 4.081 20 5 FIBDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCN1C ZINC000540610965 1118150311 /nfs/dbraw/zinc/15/03/11/1118150311.db2.gz YVKWQWNKCHLRIJ-CHWSQXEVSA-N 1 1 363.845 4.081 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000541022124 1118351779 /nfs/dbraw/zinc/35/17/79/1118351779.db2.gz UGPWYZFAHLWOJV-VBHSOAQHSA-N 1 1 365.861 4.087 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000541022124 1118351784 /nfs/dbraw/zinc/35/17/84/1118351784.db2.gz UGPWYZFAHLWOJV-VBHSOAQHSA-N 1 1 365.861 4.087 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cccc(OC(F)F)c1 ZINC000122417152 1118435068 /nfs/dbraw/zinc/43/50/68/1118435068.db2.gz CDNROKORNXGKTQ-NSHDSACASA-N 1 1 352.337 4.056 20 5 FIBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000464780445 1118691917 /nfs/dbraw/zinc/69/19/17/1118691917.db2.gz SUFHBRFYLZMNSO-NVXWUHKLSA-N 1 1 352.500 4.488 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000464858894 1118726626 /nfs/dbraw/zinc/72/66/26/1118726626.db2.gz XEMYLJGEDXUHOU-KDOFPFPSSA-N 1 1 371.437 4.298 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)C[C@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000464862012 1118728033 /nfs/dbraw/zinc/72/80/33/1118728033.db2.gz WGMHJGHFCSXNCJ-KSSFIOAISA-N 1 1 371.437 4.298 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)cc1 ZINC000443662687 1118751729 /nfs/dbraw/zinc/75/17/29/1118751729.db2.gz XJEMDEMSASRWAW-OAHLLOKOSA-N 1 1 369.396 4.297 20 5 FIBDMO COc1cccc([C@H]2C[C@@H](C)C[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000542247185 1118866334 /nfs/dbraw/zinc/86/63/34/1118866334.db2.gz PMODCCAOWGTOHB-RDTXWAMCSA-N 1 1 356.422 4.195 20 5 FIBDMO Cc1ccccc1[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000272101350 1119174325 /nfs/dbraw/zinc/17/43/25/1119174325.db2.gz ZUCGJOVNRZUACB-IBGZPJMESA-N 1 1 364.405 4.194 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000492912787 1119212355 /nfs/dbraw/zinc/21/23/55/1119212355.db2.gz QCGWLFRTFLOPAQ-IIBYNOLFSA-N 1 1 352.434 4.138 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000492912787 1119212361 /nfs/dbraw/zinc/21/23/61/1119212361.db2.gz QCGWLFRTFLOPAQ-IIBYNOLFSA-N 1 1 352.434 4.138 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000122613146 1119291624 /nfs/dbraw/zinc/29/16/24/1119291624.db2.gz ALJYXXVJLWVUFE-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO C[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC000761524535 1119412085 /nfs/dbraw/zinc/41/20/85/1119412085.db2.gz FKDVVUXMIIPQJG-YJBOKZPZSA-N 1 1 373.884 4.391 20 5 FIBDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCN1Cc1ccccc1 ZINC000761524535 1119412088 /nfs/dbraw/zinc/41/20/88/1119412088.db2.gz FKDVVUXMIIPQJG-YJBOKZPZSA-N 1 1 373.884 4.391 20 5 FIBDMO CCCC[N@H+](C)c1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000730574920 1120063260 /nfs/dbraw/zinc/06/32/60/1120063260.db2.gz FAXQOPXDKAUQII-HNNXBMFYSA-N 1 1 370.453 4.270 20 5 FIBDMO CCCC[N@@H+](C)c1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000730574920 1120063265 /nfs/dbraw/zinc/06/32/65/1120063265.db2.gz FAXQOPXDKAUQII-HNNXBMFYSA-N 1 1 370.453 4.270 20 5 FIBDMO CC(C)[N@H+](C)Cc1nc(-c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2)no1 ZINC000761857085 1120555419 /nfs/dbraw/zinc/55/54/19/1120555419.db2.gz MGVIJFIHOOIVSM-UHFFFAOYSA-N 1 1 368.393 4.277 20 5 FIBDMO CC(C)[N@@H+](C)Cc1nc(-c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2)no1 ZINC000761857085 1120555424 /nfs/dbraw/zinc/55/54/24/1120555424.db2.gz MGVIJFIHOOIVSM-UHFFFAOYSA-N 1 1 368.393 4.277 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccc(OC(F)(F)F)cc1 ZINC000495364133 1120744622 /nfs/dbraw/zinc/74/46/22/1120744622.db2.gz MSXNFPZPXLOVGT-UHFFFAOYSA-N 1 1 370.327 4.134 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccc(OC(F)(F)F)cc1 ZINC000495364133 1120744628 /nfs/dbraw/zinc/74/46/28/1120744628.db2.gz MSXNFPZPXLOVGT-UHFFFAOYSA-N 1 1 370.327 4.134 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000193386705 1120845608 /nfs/dbraw/zinc/84/56/08/1120845608.db2.gz QKIJSASHRGAASE-OAHLLOKOSA-N 1 1 367.449 4.387 20 5 FIBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2c3ccccc3ncc2[N+](=O)[O-])C1 ZINC000488076397 1121408581 /nfs/dbraw/zinc/40/85/81/1121408581.db2.gz MXWSYTOVEQVWRQ-IRXDYDNUSA-N 1 1 368.481 4.234 20 5 FIBDMO CC[N@@H+](C)C[C@@H]1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301465699 1122124048 /nfs/dbraw/zinc/12/40/48/1122124048.db2.gz XEFQSIULPONIKZ-JTQLQIEISA-N 1 1 365.783 4.045 20 5 FIBDMO Cc1ccc([C@@H](C)NCc2cccc(C[NH+]3CCCC3)c2)cc1[N+](=O)[O-] ZINC000123023448 1122233245 /nfs/dbraw/zinc/23/32/45/1122233245.db2.gz YDMLVNSEFFHJRK-QGZVFWFLSA-N 1 1 353.466 4.350 20 5 FIBDMO CCC1CCC([N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C2CC2)CC1 ZINC000917439643 1122305615 /nfs/dbraw/zinc/30/56/15/1122305615.db2.gz ALORVKBUCNEWRF-UHFFFAOYSA-N 1 1 369.469 4.244 20 5 FIBDMO Cc1cccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000917841969 1122457687 /nfs/dbraw/zinc/45/76/87/1122457687.db2.gz RMYVIKTVFPNEMJ-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1cccc(C[N@H+](C)[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000917841969 1122457691 /nfs/dbraw/zinc/45/76/91/1122457691.db2.gz RMYVIKTVFPNEMJ-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO CC[N@H+](Cc1cccs1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000194702149 1122733574 /nfs/dbraw/zinc/73/35/74/1122733574.db2.gz GFABPDZBQMYLLP-LLVKDONJSA-N 1 1 367.858 4.159 20 5 FIBDMO CC[N@@H+](Cc1cccs1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000194702149 1122733579 /nfs/dbraw/zinc/73/35/79/1122733579.db2.gz GFABPDZBQMYLLP-LLVKDONJSA-N 1 1 367.858 4.159 20 5 FIBDMO CC(C)c1ncc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000130724184 1123535102 /nfs/dbraw/zinc/53/51/02/1123535102.db2.gz HUHUREJNKCDSOG-UHFFFAOYSA-N 1 1 361.467 4.218 20 5 FIBDMO CC1CCC(OC2CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)CC1 ZINC000609386562 1123699109 /nfs/dbraw/zinc/69/91/09/1123699109.db2.gz LUHHARZXXDBWBY-UHFFFAOYSA-N 1 1 350.434 4.294 20 5 FIBDMO CC(C)[N@H+](CC(=O)N(C)[C@H](C)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350344 1123706127 /nfs/dbraw/zinc/70/61/27/1123706127.db2.gz HDDTZRZPMBVLRZ-QGZVFWFLSA-N 1 1 369.465 4.025 20 5 FIBDMO CC(C)[N@@H+](CC(=O)N(C)[C@H](C)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350344 1123706133 /nfs/dbraw/zinc/70/61/33/1123706133.db2.gz HDDTZRZPMBVLRZ-QGZVFWFLSA-N 1 1 369.465 4.025 20 5 FIBDMO CCOC(=O)CC[C@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000615834551 1124127613 /nfs/dbraw/zinc/12/76/13/1124127613.db2.gz ODFUOJQMOZWTMX-NWNNTGRJSA-N 1 1 360.454 4.053 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+](C)Cc3ccc(C)cn3)o2)c([N+](=O)[O-])c1 ZINC000616152066 1124250506 /nfs/dbraw/zinc/25/05/06/1124250506.db2.gz JJCRFMPYKFPFHH-UHFFFAOYSA-N 1 1 367.405 4.199 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)Cc3ccc(C)cn3)o2)c([N+](=O)[O-])c1 ZINC000616152066 1124250513 /nfs/dbraw/zinc/25/05/13/1124250513.db2.gz JJCRFMPYKFPFHH-UHFFFAOYSA-N 1 1 367.405 4.199 20 5 FIBDMO CCC[C@]1(CO)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000554887956 1124727488 /nfs/dbraw/zinc/72/74/88/1124727488.db2.gz NFDGPHLGBRHFPA-IBGZPJMESA-N 1 1 360.479 4.308 20 5 FIBDMO c1ccc2c(c1)cc(-c1noc(CNCC3CC[NH2+]CC3)n1)c1ccccc21 ZINC001212320593 1124738373 /nfs/dbraw/zinc/73/83/73/1124738373.db2.gz RGTMFODLSRTXSW-UHFFFAOYSA-N 1 1 372.472 4.132 20 5 FIBDMO O=[N+]([O-])c1cnc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c(Cl)c1 ZINC000301250297 1125075595 /nfs/dbraw/zinc/07/55/95/1125075595.db2.gz BDGXPWSHDLDWSQ-GFCCVEGCSA-N 1 1 366.874 4.029 20 5 FIBDMO COc1cc(N[C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)ccc1[N+](=O)[O-] ZINC000301727440 1125145862 /nfs/dbraw/zinc/14/58/62/1125145862.db2.gz BHXAKHLCXDETEJ-ZDUSSCGKSA-N 1 1 352.394 4.271 20 5 FIBDMO COc1cccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000113314351 1125149037 /nfs/dbraw/zinc/14/90/37/1125149037.db2.gz WCZVMRYYVBUOTB-UHFFFAOYSA-N 1 1 355.419 4.017 20 5 FIBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCN(Cc2ccccc2)CC1 ZINC000255125354 1125184650 /nfs/dbraw/zinc/18/46/50/1125184650.db2.gz KOCMENLCLOPPSL-XFFZJAGNSA-N 1 1 365.477 4.204 20 5 FIBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2)CC1 ZINC000255125354 1125184653 /nfs/dbraw/zinc/18/46/53/1125184653.db2.gz KOCMENLCLOPPSL-XFFZJAGNSA-N 1 1 365.477 4.204 20 5 FIBDMO C[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311547107 1125185861 /nfs/dbraw/zinc/18/58/61/1125185861.db2.gz OUOZAOGHOCYDRE-YJBOKZPZSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@@H]1C[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301740800 1125190550 /nfs/dbraw/zinc/19/05/50/1125190550.db2.gz KQQNUODPIQCBJE-CJNGLKHVSA-N 1 1 360.845 4.108 20 5 FIBDMO C[C@@H]1C[C@@H](N(C)c2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301748819 1125194504 /nfs/dbraw/zinc/19/45/04/1125194504.db2.gz SOWMJELOEDTRRJ-PBHICJAKSA-N 1 1 374.872 4.133 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(C(F)(F)F)c1 ZINC000301750041 1125194770 /nfs/dbraw/zinc/19/47/70/1125194770.db2.gz ALAZXKDLNQEAJQ-WBMJQRKESA-N 1 1 369.387 4.067 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312531591 1125400053 /nfs/dbraw/zinc/40/00/53/1125400053.db2.gz PSLQFZKLHDONTL-UEXGIBASSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312531591 1125400057 /nfs/dbraw/zinc/40/00/57/1125400057.db2.gz PSLQFZKLHDONTL-UEXGIBASSA-N 1 1 367.493 4.464 20 5 FIBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000038039064 204786462 /nfs/dbraw/zinc/78/64/62/204786462.db2.gz PCCZKJTWQAWIAI-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000052212632 205186212 /nfs/dbraw/zinc/18/62/12/205186212.db2.gz ABNRMLPRUXWNAU-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])Cc1ccccc1N1CCCC1 ZINC000568496244 568037420 /nfs/dbraw/zinc/03/74/20/568037420.db2.gz IWXLMRRHUFZNOK-UHFFFAOYSA-N 1 1 359.857 4.480 20 5 FIBDMO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])Cc1ccccc1N1CCCC1 ZINC000568496244 568037421 /nfs/dbraw/zinc/03/74/21/568037421.db2.gz IWXLMRRHUFZNOK-UHFFFAOYSA-N 1 1 359.857 4.480 20 5 FIBDMO C[C@H]([NH3+])C1CCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000563129481 568261428 /nfs/dbraw/zinc/26/14/28/568261428.db2.gz CELOUXHGOLPPBZ-AWEZNQCLSA-N 1 1 373.428 4.085 20 5 FIBDMO CCCc1nc(C)c(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)o1 ZINC000291710691 568278393 /nfs/dbraw/zinc/27/83/93/568278393.db2.gz LHBSTOLDYDDHEH-UHFFFAOYSA-N 1 1 355.394 4.394 20 5 FIBDMO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302035185 568313190 /nfs/dbraw/zinc/31/31/90/568313190.db2.gz FGEZMSAMLZOEJO-STQMWFEESA-N 1 1 369.412 4.261 20 5 FIBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1F ZINC000182007337 568388394 /nfs/dbraw/zinc/38/83/94/568388394.db2.gz ZFUAZSCTCTWSNV-CYBMUJFWSA-N 1 1 362.401 4.381 20 5 FIBDMO COc1ccc([C@@H](C)[NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1F ZINC000182024602 568557451 /nfs/dbraw/zinc/55/74/51/568557451.db2.gz IRMNPQWDFBTQEB-GFCCVEGCSA-N 1 1 371.368 4.248 20 5 FIBDMO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000025947360 568627790 /nfs/dbraw/zinc/62/77/90/568627790.db2.gz XUBKIVVLUUTWIH-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000025947360 568627793 /nfs/dbraw/zinc/62/77/93/568627793.db2.gz XUBKIVVLUUTWIH-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000619509968 1125602872 /nfs/dbraw/zinc/60/28/72/1125602872.db2.gz XYGWDYIQGYYTII-DOTOQJQBSA-N 1 1 353.422 4.007 20 5 FIBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000049525857 1079584963 /nfs/dbraw/zinc/58/49/63/1079584963.db2.gz MNRRYFZYSNWCKQ-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000046156095 1079586085 /nfs/dbraw/zinc/58/60/85/1079586085.db2.gz JMYUHQWHTUJXGP-INIZCTEOSA-N 1 1 367.449 4.008 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@@H]3c3ccccc3)n2)c1 ZINC000577552056 1079592508 /nfs/dbraw/zinc/59/25/08/1079592508.db2.gz SAVRPMYJYKNGAR-GOSISDBHSA-N 1 1 364.405 4.372 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@@H]3c3ccccc3)n2)c1 ZINC000577552056 1079592515 /nfs/dbraw/zinc/59/25/15/1079592515.db2.gz SAVRPMYJYKNGAR-GOSISDBHSA-N 1 1 364.405 4.372 20 5 FIBDMO Cc1ccccc1[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)C ZINC000183224296 1125781384 /nfs/dbraw/zinc/78/13/84/1125781384.db2.gz IGZNBABNOSQLRI-LJQANCHMSA-N 1 1 366.421 4.440 20 5 FIBDMO CCOC(=O)C(C)(C)C1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000510083815 1079911504 /nfs/dbraw/zinc/91/15/04/1079911504.db2.gz HUABFDDMAMBGOJ-UHFFFAOYSA-N 1 1 368.861 4.050 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[NH2+]C3(C(F)F)CCCCC3)o2)c1 ZINC000510088780 1079937008 /nfs/dbraw/zinc/93/70/08/1079937008.db2.gz UPVAFDUUYIHCLK-UHFFFAOYSA-N 1 1 365.380 4.350 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(C(=O)c2ccc(C)cc2)CC1 ZINC000430213874 1079989292 /nfs/dbraw/zinc/98/92/92/1079989292.db2.gz VSXPTHKXGQYRFK-UHFFFAOYSA-N 1 1 368.433 4.007 20 5 FIBDMO C[C@@H](c1ccc([S@](C)=O)cc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154123987 1079995115 /nfs/dbraw/zinc/99/51/15/1079995115.db2.gz BUJZSVZIJZLXHD-FNODVLLQSA-N 1 1 366.870 4.179 20 5 FIBDMO C[C@@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154123987 1079995118 /nfs/dbraw/zinc/99/51/18/1079995118.db2.gz BUJZSVZIJZLXHD-FNODVLLQSA-N 1 1 366.870 4.179 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000430222991 1080016841 /nfs/dbraw/zinc/01/68/41/1080016841.db2.gz VORPZRCIKYEFSH-PXNSSMCTSA-N 1 1 374.412 4.095 20 5 FIBDMO Cc1cc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000157612578 1080037274 /nfs/dbraw/zinc/03/72/74/1080037274.db2.gz HDETZBUWTLVSGL-QGZVFWFLSA-N 1 1 373.497 4.020 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(c2ncccc2Cl)CC1 ZINC000430240864 1080067037 /nfs/dbraw/zinc/06/70/37/1080067037.db2.gz VCOPXFSMJFRZHW-UHFFFAOYSA-N 1 1 361.829 4.031 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cccnc1OC1CCCC1 ZINC001648789190 1080125157 /nfs/dbraw/zinc/12/51/57/1080125157.db2.gz FGZAYDIHSYLUBU-UHFFFAOYSA-N 1 1 355.438 4.218 20 5 FIBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1F ZINC000127093829 1080190482 /nfs/dbraw/zinc/19/04/82/1080190482.db2.gz ITXSEXAKMZHUBJ-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000134450191 1080232234 /nfs/dbraw/zinc/23/22/34/1080232234.db2.gz JEQYOWLWROEZRE-LBPRGKRZSA-N 1 1 371.384 4.450 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)cc1 ZINC000134460960 1080233774 /nfs/dbraw/zinc/23/37/74/1080233774.db2.gz KHUBHSHWBRDGAA-GFCCVEGCSA-N 1 1 371.384 4.450 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@@H+]2CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC001167138847 1080684339 /nfs/dbraw/zinc/68/43/39/1080684339.db2.gz RRVRAMANYHJCJU-QGZVFWFLSA-N 1 1 373.840 4.332 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC001167138847 1080684342 /nfs/dbraw/zinc/68/43/42/1080684342.db2.gz RRVRAMANYHJCJU-QGZVFWFLSA-N 1 1 373.840 4.332 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000247027307 1080710201 /nfs/dbraw/zinc/71/02/01/1080710201.db2.gz MDOYKFVAZBFHOF-ZSZQSSIHSA-N 1 1 359.495 4.390 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000247027307 1080710213 /nfs/dbraw/zinc/71/02/13/1080710213.db2.gz MDOYKFVAZBFHOF-ZSZQSSIHSA-N 1 1 359.495 4.390 20 5 FIBDMO CC[C@H](C)[N@@H+](CCc1ccccc1F)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001167244070 1080901798 /nfs/dbraw/zinc/90/17/98/1080901798.db2.gz FJYIHZFTANGGGT-YWZLYKJASA-N 1 1 360.429 4.111 20 5 FIBDMO CCCn1c2ccccc2nc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000578698791 1081150257 /nfs/dbraw/zinc/15/02/57/1081150257.db2.gz JOERREPUCBNZGA-UHFFFAOYSA-N 1 1 352.438 4.029 20 5 FIBDMO CCCn1c2ccccc2nc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000578698791 1081150258 /nfs/dbraw/zinc/15/02/58/1081150258.db2.gz JOERREPUCBNZGA-UHFFFAOYSA-N 1 1 352.438 4.029 20 5 FIBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(C(F)(F)F)c1 ZINC000177013421 1081181759 /nfs/dbraw/zinc/18/17/59/1081181759.db2.gz AGDZKUJQCSUIJO-UHFFFAOYSA-N 1 1 365.311 4.387 20 5 FIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(C(F)(F)F)c1 ZINC000177013421 1081181760 /nfs/dbraw/zinc/18/17/60/1081181760.db2.gz AGDZKUJQCSUIJO-UHFFFAOYSA-N 1 1 365.311 4.387 20 5 FIBDMO COc1cc(Cl)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC001648832788 1081272123 /nfs/dbraw/zinc/27/21/23/1081272123.db2.gz MMTQDRVNIACJBM-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1nc2cc(Cl)ccc2n1C ZINC000547979391 1081308514 /nfs/dbraw/zinc/30/85/14/1081308514.db2.gz LSTURLGJXIUEAB-LBPRGKRZSA-N 1 1 358.829 4.294 20 5 FIBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000536021099 1081415955 /nfs/dbraw/zinc/41/59/55/1081415955.db2.gz AMXDDXQHPOGXQI-INIZCTEOSA-N 1 1 351.328 4.212 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(C4CCCC4)CC3)o2)cc1 ZINC000610370905 1081554968 /nfs/dbraw/zinc/55/49/68/1081554968.db2.gz XPOJZTJGJBJBII-UHFFFAOYSA-N 1 1 356.426 4.047 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H](Cc4ccccc4)C3)co2)cc1 ZINC000536365420 1081827715 /nfs/dbraw/zinc/82/77/15/1081827715.db2.gz JVJPJGLTQTVYMV-QGZVFWFLSA-N 1 1 363.417 4.314 20 5 FIBDMO Cc1cccc(C)c1NC(=O)CCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000177887741 1082273493 /nfs/dbraw/zinc/27/34/93/1082273493.db2.gz DHXPRLLMCBZQOS-UHFFFAOYSA-N 1 1 355.438 4.062 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1csc(Br)c1 ZINC000064994439 1082723759 /nfs/dbraw/zinc/72/37/59/1082723759.db2.gz LHHZGMWLAFYPRM-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cnn(Cc2ccccc2)c1 ZINC000090853217 1082742671 /nfs/dbraw/zinc/74/26/71/1082742671.db2.gz FYLGRFVCSUXVTF-CVEARBPZSA-N 1 1 350.422 4.251 20 5 FIBDMO Cc1ccc([C@H]2CCCC[N@@H+]2CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC001167481967 1082874770 /nfs/dbraw/zinc/87/47/70/1082874770.db2.gz BKIUSRRGCLNCGJ-HXUWFJFHSA-N 1 1 367.449 4.377 20 5 FIBDMO Cc1ccc([C@H]2CCCC[N@H+]2CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC001167481967 1082874774 /nfs/dbraw/zinc/87/47/74/1082874774.db2.gz BKIUSRRGCLNCGJ-HXUWFJFHSA-N 1 1 367.449 4.377 20 5 FIBDMO COc1ccc2nc(C[NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)sc2c1 ZINC000187443868 1082944622 /nfs/dbraw/zinc/94/46/22/1082944622.db2.gz PPKFCCDEIHYVGD-GFCCVEGCSA-N 1 1 357.435 4.372 20 5 FIBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001167487149 1082956301 /nfs/dbraw/zinc/95/63/01/1082956301.db2.gz GKDZKSQJBPEABD-FPOVZHCZSA-N 1 1 356.466 4.280 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582440 1083212392 /nfs/dbraw/zinc/21/23/92/1083212392.db2.gz HXOIGVKTJSVRTE-SJKOYZFVSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582440 1083212396 /nfs/dbraw/zinc/21/23/96/1083212396.db2.gz HXOIGVKTJSVRTE-SJKOYZFVSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@H]1c1cccc(F)c1 ZINC000610582290 1083212789 /nfs/dbraw/zinc/21/27/89/1083212789.db2.gz BMMGTKLCKQXPQU-CWTRNNRKSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@H]1c1cccc(F)c1 ZINC000610582290 1083212792 /nfs/dbraw/zinc/21/27/92/1083212792.db2.gz BMMGTKLCKQXPQU-CWTRNNRKSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604869 1083260591 /nfs/dbraw/zinc/26/05/91/1083260591.db2.gz QEPXNZDZEVIXHO-INTQDDNPSA-N 1 1 356.266 4.328 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604869 1083260595 /nfs/dbraw/zinc/26/05/95/1083260595.db2.gz QEPXNZDZEVIXHO-INTQDDNPSA-N 1 1 356.266 4.328 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(F)cn2)ccc1Oc1ccc(F)cc1 ZINC000610787710 1083508016 /nfs/dbraw/zinc/50/80/16/1083508016.db2.gz FNWNQTMZMNBGMM-UHFFFAOYSA-N 1 1 371.343 4.350 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](Cn2cnc3ccccc32)C1 ZINC000614235773 1083579132 /nfs/dbraw/zinc/57/91/32/1083579132.db2.gz GIHKHDWMDKNBQZ-IRXDYDNUSA-N 1 1 364.449 4.418 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](Cn2cnc3ccccc32)C1 ZINC000614235774 1083579238 /nfs/dbraw/zinc/57/92/38/1083579238.db2.gz GIHKHDWMDKNBQZ-SJORKVTESA-N 1 1 364.449 4.418 20 5 FIBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000535719389 1083607965 /nfs/dbraw/zinc/60/79/65/1083607965.db2.gz VDRVJAXXTVNNHZ-KRWDZBQOSA-N 1 1 355.438 4.371 20 5 FIBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000535719390 1083608020 /nfs/dbraw/zinc/60/80/20/1083608020.db2.gz VDRVJAXXTVNNHZ-QGZVFWFLSA-N 1 1 355.438 4.371 20 5 FIBDMO Cc1ccc(C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C(C)C)s1 ZINC000065161792 1083755377 /nfs/dbraw/zinc/75/53/77/1083755377.db2.gz VOPKKGDXKLFZAO-UHFFFAOYSA-N 1 1 372.450 4.425 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C(C)C)s1 ZINC000065161792 1083755391 /nfs/dbraw/zinc/75/53/91/1083755391.db2.gz VOPKKGDXKLFZAO-UHFFFAOYSA-N 1 1 372.450 4.425 20 5 FIBDMO C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548933640 1083844061 /nfs/dbraw/zinc/84/40/61/1083844061.db2.gz IMIAIWKFSXGDLC-HNNXBMFYSA-N 1 1 351.406 4.485 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000548934666 1083847825 /nfs/dbraw/zinc/84/78/25/1083847825.db2.gz NPOAKERISMMZEJ-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2cccc(F)c2)o1 ZINC000548934666 1083847833 /nfs/dbraw/zinc/84/78/33/1083847833.db2.gz NPOAKERISMMZEJ-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2ccc(F)cc2)n1 ZINC000548933898 1083852783 /nfs/dbraw/zinc/85/27/83/1083852783.db2.gz KQOJODJALSWOLR-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2ccc(F)cc2)n1 ZINC000548933898 1083852793 /nfs/dbraw/zinc/85/27/93/1083852793.db2.gz KQOJODJALSWOLR-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000548935840 1083859536 /nfs/dbraw/zinc/85/95/36/1083859536.db2.gz ZRKIGOMQZXAUSO-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2ccc(F)cc2)o1 ZINC000548935840 1083859549 /nfs/dbraw/zinc/85/95/49/1083859549.db2.gz ZRKIGOMQZXAUSO-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO CC(=O)c1ccc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000065202239 1083860478 /nfs/dbraw/zinc/86/04/78/1083860478.db2.gz KUYSPPCPVYOEKS-GOSISDBHSA-N 1 1 367.449 4.122 20 5 FIBDMO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000612530799 1083895285 /nfs/dbraw/zinc/89/52/85/1083895285.db2.gz DQIAQXVIVHOCBS-GFCCVEGCSA-N 1 1 372.812 4.192 20 5 FIBDMO C[C@H](c1cccs1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000472440976 1083911285 /nfs/dbraw/zinc/91/12/85/1083911285.db2.gz SVKWOJKJJXQFDN-OAHLLOKOSA-N 1 1 356.451 4.116 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(C)c1OC ZINC000796838404 1084070498 /nfs/dbraw/zinc/07/04/98/1084070498.db2.gz INJFYJATFFAWPQ-LBPRGKRZSA-N 1 1 364.829 4.425 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@H](COC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000539088875 1084313746 /nfs/dbraw/zinc/31/37/46/1084313746.db2.gz BTSLLDJGVSLLBD-SUMWQHHRSA-N 1 1 362.401 4.171 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2ccc(F)cc2)no1 ZINC000511063113 1084555403 /nfs/dbraw/zinc/55/54/03/1084555403.db2.gz GOWSYHLWAGOJQW-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000051429035 1084608356 /nfs/dbraw/zinc/60/83/56/1084608356.db2.gz FCWIPWMFCKEYOW-MRXNPFEDSA-N 1 1 369.446 4.420 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1nc2ccccc2s1 ZINC000051429035 1084608367 /nfs/dbraw/zinc/60/83/67/1084608367.db2.gz FCWIPWMFCKEYOW-MRXNPFEDSA-N 1 1 369.446 4.420 20 5 FIBDMO Cc1ccc(-c2nnc([C@@H](C)[N@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511073809 1084614130 /nfs/dbraw/zinc/61/41/30/1084614130.db2.gz MPNPUCDZTXOART-OAHLLOKOSA-N 1 1 366.421 4.189 20 5 FIBDMO Cc1ccc(-c2nnc([C@@H](C)[N@@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511073809 1084614140 /nfs/dbraw/zinc/61/41/40/1084614140.db2.gz MPNPUCDZTXOART-OAHLLOKOSA-N 1 1 366.421 4.189 20 5 FIBDMO CCc1ccc([C@H](NCC[C@@H]2CCC[N@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000414178948 1084744883 /nfs/dbraw/zinc/74/48/83/1084744883.db2.gz KNJKWGUZCHQFIS-HRAATJIYSA-N 1 1 371.481 4.161 20 5 FIBDMO CCc1ccc([C@H](NCC[C@@H]2CCC[N@@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000414178948 1084744890 /nfs/dbraw/zinc/74/48/90/1084744890.db2.gz KNJKWGUZCHQFIS-HRAATJIYSA-N 1 1 371.481 4.161 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000479096583 1085088256 /nfs/dbraw/zinc/08/82/56/1085088256.db2.gz GQAMPMJHZIQBOP-KSSFIOAISA-N 1 1 364.405 4.023 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCc2ccccc2C1 ZINC000106888031 1085238331 /nfs/dbraw/zinc/23/83/31/1085238331.db2.gz APWOBTTXECHSBE-CQSZACIVSA-N 1 1 364.405 4.154 20 5 FIBDMO CCC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000480080338 1085412481 /nfs/dbraw/zinc/41/24/81/1085412481.db2.gz FWOPIMWLZYSZQU-YLJYHZDGSA-N 1 1 353.422 4.045 20 5 FIBDMO CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000472245323 1085442402 /nfs/dbraw/zinc/44/24/02/1085442402.db2.gz XBYZAUNCOGDRER-HXUWFJFHSA-N 1 1 368.412 4.042 20 5 FIBDMO C[C@@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1nccs1 ZINC000549545464 1085529326 /nfs/dbraw/zinc/52/93/26/1085529326.db2.gz VDRPMKKEGUVDHP-JTQLQIEISA-N 1 1 359.373 4.306 20 5 FIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C(F)F)C2)cc1OC ZINC000611668747 1085544161 /nfs/dbraw/zinc/54/41/61/1085544161.db2.gz TXIFBMMHDLJAOL-OLZOCXBDSA-N 1 1 372.412 4.115 20 5 FIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C(F)F)C2)cc1OC ZINC000611668747 1085544172 /nfs/dbraw/zinc/54/41/72/1085544172.db2.gz TXIFBMMHDLJAOL-OLZOCXBDSA-N 1 1 372.412 4.115 20 5 FIBDMO Cc1ccccc1C[NH+]1CCC(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000178646485 1085550550 /nfs/dbraw/zinc/55/05/50/1085550550.db2.gz OPMMWCLIOKUKBN-KRWDZBQOSA-N 1 1 353.466 4.218 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000178658549 1085684294 /nfs/dbraw/zinc/68/42/94/1085684294.db2.gz MDOYKFVAZBFHOF-QOKNQOGYSA-N 1 1 359.495 4.390 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000178658549 1085684302 /nfs/dbraw/zinc/68/43/02/1085684302.db2.gz MDOYKFVAZBFHOF-QOKNQOGYSA-N 1 1 359.495 4.390 20 5 FIBDMO COc1ccc(C[N@H+](Cc2ccccc2)CC2CCOCC2)cc1[N+](=O)[O-] ZINC000111261479 1085733266 /nfs/dbraw/zinc/73/32/66/1085733266.db2.gz QQKUZOQMBXSLGT-UHFFFAOYSA-N 1 1 370.449 4.032 20 5 FIBDMO COc1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000432241806 1085939942 /nfs/dbraw/zinc/93/99/42/1085939942.db2.gz SIOLUHZXVHYISX-UHFFFAOYSA-N 1 1 359.184 4.339 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(SC)c(F)c1 ZINC000178729127 1085966520 /nfs/dbraw/zinc/96/65/20/1085966520.db2.gz ZUQVAQNBUMFSOT-NSHDSACASA-N 1 1 350.415 4.315 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccc(Cl)cc2)C2CC2)c2c(c1)COCO2 ZINC000052075779 1086121076 /nfs/dbraw/zinc/12/10/76/1086121076.db2.gz MFWVFVLMFZFYJW-UHFFFAOYSA-N 1 1 374.824 4.279 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccc(Cl)cc2)C2CC2)c2c(c1)COCO2 ZINC000052075779 1086121085 /nfs/dbraw/zinc/12/10/85/1086121085.db2.gz MFWVFVLMFZFYJW-UHFFFAOYSA-N 1 1 374.824 4.279 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1cc2ccccc2o1 ZINC000472280054 1086207789 /nfs/dbraw/zinc/20/77/89/1086207789.db2.gz RHSZRPRYAZEGNJ-UHFFFAOYSA-N 1 1 367.405 4.110 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C(C)(C)c1ccccc1 ZINC000585754310 1086687076 /nfs/dbraw/zinc/68/70/76/1086687076.db2.gz HEGGNTYBDDOHBM-UHFFFAOYSA-N 1 1 355.438 4.099 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765560 1086692937 /nfs/dbraw/zinc/69/29/37/1086692937.db2.gz RNNWBZBGSAJIKR-APWZRJJASA-N 1 1 364.449 4.015 20 5 FIBDMO COc1cccc(C[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C[C@H]2CCCO2)c1 ZINC000512065917 1086727115 /nfs/dbraw/zinc/72/71/15/1086727115.db2.gz BKJZDPZJPHEHIN-HXUWFJFHSA-N 1 1 370.449 4.093 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000052795436 1087162328 /nfs/dbraw/zinc/16/23/28/1087162328.db2.gz MUMBWEGVIBGJGV-INIZCTEOSA-N 1 1 367.449 4.142 20 5 FIBDMO Cc1cc(NC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000248587433 1087241185 /nfs/dbraw/zinc/24/11/85/1087241185.db2.gz WSWKRKZSMXPPMO-SJORKVTESA-N 1 1 374.485 4.022 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CC[C@H](CC(F)(F)F)C3)co2)cc1 ZINC000278699777 1087242182 /nfs/dbraw/zinc/24/21/82/1087242182.db2.gz JMSCDYCNUJKKHT-LLVKDONJSA-N 1 1 355.316 4.024 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H](CC(F)(F)F)C3)co2)cc1 ZINC000278699777 1087242189 /nfs/dbraw/zinc/24/21/89/1087242189.db2.gz JMSCDYCNUJKKHT-LLVKDONJSA-N 1 1 355.316 4.024 20 5 FIBDMO COC[C@@H]1CC[N@H+]1Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000573214522 1087325243 /nfs/dbraw/zinc/32/52/43/1087325243.db2.gz XOZLJQLCYKRURO-HNNXBMFYSA-N 1 1 362.813 4.261 20 5 FIBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC000409853114 1087610669 /nfs/dbraw/zinc/61/06/69/1087610669.db2.gz CCEUNBOIODSYIO-UHFFFAOYSA-N 1 1 363.417 4.209 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)o1 ZINC000611983744 1087674441 /nfs/dbraw/zinc/67/44/41/1087674441.db2.gz FOTAFVWVKODIJV-QGZVFWFLSA-N 1 1 363.417 4.314 20 5 FIBDMO C[C@H](c1nc2ccccc2o1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000181125593 1088254647 /nfs/dbraw/zinc/25/46/47/1088254647.db2.gz VXZPXWYGXIYWJV-CQSZACIVSA-N 1 1 367.405 4.340 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(=O)c2ccc(F)cc2)CC1 ZINC000434679495 1088929444 /nfs/dbraw/zinc/92/94/44/1088929444.db2.gz PJKDZNYBQJMBGY-CQSZACIVSA-N 1 1 356.397 4.390 20 5 FIBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000549182788 1089149680 /nfs/dbraw/zinc/14/96/80/1089149680.db2.gz IHRONPSDACSAKL-UHFFFAOYSA-N 1 1 359.389 4.249 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2cccc(F)c2)n[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC000511525355 1089436002 /nfs/dbraw/zinc/43/60/02/1089436002.db2.gz WDXIDABMTRZWBU-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO CCC[NH+]1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000236795319 1089772120 /nfs/dbraw/zinc/77/21/20/1089772120.db2.gz URNHJMOKGWUKRL-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO CCCN1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000236795319 1089772132 /nfs/dbraw/zinc/77/21/32/1089772132.db2.gz URNHJMOKGWUKRL-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO CCCOc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000584437529 1090197987 /nfs/dbraw/zinc/19/79/87/1090197987.db2.gz MGMXIFRGXHGLEH-UHFFFAOYSA-N 1 1 358.438 4.067 20 5 FIBDMO CN(C)Cc1cc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)ccc1F ZINC000417310994 1090805483 /nfs/dbraw/zinc/80/54/83/1090805483.db2.gz LHBBKMBGQBYAKZ-OAQYLSRUSA-N 1 1 371.456 4.353 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572149 1090970158 /nfs/dbraw/zinc/97/01/58/1090970158.db2.gz ZIWWHNYUWCDCKP-ICSRJNTNSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572149 1090970159 /nfs/dbraw/zinc/97/01/59/1090970159.db2.gz ZIWWHNYUWCDCKP-ICSRJNTNSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572149 1090970162 /nfs/dbraw/zinc/97/01/62/1090970162.db2.gz ZIWWHNYUWCDCKP-ICSRJNTNSA-N 1 1 367.493 4.466 20 5 FIBDMO CC(C)(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000500100802 1091038169 /nfs/dbraw/zinc/03/81/69/1091038169.db2.gz ZXOBUIWIVCKTGT-UHFFFAOYSA-N 1 1 355.438 4.224 20 5 FIBDMO COc1cccc(C2(F)CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)c1 ZINC000500161614 1091074193 /nfs/dbraw/zinc/07/41/93/1091074193.db2.gz FNOVCHKUOPZJQQ-UHFFFAOYSA-N 1 1 362.376 4.203 20 5 FIBDMO CCC1(CC)[C@@H](OC)C[C@@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001167766313 1091600546 /nfs/dbraw/zinc/60/05/46/1091600546.db2.gz KHLSKZFDWZAHKU-OALUTQOASA-N 1 1 364.486 4.408 20 5 FIBDMO COC(=O)c1ccc(Cl)c(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000182119424 1091816052 /nfs/dbraw/zinc/81/60/52/1091816052.db2.gz YFSRDTBLFVMMCO-LBPRGKRZSA-N 1 1 362.813 4.194 20 5 FIBDMO CC[N@H+](Cc1ccc(C)cc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899844 1091819528 /nfs/dbraw/zinc/81/95/28/1091819528.db2.gz TWSUEYQXXNBEIK-UHFFFAOYSA-N 1 1 350.422 4.246 20 5 FIBDMO CC[C@@H]1CCCC[N@H+]1CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000236916389 1092026363 /nfs/dbraw/zinc/02/63/63/1092026363.db2.gz UCZOBVXUPOTZBJ-QGZVFWFLSA-N 1 1 374.510 4.072 20 5 FIBDMO Cc1c(CN(Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000432676149 1092071008 /nfs/dbraw/zinc/07/10/08/1092071008.db2.gz NJAULTFBLSDPNT-LJQANCHMSA-N 1 1 371.506 4.109 20 5 FIBDMO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000520879819 1092324247 /nfs/dbraw/zinc/32/42/47/1092324247.db2.gz TYUUECRFABXOQN-RBZFPXEDSA-N 1 1 350.374 4.467 20 5 FIBDMO CCOc1ccc([C@@H]2CCC[N@@H+]2Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015372247 1092455390 /nfs/dbraw/zinc/45/53/90/1092455390.db2.gz RETOSWQNIWOGQQ-IBGZPJMESA-N 1 1 356.422 4.339 20 5 FIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015372247 1092455394 /nfs/dbraw/zinc/45/53/94/1092455394.db2.gz RETOSWQNIWOGQQ-IBGZPJMESA-N 1 1 356.422 4.339 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1 ZINC000521276164 1092616356 /nfs/dbraw/zinc/61/63/56/1092616356.db2.gz WNEYQNWHCYFENU-HNNXBMFYSA-N 1 1 358.360 4.028 20 5 FIBDMO CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236931544 1092811786 /nfs/dbraw/zinc/81/17/86/1092811786.db2.gz NABDOKDIZXKVBC-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CC[N@@H+]1CCC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236931544 1092811796 /nfs/dbraw/zinc/81/17/96/1092811796.db2.gz NABDOKDIZXKVBC-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CC[N@H+]1CCC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236931544 1092811801 /nfs/dbraw/zinc/81/18/01/1092811801.db2.gz NABDOKDIZXKVBC-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CCN1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236931544 1092811814 /nfs/dbraw/zinc/81/18/14/1092811814.db2.gz NABDOKDIZXKVBC-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000443075203 1092934819 /nfs/dbraw/zinc/93/48/19/1092934819.db2.gz ZEEULPWEPKMUPR-QFBILLFUSA-N 1 1 369.465 4.362 20 5 FIBDMO C[N@@H+](CCc1ccccc1O)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000573672742 1092957816 /nfs/dbraw/zinc/95/78/16/1092957816.db2.gz PXKMVPBLDURYIV-UHFFFAOYSA-N 1 1 352.390 4.235 20 5 FIBDMO C[C@@]1(c2cccc(F)c2)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000593044776 1093166881 /nfs/dbraw/zinc/16/68/81/1093166881.db2.gz BPOVRWPPVIWOGZ-LJQANCHMSA-N 1 1 355.369 4.039 20 5 FIBDMO C[C@@]1(c2cccc(F)c2)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000593044776 1093166887 /nfs/dbraw/zinc/16/68/87/1093166887.db2.gz BPOVRWPPVIWOGZ-LJQANCHMSA-N 1 1 355.369 4.039 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](c4ccccc4)C3)n2)cc1 ZINC000433079029 1093206046 /nfs/dbraw/zinc/20/60/46/1093206046.db2.gz XQQQKWFMNSSQST-KRWDZBQOSA-N 1 1 364.405 4.024 20 5 FIBDMO C[C@@H](c1nc2ccccc2s1)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000051878264 1093309948 /nfs/dbraw/zinc/30/99/48/1093309948.db2.gz OIPTYQWXAGCZQY-ZDUSSCGKSA-N 1 1 357.435 4.276 20 5 FIBDMO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000051878264 1093309953 /nfs/dbraw/zinc/30/99/53/1093309953.db2.gz OIPTYQWXAGCZQY-ZDUSSCGKSA-N 1 1 357.435 4.276 20 5 FIBDMO CCCOc1ncccc1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144329 1093321219 /nfs/dbraw/zinc/32/12/19/1093321219.db2.gz LXGGCBNEOITGLL-GOSISDBHSA-N 1 1 355.438 4.291 20 5 FIBDMO C[C@H]([NH2+]Cc1cccc(F)c1Br)c1cccc([N+](=O)[O-])c1 ZINC000382766447 1093888506 /nfs/dbraw/zinc/88/85/06/1093888506.db2.gz TTWUHTUKKGBQOF-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO CC[C@H]([NH2+]Cc1cccnc1OCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000151120235 1093907586 /nfs/dbraw/zinc/90/75/86/1093907586.db2.gz GXWMEGHJDKANPN-HNNXBMFYSA-N 1 1 369.343 4.172 20 5 FIBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000151133669 1093916125 /nfs/dbraw/zinc/91/61/25/1093916125.db2.gz JLJILTPNABKQCR-OAHLLOKOSA-N 1 1 366.421 4.016 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000513242606 1094033257 /nfs/dbraw/zinc/03/32/57/1094033257.db2.gz VBFNSVOJMDSKPQ-KBXCAEBGSA-N 1 1 364.405 4.228 20 5 FIBDMO O=[N+]([O-])c1cccc(N2CCN(c3cc[nH+]c4ccc(Cl)cc43)CC2)c1 ZINC000513623779 1094242990 /nfs/dbraw/zinc/24/29/90/1094242990.db2.gz GWHZJRPUCHNPPS-UHFFFAOYSA-N 1 1 368.824 4.123 20 5 FIBDMO O=[N+]([O-])c1ccc(NCCC[N@H+]2CCc3ccccc3C2)c2ccncc21 ZINC000025497576 1094312023 /nfs/dbraw/zinc/31/20/23/1094312023.db2.gz OAAVEOWBPWKLGX-UHFFFAOYSA-N 1 1 362.433 4.003 20 5 FIBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCc2sccc2C1 ZINC000025500275 1094326696 /nfs/dbraw/zinc/32/66/96/1094326696.db2.gz ODMIYKOQASMKFE-ZDUSSCGKSA-N 1 1 368.462 4.063 20 5 FIBDMO CC(C)[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1ccsc1 ZINC000420997624 1095234793 /nfs/dbraw/zinc/23/47/93/1095234793.db2.gz ADKBITHCCUSMOM-CYBMUJFWSA-N 1 1 362.451 4.494 20 5 FIBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1ccsc1 ZINC000420997624 1095234803 /nfs/dbraw/zinc/23/48/03/1095234803.db2.gz ADKBITHCCUSMOM-CYBMUJFWSA-N 1 1 362.451 4.494 20 5 FIBDMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000522849845 1095781787 /nfs/dbraw/zinc/78/17/87/1095781787.db2.gz ZTWPCHDYUDWWBM-CQSZACIVSA-N 1 1 368.865 4.024 20 5 FIBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2OC)cc1[N+](=O)[O-] ZINC000421826277 1095938652 /nfs/dbraw/zinc/93/86/52/1095938652.db2.gz RSBRHGLRWUCIJD-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CC(=O)N(C)[C@H](C)c1ccccc1 ZINC000503253184 1096331054 /nfs/dbraw/zinc/33/10/54/1096331054.db2.gz ATUCNWUGZZNZON-IAGOWNOFSA-N 1 1 369.465 4.116 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CC(=O)N(C)[C@H](C)c1ccccc1 ZINC000503253184 1096331062 /nfs/dbraw/zinc/33/10/62/1096331062.db2.gz ATUCNWUGZZNZON-IAGOWNOFSA-N 1 1 369.465 4.116 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000532976521 1098647167 /nfs/dbraw/zinc/64/71/67/1098647167.db2.gz GAYLWZYJZRTUMR-GOSISDBHSA-N 1 1 371.437 4.442 20 5 FIBDMO Cc1ccccc1[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000533242223 1098899094 /nfs/dbraw/zinc/89/90/94/1098899094.db2.gz DXXVKLSEQHPICC-HXUWFJFHSA-N 1 1 367.449 4.377 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC4(CCCCC4)C3)n2)cc1 ZINC000533440792 1099065770 /nfs/dbraw/zinc/06/57/70/1099065770.db2.gz OEGAQUYKJYBLQT-UHFFFAOYSA-N 1 1 356.426 4.191 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000533511772 1099118330 /nfs/dbraw/zinc/11/83/30/1099118330.db2.gz IGLFWSQGHOYVPZ-VBQJREDUSA-N 1 1 351.878 4.085 20 5 FIBDMO CCn1cc(C[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C(C)C)cn1 ZINC000593080322 1099407378 /nfs/dbraw/zinc/40/73/78/1099407378.db2.gz MFQCUNUQTJUNBE-UHFFFAOYSA-N 1 1 370.375 4.241 20 5 FIBDMO CCn1cc(C[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C(C)C)cn1 ZINC000593080322 1099407380 /nfs/dbraw/zinc/40/73/80/1099407380.db2.gz MFQCUNUQTJUNBE-UHFFFAOYSA-N 1 1 370.375 4.241 20 5 FIBDMO C[C@H](N[C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516926246 1099936372 /nfs/dbraw/zinc/93/63/72/1099936372.db2.gz HJNOEFSJHGLYNP-PXNSSMCTSA-N 1 1 365.477 4.443 20 5 FIBDMO C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516926246 1099936376 /nfs/dbraw/zinc/93/63/76/1099936376.db2.gz HJNOEFSJHGLYNP-PXNSSMCTSA-N 1 1 365.477 4.443 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000506098437 1100091690 /nfs/dbraw/zinc/09/16/90/1100091690.db2.gz CYNGKMDUASFBHE-VDNIUXDYSA-N 1 1 366.417 4.216 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c1 ZINC000536695332 1100195934 /nfs/dbraw/zinc/19/59/34/1100195934.db2.gz AQKPVKTUSOLARW-DZGCQCFKSA-N 1 1 358.410 4.056 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)c1 ZINC000536695332 1100195947 /nfs/dbraw/zinc/19/59/47/1100195947.db2.gz AQKPVKTUSOLARW-DZGCQCFKSA-N 1 1 358.410 4.056 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c1 ZINC000536695335 1100196066 /nfs/dbraw/zinc/19/60/66/1100196066.db2.gz AQKPVKTUSOLARW-ZFWWWQNUSA-N 1 1 358.410 4.056 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)c1 ZINC000536695335 1100196069 /nfs/dbraw/zinc/19/60/69/1100196069.db2.gz AQKPVKTUSOLARW-ZFWWWQNUSA-N 1 1 358.410 4.056 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000459653837 1100395505 /nfs/dbraw/zinc/39/55/05/1100395505.db2.gz DMSAQAWKKGDCQQ-CZUORRHYSA-N 1 1 372.387 4.337 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@@H+]1CCC[C@H](C)C1 ZINC000518264561 1101049249 /nfs/dbraw/zinc/04/92/49/1101049249.db2.gz GRKWSQDBESDYOK-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@H+]1CCC[C@H](C)C1 ZINC000518264561 1101049257 /nfs/dbraw/zinc/04/92/57/1101049257.db2.gz GRKWSQDBESDYOK-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H]1CCC[C@H]1c1ccccc1 ZINC000459673170 1101312713 /nfs/dbraw/zinc/31/27/13/1101312713.db2.gz IYPHICAPMVVODH-ROUUACIJSA-N 1 1 367.449 4.110 20 5 FIBDMO CC[N@@H+]1CCC[C@H]1CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000518771277 1101533021 /nfs/dbraw/zinc/53/30/21/1101533021.db2.gz RQBDSKYZBLMPDW-KRWDZBQOSA-N 1 1 373.428 4.100 20 5 FIBDMO CC[N@H+]1CCC[C@H]1CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000518771277 1101533028 /nfs/dbraw/zinc/53/30/28/1101533028.db2.gz RQBDSKYZBLMPDW-KRWDZBQOSA-N 1 1 373.428 4.100 20 5 FIBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000537647006 1102640115 /nfs/dbraw/zinc/64/01/15/1102640115.db2.gz FWNZGJKNGCABNZ-QGZVFWFLSA-N 1 1 369.465 4.019 20 5 FIBDMO COc1cc(C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)c([N+](=O)[O-])cc1F ZINC000184302247 1102805288 /nfs/dbraw/zinc/80/52/88/1102805288.db2.gz IYLZGTANMGGRNH-SNVBAGLBSA-N 1 1 370.327 4.195 20 5 FIBDMO CC[C@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000184308784 1102838459 /nfs/dbraw/zinc/83/84/59/1102838459.db2.gz GMWNCOGZZQZVCM-HNNXBMFYSA-N 1 1 354.328 4.262 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000507143330 1103144149 /nfs/dbraw/zinc/14/41/49/1103144149.db2.gz LJFTYAHXOMCIPF-QGZVFWFLSA-N 1 1 356.422 4.258 20 5 FIBDMO Cc1ccccc1[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000507166439 1103167145 /nfs/dbraw/zinc/16/71/45/1103167145.db2.gz WRHXDNYMBFVNAB-IRXDYDNUSA-N 1 1 367.449 4.028 20 5 FIBDMO C[C@H]1CC[N@@H+]([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)C1 ZINC000507185392 1103184868 /nfs/dbraw/zinc/18/48/68/1103184868.db2.gz XICZRFJIDJZYGS-SCLBCKFNSA-N 1 1 373.840 4.270 20 5 FIBDMO C[C@H]1CC[N@H+]([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)C1 ZINC000507185392 1103184876 /nfs/dbraw/zinc/18/48/76/1103184876.db2.gz XICZRFJIDJZYGS-SCLBCKFNSA-N 1 1 373.840 4.270 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(OCC(F)F)cc1)C1CC1 ZINC000507173388 1103193286 /nfs/dbraw/zinc/19/32/86/1103193286.db2.gz MDGCKKSXEVBGLE-UHFFFAOYSA-N 1 1 362.376 4.403 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(OCC(F)F)cc1)C1CC1 ZINC000507173388 1103193288 /nfs/dbraw/zinc/19/32/88/1103193288.db2.gz MDGCKKSXEVBGLE-UHFFFAOYSA-N 1 1 362.376 4.403 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2c2cc(C)ccc2C)c1 ZINC001168134160 1107430880 /nfs/dbraw/zinc/43/08/80/1107430880.db2.gz JFQYYLXVCFXILN-HXUWFJFHSA-N 1 1 368.433 4.335 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](CC(C)(C)C)C1 ZINC000452078969 1107460549 /nfs/dbraw/zinc/46/05/49/1107460549.db2.gz MPQJEPUSCJAMJK-ZIAGYGMSSA-N 1 1 358.442 4.464 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000186669577 1107879320 /nfs/dbraw/zinc/87/93/20/1107879320.db2.gz ATLFVMCUAXGVKG-NRFANRHFSA-N 1 1 368.433 4.013 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000186669577 1107879340 /nfs/dbraw/zinc/87/93/40/1107879340.db2.gz ATLFVMCUAXGVKG-NRFANRHFSA-N 1 1 368.433 4.013 20 5 FIBDMO Cc1ccc([C@H](CNCc2ccc(C)c([N+](=O)[O-])c2)[NH+]2CCCC2)cc1 ZINC000520221788 1108071389 /nfs/dbraw/zinc/07/13/89/1108071389.db2.gz ZQNWEXQNBJICDX-NRFANRHFSA-N 1 1 353.466 4.138 20 5 FIBDMO CCc1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453342840 1108441601 /nfs/dbraw/zinc/44/16/01/1108441601.db2.gz HYQRNWADCIEMMC-NZZOTNDHSA-N 1 1 369.465 4.054 20 5 FIBDMO Cc1cc(C[C@@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)n[nH]1 ZINC000532015740 1108550539 /nfs/dbraw/zinc/55/05/39/1108550539.db2.gz WBLRZCXDGYLNHQ-GFCCVEGCSA-N 1 1 356.451 4.076 20 5 FIBDMO O=[N+]([O-])c1cc(CN2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)cs1 ZINC000532243785 1108734591 /nfs/dbraw/zinc/73/45/91/1108734591.db2.gz GOVVADQDHADGBF-RTBURBONSA-N 1 1 371.506 4.143 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1)CC2 ZINC000532292769 1108745581 /nfs/dbraw/zinc/74/55/81/1108745581.db2.gz NPXKIADUGSNYPF-UHFFFAOYSA-N 1 1 366.339 4.094 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1ccc(OCC(F)(F)F)cc1)CC2 ZINC000532292769 1108745592 /nfs/dbraw/zinc/74/55/92/1108745592.db2.gz NPXKIADUGSNYPF-UHFFFAOYSA-N 1 1 366.339 4.094 20 5 FIBDMO COCC[N@H+](Cc1ccco1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000508532786 1108836147 /nfs/dbraw/zinc/83/61/47/1108836147.db2.gz VHVBULHWMZZNOF-UHFFFAOYSA-N 1 1 356.378 4.096 20 5 FIBDMO COCC[N@@H+](Cc1ccco1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000508532786 1108836149 /nfs/dbraw/zinc/83/61/49/1108836149.db2.gz VHVBULHWMZZNOF-UHFFFAOYSA-N 1 1 356.378 4.096 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCCC4(CCCC4)C3)o2)c1 ZINC000445839750 1109000567 /nfs/dbraw/zinc/00/05/67/1109000567.db2.gz DWCFPNFAPDNEGZ-UHFFFAOYSA-N 1 1 355.438 4.449 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@@H](O)[C@H](C)C3)cc2[N+](=O)[O-])cc1 ZINC000428449201 1109292230 /nfs/dbraw/zinc/29/22/30/1109292230.db2.gz SIIPYNXDKUZYHA-DNVCBOLYSA-N 1 1 372.490 4.257 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@H+]3CC[C@@H](O)[C@H](C)C3)cc2[N+](=O)[O-])cc1 ZINC000428449201 1109292236 /nfs/dbraw/zinc/29/22/36/1109292236.db2.gz SIIPYNXDKUZYHA-DNVCBOLYSA-N 1 1 372.490 4.257 20 5 FIBDMO CC[C@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000428481141 1109534100 /nfs/dbraw/zinc/53/41/00/1109534100.db2.gz DPQQVPMRNRVARE-IBGZPJMESA-N 1 1 360.479 4.308 20 5 FIBDMO COc1cc(C)ccc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000449287736 1110015972 /nfs/dbraw/zinc/01/59/72/1110015972.db2.gz LGNRDTNGHNHNRF-UHFFFAOYSA-N 1 1 354.328 4.220 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3C[C@@H](C4CC4)[C@@H]3C3CC3)cs2)c1 ZINC000449536464 1110103502 /nfs/dbraw/zinc/10/35/02/1110103502.db2.gz IOFDSMRBSCGGIP-ROUUACIJSA-N 1 1 355.463 4.339 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](CCCO)C2)ccc1Oc1ccc(F)cc1 ZINC000449790868 1110172912 /nfs/dbraw/zinc/17/29/12/1110172912.db2.gz MOTSLOFUOLOPSG-OAHLLOKOSA-N 1 1 374.412 4.121 20 5 FIBDMO C[C@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450433746 1110297022 /nfs/dbraw/zinc/29/70/22/1110297022.db2.gz LLHLLSGIKOVXPX-GJZGRUSLSA-N 1 1 354.454 4.208 20 5 FIBDMO COC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Cl ZINC000450679468 1110328644 /nfs/dbraw/zinc/32/86/44/1110328644.db2.gz JPDATINAGCASFG-LBPRGKRZSA-N 1 1 362.813 4.194 20 5 FIBDMO C[C@H](Nc1cccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000538589707 1111212138 /nfs/dbraw/zinc/21/21/38/1111212138.db2.gz RJNFLXBAONKLJB-BBWFWOEESA-N 1 1 369.465 4.377 20 5 FIBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000538752184 1111282149 /nfs/dbraw/zinc/28/21/49/1111282149.db2.gz OMOXXDVATVQJSP-QGZVFWFLSA-N 1 1 369.465 4.019 20 5 FIBDMO CCS[C@@H]1CCC[C@H]([NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552044579 1111555736 /nfs/dbraw/zinc/55/57/36/1111555736.db2.gz GWODRNJHBVCSPG-CGTJXYLNSA-N 1 1 374.510 4.072 20 5 FIBDMO Cn1cc(C[N@H+]2CC(C)(C)[C@@H]3CCC[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000552406905 1111697660 /nfs/dbraw/zinc/69/76/60/1111697660.db2.gz XCRVOCSAUXNJDT-MSOLQXFVSA-N 1 1 354.454 4.006 20 5 FIBDMO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C[C@@H]1CCCCO1 ZINC000553079963 1111904022 /nfs/dbraw/zinc/90/40/22/1111904022.db2.gz MZHKMFUTBAQXMF-SFHVURJKSA-N 1 1 350.459 4.163 20 5 FIBDMO CCC(=O)c1ccc(NC[C@H](c2ccco2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000479846246 1112167790 /nfs/dbraw/zinc/16/77/90/1112167790.db2.gz BMXXOWPUVYKQRR-QGZVFWFLSA-N 1 1 357.410 4.030 20 5 FIBDMO COc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)ccc1OC1CCCC1 ZINC000479896215 1112188771 /nfs/dbraw/zinc/18/87/71/1112188771.db2.gz ZDQZVXIYCXKUAR-UHFFFAOYSA-N 1 1 374.412 4.354 20 5 FIBDMO CCC(=O)c1ccc(NC[C@H](c2ccc(C)o2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000479986624 1112221640 /nfs/dbraw/zinc/22/16/40/1112221640.db2.gz JGQZPBXDDXKZFS-GOSISDBHSA-N 1 1 371.437 4.338 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000554849370 1112528737 /nfs/dbraw/zinc/52/87/37/1112528737.db2.gz YMCBYJICJIXWTL-HNNXBMFYSA-N 1 1 358.360 4.158 20 5 FIBDMO Cc1[nH]c(C2CCN(C(=O)c3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)[nH+]c1C ZINC000899509662 1112861124 /nfs/dbraw/zinc/86/11/24/1112861124.db2.gz OCXXNJWSCZRHOR-UHFFFAOYSA-N 1 1 370.453 4.078 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000486931112 1113679260 /nfs/dbraw/zinc/67/92/60/1113679260.db2.gz FFHPWHHRGJZGJI-UHFFFAOYSA-N 1 1 371.428 4.145 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000044089753 1113940639 /nfs/dbraw/zinc/94/06/39/1113940639.db2.gz QASUQMDZFLASOH-AWEZNQCLSA-N 1 1 367.405 4.281 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000044089753 1113940643 /nfs/dbraw/zinc/94/06/43/1113940643.db2.gz QASUQMDZFLASOH-AWEZNQCLSA-N 1 1 367.405 4.281 20 5 FIBDMO Cc1ccccc1[C@H](C(C)C)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000488693559 1113976981 /nfs/dbraw/zinc/97/69/81/1113976981.db2.gz GKIZJDKMMSDLTJ-NRFANRHFSA-N 1 1 369.465 4.479 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)CC2CCOCC2)c(F)c1 ZINC000491094300 1114372513 /nfs/dbraw/zinc/37/25/13/1114372513.db2.gz XVUBQOMIAUHZKF-UHFFFAOYSA-N 1 1 358.413 4.163 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c(F)c1 ZINC000586766783 1114389311 /nfs/dbraw/zinc/38/93/11/1114389311.db2.gz CVWJHQMHPCUWIA-GFCCVEGCSA-N 1 1 373.359 4.394 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c(F)c1 ZINC000586766783 1114389314 /nfs/dbraw/zinc/38/93/14/1114389314.db2.gz CVWJHQMHPCUWIA-GFCCVEGCSA-N 1 1 373.359 4.394 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)c1 ZINC000590178439 1114907969 /nfs/dbraw/zinc/90/79/69/1114907969.db2.gz TWSORYUTXRMVAT-VIFPVBQESA-N 1 1 356.266 4.388 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1 ZINC000590178439 1114907970 /nfs/dbraw/zinc/90/79/70/1114907970.db2.gz TWSORYUTXRMVAT-VIFPVBQESA-N 1 1 356.266 4.388 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H](c4ccccn4)C3)co2)cc1 ZINC000590600703 1114952333 /nfs/dbraw/zinc/95/23/33/1114952333.db2.gz KUCJINCHPSGRSC-MRXNPFEDSA-N 1 1 364.405 4.024 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC000591282881 1115055094 /nfs/dbraw/zinc/05/50/94/1115055094.db2.gz XBUBHJDBIMGNDA-CQSZACIVSA-N 1 1 357.479 4.088 20 5 FIBDMO Cc1ccc(F)cc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592132685 1115205855 /nfs/dbraw/zinc/20/58/55/1115205855.db2.gz MTZCXSMEGSMCJO-MXVIHJGJSA-N 1 1 372.440 4.348 20 5 FIBDMO Cc1ccc(F)c(C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)c1 ZINC000592132572 1115205931 /nfs/dbraw/zinc/20/59/31/1115205931.db2.gz KHAMKWXXPUGLLO-WGSAOQKQSA-N 1 1 372.440 4.348 20 5 FIBDMO Cc1ccc(F)c(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)c1 ZINC000592132572 1115205934 /nfs/dbraw/zinc/20/59/34/1115205934.db2.gz KHAMKWXXPUGLLO-WGSAOQKQSA-N 1 1 372.440 4.348 20 5 FIBDMO CC[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1[NH3+] ZINC000592427716 1115307144 /nfs/dbraw/zinc/30/71/44/1115307144.db2.gz TUCIYQAQAIGIKG-PXAZEXFGSA-N 1 1 363.845 4.067 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1c(F)cccc1N1CCCC1 ZINC000594505007 1115451836 /nfs/dbraw/zinc/45/18/36/1115451836.db2.gz XWAPCIZESDVFNG-GOSISDBHSA-N 1 1 355.413 4.111 20 5 FIBDMO CC[NH+](CC)Cc1cccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595019472 1115504488 /nfs/dbraw/zinc/50/44/88/1115504488.db2.gz WJJSAXBXYJXQHN-MRXNPFEDSA-N 1 1 371.481 4.296 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccccc1OC(F)F ZINC000595003863 1115507565 /nfs/dbraw/zinc/50/75/65/1115507565.db2.gz MBKWXYDFWARFJM-LLVKDONJSA-N 1 1 352.337 4.056 20 5 FIBDMO COc1cccc(OC)c1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000595074694 1115509196 /nfs/dbraw/zinc/50/91/96/1115509196.db2.gz UCEYBUXYUZSRIR-QGZVFWFLSA-N 1 1 356.422 4.124 20 5 FIBDMO COC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1cccc(Cl)c1 ZINC000595046558 1115511402 /nfs/dbraw/zinc/51/14/02/1115511402.db2.gz AMCQALMTENTDBJ-SJKOYZFVSA-N 1 1 364.829 4.295 20 5 FIBDMO COC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccc(Cl)cc1 ZINC000595050865 1115512640 /nfs/dbraw/zinc/51/26/40/1115512640.db2.gz UUAKKPMWNKWLSH-SJKOYZFVSA-N 1 1 364.829 4.295 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC=C(c2cn(C(C)C)nn2)CC1 ZINC000595528436 1115540757 /nfs/dbraw/zinc/54/07/57/1115540757.db2.gz YCGJLFAJFIJGLA-INIZCTEOSA-N 1 1 369.469 4.316 20 5 FIBDMO Cc1noc(C[NH2+][C@](C)(Cc2ccccc2)c2ccccc2)c1[N+](=O)[O-] ZINC000595543929 1115541945 /nfs/dbraw/zinc/54/19/45/1115541945.db2.gz SHWKTRXKZBUASI-HXUWFJFHSA-N 1 1 351.406 4.139 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(c2ccco2)CC1 ZINC000595615945 1115554437 /nfs/dbraw/zinc/55/44/37/1115554437.db2.gz ODIOEEWPHZIIFN-ZDUSSCGKSA-N 1 1 368.393 4.178 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000593113548 1115558765 /nfs/dbraw/zinc/55/87/65/1115558765.db2.gz OTDHRNNBKRAEAH-UHFFFAOYSA-N 1 1 366.339 4.401 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC([C@H]3CCCCO3)CC2)c1 ZINC000595783403 1115563212 /nfs/dbraw/zinc/56/32/12/1115563212.db2.gz NZGDNGNCYHYBCA-QGZVFWFLSA-N 1 1 372.387 4.395 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H]([C@H]4CCCCO4)C3)co2)cc1 ZINC000595787450 1115563482 /nfs/dbraw/zinc/56/34/82/1115563482.db2.gz IXLWUKGFTZCFHL-VQIMIIECSA-N 1 1 371.437 4.031 20 5 FIBDMO CC[N@@H+](Cc1onc(C)c1[N+](=O)[O-])[C@@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000595867572 1115566839 /nfs/dbraw/zinc/56/68/39/1115566839.db2.gz OVANWPOWALWPDI-NSHDSACASA-N 1 1 371.359 4.363 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccccc3-n3ccnc32)cc1[N+](=O)[O-] ZINC000596095892 1115572132 /nfs/dbraw/zinc/57/21/32/1115572132.db2.gz QVXJSSCTMDVPNZ-CRAIPNDOSA-N 1 1 362.433 4.427 20 5 FIBDMO Cc1c([C@@H](C)[NH2+][C@@H]2CCc3ccccc3-n3ccnc32)cccc1[N+](=O)[O-] ZINC000596095273 1115574572 /nfs/dbraw/zinc/57/45/72/1115574572.db2.gz OOSDZSDTZMQNSG-CRAIPNDOSA-N 1 1 362.433 4.427 20 5 FIBDMO CC[C@@](C)([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(F)cc1 ZINC000602927493 1115732959 /nfs/dbraw/zinc/73/29/59/1115732959.db2.gz SUTCTOXLGWSCNB-LJQANCHMSA-N 1 1 370.384 4.199 20 5 FIBDMO COc1ccc(C[NH2+][C@@H]2CCc3ccc(F)c(Cl)c32)cc1[N+](=O)[O-] ZINC000593591475 1115743299 /nfs/dbraw/zinc/74/32/99/1115743299.db2.gz JQEAQILYZPHWME-CYBMUJFWSA-N 1 1 350.777 4.173 20 5 FIBDMO COc1ccc(C[NH2+][C@H]2CCc3ccc(F)c(Cl)c32)cc1[N+](=O)[O-] ZINC000593591476 1115743377 /nfs/dbraw/zinc/74/33/77/1115743377.db2.gz JQEAQILYZPHWME-ZDUSSCGKSA-N 1 1 350.777 4.173 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)c2c(c1)COCO2 ZINC000076805339 1115770880 /nfs/dbraw/zinc/77/08/80/1115770880.db2.gz VURRNJLEMQUZOB-QGZVFWFLSA-N 1 1 358.394 4.172 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCCC[C@@H]2c2ccco2)c2c(c1)COCO2 ZINC000076805339 1115770884 /nfs/dbraw/zinc/77/08/84/1115770884.db2.gz VURRNJLEMQUZOB-QGZVFWFLSA-N 1 1 358.394 4.172 20 5 FIBDMO Cc1cc(CNc2ccc3cnccc3c2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000599084624 1115787960 /nfs/dbraw/zinc/78/79/60/1115787960.db2.gz CXAMJWRYJCUOFU-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO COc1cc(C[N@@H+](CCC(C)C)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000603553716 1115791357 /nfs/dbraw/zinc/79/13/57/1115791357.db2.gz OPMWLMGVXKSIGC-UHFFFAOYSA-N 1 1 358.385 4.215 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2nccn2C)cc1[N+](=O)[O-] ZINC000593718359 1115802107 /nfs/dbraw/zinc/80/21/07/1115802107.db2.gz HLIDLIRFDZIMNU-LPHOPBHVSA-N 1 1 364.449 4.271 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](Cc1ccccc1)c1nccn1C ZINC000593723252 1115805068 /nfs/dbraw/zinc/80/50/68/1115805068.db2.gz UNNBXVPPWVKKOL-OXJNMPFZSA-N 1 1 364.449 4.271 20 5 FIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603838729 1115818454 /nfs/dbraw/zinc/81/84/54/1115818454.db2.gz FFKYTYKGZRDUPX-SFHVURJKSA-N 1 1 356.422 4.209 20 5 FIBDMO CCC1CCC([N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C2CC2)CC1 ZINC000603856385 1115821861 /nfs/dbraw/zinc/82/18/61/1115821861.db2.gz RWOQAFIDMGSNTF-UHFFFAOYSA-N 1 1 360.454 4.395 20 5 FIBDMO COc1cc(C[NH2+]C(C)(C)c2nc3ccccc3s2)ccc1[N+](=O)[O-] ZINC000599534024 1115824017 /nfs/dbraw/zinc/82/40/17/1115824017.db2.gz VPELGYSZVLIVPD-UHFFFAOYSA-N 1 1 357.435 4.238 20 5 FIBDMO COc1ccc([C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C2CC2)cn1 ZINC000599695545 1115836728 /nfs/dbraw/zinc/83/67/28/1115836728.db2.gz DCIATROVQZZEMF-HXUWFJFHSA-N 1 1 371.437 4.027 20 5 FIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000604521218 1115866980 /nfs/dbraw/zinc/86/69/80/1115866980.db2.gz COUNAAVZKVLLTD-RXVVDRJESA-N 1 1 370.449 4.073 20 5 FIBDMO CC[C@H](c1ccccc1)[N@@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000604493284 1115867612 /nfs/dbraw/zinc/86/76/12/1115867612.db2.gz DLNLSUQCWGUUOT-GOSISDBHSA-N 1 1 371.437 4.015 20 5 FIBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000604493285 1115867727 /nfs/dbraw/zinc/86/77/27/1115867727.db2.gz DLNLSUQCWGUUOT-SFHVURJKSA-N 1 1 371.437 4.015 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC[C@@H]1C ZINC000608836319 1116131352 /nfs/dbraw/zinc/13/13/52/1116131352.db2.gz HWCNGVQCFKCFAD-JKSUJKDBSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC[C@@H]1C ZINC000608836319 1116131354 /nfs/dbraw/zinc/13/13/54/1116131354.db2.gz HWCNGVQCFKCFAD-JKSUJKDBSA-N 1 1 357.454 4.207 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)s1 ZINC000608836277 1116131377 /nfs/dbraw/zinc/13/13/77/1116131377.db2.gz ZIUNEYBSRQNFQZ-CABCVRRESA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)s1 ZINC000608836277 1116131378 /nfs/dbraw/zinc/13/13/78/1116131378.db2.gz ZIUNEYBSRQNFQZ-CABCVRRESA-N 1 1 357.479 4.040 20 5 FIBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+](Cc4cccc([N+](=O)[O-])c4)C3)nc2c1 ZINC000534951696 1116255363 /nfs/dbraw/zinc/25/53/63/1116255363.db2.gz HPLBRGIJYSNIBI-MRXNPFEDSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@H+](Cc4cccc([N+](=O)[O-])c4)C3)[nH]c2c1 ZINC000534951696 1116255364 /nfs/dbraw/zinc/25/53/64/1116255364.db2.gz HPLBRGIJYSNIBI-MRXNPFEDSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@@H+](Cc4cccc([N+](=O)[O-])c4)C3)[nH]c2c1 ZINC000534951696 1116255365 /nfs/dbraw/zinc/25/53/65/1116255365.db2.gz HPLBRGIJYSNIBI-MRXNPFEDSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1cnc(NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000463052437 1117941801 /nfs/dbraw/zinc/94/18/01/1117941801.db2.gz HPMPQXVNBISHEP-HNNXBMFYSA-N 1 1 354.454 4.142 20 5 FIBDMO C[C@@H](NC1CC[NH+](CCc2ccc(F)cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000463085359 1118346028 /nfs/dbraw/zinc/34/60/28/1118346028.db2.gz PVVAIMOOCJTYIV-MRXNPFEDSA-N 1 1 371.456 4.092 20 5 FIBDMO C[C@H](NC1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356481 1118388664 /nfs/dbraw/zinc/38/86/64/1118388664.db2.gz OHKBNDGTILCCCR-KURKYZTESA-N 1 1 367.493 4.402 20 5 FIBDMO C[C@H]([NH2+]C1[C@H](C)CN(Cc2ccccc2)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356481 1118388669 /nfs/dbraw/zinc/38/86/69/1118388669.db2.gz OHKBNDGTILCCCR-KURKYZTESA-N 1 1 367.493 4.402 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC001168437553 1118446353 /nfs/dbraw/zinc/44/63/53/1118446353.db2.gz LHJYLJSSVGRTEL-AWEZNQCLSA-N 1 1 373.384 4.412 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000541773207 1118644938 /nfs/dbraw/zinc/64/49/38/1118644938.db2.gz RYLFPSSGZGQSIR-GOSISDBHSA-N 1 1 354.406 4.012 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](CSc3ccccc3)C2)c1 ZINC000464757330 1118682516 /nfs/dbraw/zinc/68/25/16/1118682516.db2.gz MENHWZHVBWCCRJ-MRXNPFEDSA-N 1 1 358.463 4.088 20 5 FIBDMO CC(C)CCOC1CC[NH+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000153047507 1118726590 /nfs/dbraw/zinc/72/65/90/1118726590.db2.gz SIKJBLRKJLCSEA-UHFFFAOYSA-N 1 1 373.453 4.277 20 5 FIBDMO COc1cc(C[NH2+][C@@H]2CCC[C@@H]2F)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000549935810 1118986758 /nfs/dbraw/zinc/98/67/58/1118986758.db2.gz FDQLDAYLNPVENL-DLBZAZTESA-N 1 1 374.412 4.163 20 5 FIBDMO CSc1cc2c(cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-])OCCO2 ZINC000492330516 1119070444 /nfs/dbraw/zinc/07/04/44/1119070444.db2.gz ASVMQMIKRGFYGZ-UHFFFAOYSA-N 1 1 374.462 4.113 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1ccc(Cl)cc1 ZINC000031006291 1119211563 /nfs/dbraw/zinc/21/15/63/1119211563.db2.gz ILDHWLQJCIEPIN-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3ccc4c(n3)CCCC4)o2)c1 ZINC000444012281 1119249369 /nfs/dbraw/zinc/24/93/69/1119249369.db2.gz KVTUSZGYNXXZCH-UHFFFAOYSA-N 1 1 363.417 4.418 20 5 FIBDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1OC ZINC000761506889 1119403067 /nfs/dbraw/zinc/40/30/67/1119403067.db2.gz OQWBXBKVKCVCRV-UHFFFAOYSA-N 1 1 364.829 4.206 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000761512883 1119405704 /nfs/dbraw/zinc/40/57/04/1119405704.db2.gz YWUWQRXCGVMUAN-XYPHTWIQSA-N 1 1 352.862 4.274 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(Br)ccc2F)cc1Cl ZINC000761523774 1119407314 /nfs/dbraw/zinc/40/73/14/1119407314.db2.gz XLCSWDHTCPTPEM-UHFFFAOYSA-N 1 1 373.609 4.440 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)[C@H](CO)C2CC2)cc1Cl ZINC000761535850 1119414588 /nfs/dbraw/zinc/41/45/88/1119414588.db2.gz ZWVISJFEWRZLEN-LJQANCHMSA-N 1 1 360.841 4.021 20 5 FIBDMO O=C(Nc1ccccc1)[C@@H]1CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493630738 1119482610 /nfs/dbraw/zinc/48/26/10/1119482610.db2.gz BYBCRMMRUDEIFX-CQSZACIVSA-N 1 1 373.840 4.099 20 5 FIBDMO O=C(Nc1ccccc1)[C@@H]1CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493630738 1119482612 /nfs/dbraw/zinc/48/26/12/1119482612.db2.gz BYBCRMMRUDEIFX-CQSZACIVSA-N 1 1 373.840 4.099 20 5 FIBDMO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1cccc2[nH]ccc21 ZINC000494060302 1119532536 /nfs/dbraw/zinc/53/25/36/1119532536.db2.gz LWIBPGPHIDSAHL-UHFFFAOYSA-N 1 1 362.389 4.363 20 5 FIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1cccc2[nH]ccc21 ZINC000494060302 1119532541 /nfs/dbraw/zinc/53/25/41/1119532541.db2.gz LWIBPGPHIDSAHL-UHFFFAOYSA-N 1 1 362.389 4.363 20 5 FIBDMO Cc1ccc([C@@H](CNCc2ccc([N+](=O)[O-])cc2Cl)[NH+]2CCCC2)o1 ZINC000542484422 1119881572 /nfs/dbraw/zinc/88/15/72/1119881572.db2.gz ZLLMBMRJIUJATH-QGZVFWFLSA-N 1 1 363.845 4.076 20 5 FIBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)c2C1 ZINC000494518562 1119886409 /nfs/dbraw/zinc/88/64/09/1119886409.db2.gz FGQNPXWUXZIDLE-UHFFFAOYSA-N 1 1 373.840 4.472 20 5 FIBDMO COC[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc(F)c(F)c1 ZINC000193068422 1120348929 /nfs/dbraw/zinc/34/89/29/1120348929.db2.gz PMGUVMGWIGUEIZ-OALUTQOASA-N 1 1 362.376 4.228 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccccc1OC(F)F ZINC000193119994 1120416924 /nfs/dbraw/zinc/41/69/24/1120416924.db2.gz HLAFFGRDOYRTJA-NSHDSACASA-N 1 1 352.337 4.056 20 5 FIBDMO Cc1nn(C[N@H+]2CCC[C@@H]2c2cc(C)ccc2C)c2ncc([N+](=O)[O-])cc12 ZINC000761837453 1120528288 /nfs/dbraw/zinc/52/82/88/1120528288.db2.gz HZTSCBZBZBXQRV-LJQANCHMSA-N 1 1 365.437 4.059 20 5 FIBDMO O=[N+]([O-])c1c(F)cccc1N1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000762556263 1120929981 /nfs/dbraw/zinc/92/99/81/1120929981.db2.gz ACVBPCWRHWZVOE-UHFFFAOYSA-N 1 1 369.440 4.226 20 5 FIBDMO C[C@H](CNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)[NH+](C)C ZINC000609223484 1121010956 /nfs/dbraw/zinc/01/09/56/1121010956.db2.gz XNODTJXMRDSGEM-CYBMUJFWSA-N 1 1 363.845 4.080 20 5 FIBDMO CC(=O)c1cc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000552996718 1121517296 /nfs/dbraw/zinc/51/72/96/1121517296.db2.gz DORXEUKLZFXDOO-HNNXBMFYSA-N 1 1 373.478 4.183 20 5 FIBDMO Cc1c(C[NH2+]Cc2c(F)cccc2OC(F)(F)F)cccc1[N+](=O)[O-] ZINC000556413286 1122877500 /nfs/dbraw/zinc/87/75/00/1122877500.db2.gz VTBMPEQQICICSK-UHFFFAOYSA-N 1 1 358.291 4.231 20 5 FIBDMO CO[C@@H]1CC[NH2+][C@@H](c2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001212240819 1123006245 /nfs/dbraw/zinc/00/62/45/1123006245.db2.gz CRRUKGLOATWNSG-FOIQADDNSA-N 1 1 359.429 4.483 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1c(F)cccc1N1CCCC1 ZINC000556913215 1123222031 /nfs/dbraw/zinc/22/20/31/1123222031.db2.gz RAMKOVFPRAVDAB-OAHLLOKOSA-N 1 1 357.429 4.493 20 5 FIBDMO COCCc1cc[nH+]c(N[C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000556914329 1123223142 /nfs/dbraw/zinc/22/31/42/1123223142.db2.gz ZRQDYBNYWASXAV-WMZOPIPTSA-N 1 1 355.438 4.002 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC2CCC(C)CC2)CC1 ZINC000609386539 1123699181 /nfs/dbraw/zinc/69/91/81/1123699181.db2.gz BMVPVNAMJKTHSA-UHFFFAOYSA-N 1 1 362.470 4.163 20 5 FIBDMO Cc1ccnc(NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-] ZINC000609669704 1123789581 /nfs/dbraw/zinc/78/95/81/1123789581.db2.gz WHJZBKFMPDDSIA-HNNXBMFYSA-N 1 1 354.454 4.142 20 5 FIBDMO COc1ccc(CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC(C)C)cc1OC ZINC000609672636 1123789937 /nfs/dbraw/zinc/78/99/37/1123789937.db2.gz UQTMWWVNQCSCCN-UHFFFAOYSA-N 1 1 372.465 4.313 20 5 FIBDMO COc1ccccc1[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000610004317 1123914853 /nfs/dbraw/zinc/91/48/53/1123914853.db2.gz WEDMIPIDHVPQEE-INIZCTEOSA-N 1 1 370.449 4.380 20 5 FIBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273515510 1124185159 /nfs/dbraw/zinc/18/51/59/1124185159.db2.gz PEBMNOMFBMILEL-HOTGVXAUSA-N 1 1 350.415 4.148 20 5 FIBDMO CC[C@H]([NH2+][C@H](COC)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000091413297 1124385347 /nfs/dbraw/zinc/38/53/47/1124385347.db2.gz RYTLMUAPEIKKCQ-ZWKOTPCHSA-N 1 1 350.365 4.301 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@@H+](CC4CCCC4)C3)o2)cc1 ZINC000462741909 1124462906 /nfs/dbraw/zinc/46/29/06/1124462906.db2.gz VXNGVVVZTCQTCK-GOSISDBHSA-N 1 1 369.465 4.209 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCN(CC4CCCC4)C3)o2)cc1 ZINC000462741909 1124462911 /nfs/dbraw/zinc/46/29/11/1124462911.db2.gz VXNGVVVZTCQTCK-GOSISDBHSA-N 1 1 369.465 4.209 20 5 FIBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1ccccc1 ZINC000428840044 1124511392 /nfs/dbraw/zinc/51/13/92/1124511392.db2.gz LNIMUJOCPKQSJP-OAHLLOKOSA-N 1 1 356.422 4.433 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000542929384 1124889634 /nfs/dbraw/zinc/88/96/34/1124889634.db2.gz XXMRHQDFCSIWCI-DJIMGWMZSA-N 1 1 352.862 4.274 20 5 FIBDMO COc1cccc(C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC(C)C)c1 ZINC000618276739 1125135940 /nfs/dbraw/zinc/13/59/40/1125135940.db2.gz OPOMAQRXSWEXGO-UHFFFAOYSA-N 1 1 368.437 4.138 20 5 FIBDMO CCn1c(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc2cc(F)ccc21 ZINC000181820630 1125143919 /nfs/dbraw/zinc/14/39/19/1125143919.db2.gz XFCSSZBKDJRIHS-ZDUSSCGKSA-N 1 1 356.401 4.263 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3CCCc4occc43)cs2)c1 ZINC000113320811 1125148971 /nfs/dbraw/zinc/14/89/71/1125148971.db2.gz WEFUFZDPAJNZPK-MRXNPFEDSA-N 1 1 355.419 4.479 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)cnc1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000301730345 1125173919 /nfs/dbraw/zinc/17/39/19/1125173919.db2.gz CZMYFTYFHGLSNT-ALOPSCKCSA-N 1 1 372.856 4.251 20 5 FIBDMO C[C@@H]1C[C@H](N(C)c2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301748820 1125189980 /nfs/dbraw/zinc/18/99/80/1125189980.db2.gz SOWMJELOEDTRRJ-RHSMWYFYSA-N 1 1 374.872 4.133 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc(CNc2c(F)cc([N+](=O)[O-])cc2F)cc1F ZINC000301771207 1125256983 /nfs/dbraw/zinc/25/69/83/1125256983.db2.gz FSMJONMZXJIOAT-UHFFFAOYSA-N 1 1 362.311 4.118 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000301776034 1125263762 /nfs/dbraw/zinc/26/37/62/1125263762.db2.gz LHHOMUROKYFGNW-SWLSCSKDSA-N 1 1 369.387 4.067 20 5 FIBDMO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000069222415 568094570 /nfs/dbraw/zinc/09/45/70/568094570.db2.gz ZXNICXRVJOYZNI-JTQLQIEISA-N 1 1 368.220 4.191 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]3[C@@H]3CCCOC3)o2)c1 ZINC000517937065 568340308 /nfs/dbraw/zinc/34/03/08/568340308.db2.gz KZIVHBJKZWUOMY-APWZRJJASA-N 1 1 356.422 4.246 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000569629783 568411157 /nfs/dbraw/zinc/41/11/57/568411157.db2.gz IQQPPOSSOZMKEZ-HOJAQTOUSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000569629783 568411162 /nfs/dbraw/zinc/41/11/62/568411162.db2.gz IQQPPOSSOZMKEZ-HOJAQTOUSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000569629783 568411163 /nfs/dbraw/zinc/41/11/63/568411163.db2.gz IQQPPOSSOZMKEZ-HOJAQTOUSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000569629786 568411173 /nfs/dbraw/zinc/41/11/73/568411173.db2.gz IQQPPOSSOZMKEZ-RLLQIKCJSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000569629786 568411178 /nfs/dbraw/zinc/41/11/78/568411178.db2.gz IQQPPOSSOZMKEZ-RLLQIKCJSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000569629786 568411179 /nfs/dbraw/zinc/41/11/79/568411179.db2.gz IQQPPOSSOZMKEZ-RLLQIKCJSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCCC1 ZINC000570228106 568463725 /nfs/dbraw/zinc/46/37/25/568463725.db2.gz JZZWKYKLLNTIGS-GFCCVEGCSA-N 1 1 360.376 4.129 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000430214056 1079987984 /nfs/dbraw/zinc/98/79/84/1079987984.db2.gz DTLJXZSXXDZBTO-OAHLLOKOSA-N 1 1 354.328 4.387 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(Br)ccc1F ZINC000126944066 1080035332 /nfs/dbraw/zinc/03/53/32/1080035332.db2.gz WLHXTUBGFQEZDB-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000533380291 1080059100 /nfs/dbraw/zinc/05/91/00/1080059100.db2.gz HUDQYWZKFZPFND-AAEUAGOBSA-N 1 1 364.808 4.030 20 5 FIBDMO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000533380291 1080059104 /nfs/dbraw/zinc/05/91/04/1080059104.db2.gz HUDQYWZKFZPFND-AAEUAGOBSA-N 1 1 364.808 4.030 20 5 FIBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC001167233157 1080881847 /nfs/dbraw/zinc/88/18/47/1080881847.db2.gz CTKFIKCVPPVWRB-MRXNPFEDSA-N 1 1 360.841 4.464 20 5 FIBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000177529363 1081226718 /nfs/dbraw/zinc/22/67/18/1081226718.db2.gz LHXMTJKMHJIUJJ-KDOFPFPSSA-N 1 1 364.405 4.023 20 5 FIBDMO Cc1nn(C[NH+]2CCC(OC3CCCCC3)CC2)c2cc([N+](=O)[O-])ccc12 ZINC000121142120 1081517927 /nfs/dbraw/zinc/51/79/27/1081517927.db2.gz ILHPXJQRWQSMGK-UHFFFAOYSA-N 1 1 372.469 4.024 20 5 FIBDMO CC(=O)c1cc(N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000561155158 1082079042 /nfs/dbraw/zinc/07/90/42/1082079042.db2.gz XWEHMOVJMLZWNT-RDTXWAMCSA-N 1 1 353.422 4.045 20 5 FIBDMO Cn1c2ccccc2nc1[C@H]1CCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000510414749 1082533522 /nfs/dbraw/zinc/53/35/22/1082533522.db2.gz RSUSOQWGFPSASQ-AQDCRGGLSA-N 1 1 362.433 4.332 20 5 FIBDMO Cn1c2ccccc2nc1[C@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000510414749 1082533526 /nfs/dbraw/zinc/53/35/26/1082533526.db2.gz RSUSOQWGFPSASQ-AQDCRGGLSA-N 1 1 362.433 4.332 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCN(C(=O)CC2CCCC2)CC1 ZINC000581625831 1082720410 /nfs/dbraw/zinc/72/04/10/1082720410.db2.gz AKAQUFKZDDTHCF-QGZVFWFLSA-N 1 1 373.497 4.079 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN(C(=O)CC2CCCC2)CC1 ZINC000581625831 1082720413 /nfs/dbraw/zinc/72/04/13/1082720413.db2.gz AKAQUFKZDDTHCF-QGZVFWFLSA-N 1 1 373.497 4.079 20 5 FIBDMO COc1ccc(C[N@@H+](C)CC2CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000510449437 1082790247 /nfs/dbraw/zinc/79/02/47/1082790247.db2.gz IZHHGDUPZIJSPZ-UHFFFAOYSA-N 1 1 356.422 4.024 20 5 FIBDMO Cc1ccc([C@H]2CCCC[N@@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC001167482148 1082879950 /nfs/dbraw/zinc/87/99/50/1082879950.db2.gz GDJBIOCLCNJIRJ-GOSISDBHSA-N 1 1 353.422 4.069 20 5 FIBDMO Cc1ccc([C@H]2CCCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC001167482148 1082879953 /nfs/dbraw/zinc/87/99/53/1082879953.db2.gz GDJBIOCLCNJIRJ-GOSISDBHSA-N 1 1 353.422 4.069 20 5 FIBDMO Cc1ccc([C@@H]2CCCC[N@@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC001167482149 1082880236 /nfs/dbraw/zinc/88/02/36/1082880236.db2.gz GDJBIOCLCNJIRJ-SFHVURJKSA-N 1 1 353.422 4.069 20 5 FIBDMO Cc1ccc([C@@H]2CCCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC001167482149 1082880242 /nfs/dbraw/zinc/88/02/42/1082880242.db2.gz GDJBIOCLCNJIRJ-SFHVURJKSA-N 1 1 353.422 4.069 20 5 FIBDMO COc1ccc2nc(C[NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)sc2c1 ZINC000187443883 1082944775 /nfs/dbraw/zinc/94/47/75/1082944775.db2.gz PPKFCCDEIHYVGD-LBPRGKRZSA-N 1 1 357.435 4.372 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@@H]4CCC[C@H]43)o2)c(Cl)c1 ZINC000510632615 1083213023 /nfs/dbraw/zinc/21/30/23/1083213023.db2.gz HQHPFUIRRDJQRL-SJLPKXTDSA-N 1 1 362.813 4.262 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@@H]4CCC[C@H]43)o2)c(Cl)c1 ZINC000510632615 1083213027 /nfs/dbraw/zinc/21/30/27/1083213027.db2.gz HQHPFUIRRDJQRL-SJLPKXTDSA-N 1 1 362.813 4.262 20 5 FIBDMO O=[N+]([O-])c1sccc1N1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000610808051 1083718246 /nfs/dbraw/zinc/71/82/46/1083718246.db2.gz YBNIISUKXWAFJG-DLBZAZTESA-N 1 1 357.479 4.147 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000548934559 1083847326 /nfs/dbraw/zinc/84/73/26/1083847326.db2.gz JLZQSATXDFOHFK-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000548934559 1083847331 /nfs/dbraw/zinc/84/73/31/1083847331.db2.gz JLZQSATXDFOHFK-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@]4(CCSC4)C3)o2)c1 ZINC000451986499 1083907435 /nfs/dbraw/zinc/90/74/35/1083907435.db2.gz XSEYPUCTZTXCDF-IBGZPJMESA-N 1 1 373.478 4.011 20 5 FIBDMO Cn1cc[nH+]c1C[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000610988213 1083929929 /nfs/dbraw/zinc/92/99/29/1083929929.db2.gz ZZQVJCLGEVQRGN-INIZCTEOSA-N 1 1 358.348 4.002 20 5 FIBDMO O=C(Nc1cccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1)C1CCC1 ZINC000892511249 1084041568 /nfs/dbraw/zinc/04/15/68/1084041568.db2.gz BTQUYHZNASUFHX-UHFFFAOYSA-N 1 1 373.840 4.277 20 5 FIBDMO C[C@@H](c1cccc(Nc2ccc([N+](=O)[O-])cc2Cl)c1)[NH+]1CCOCC1 ZINC000511453739 1084482567 /nfs/dbraw/zinc/48/25/67/1084482567.db2.gz KQEUUOQGZRAPOI-ZDUSSCGKSA-N 1 1 361.829 4.385 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000414156195 1084707357 /nfs/dbraw/zinc/70/73/57/1084707357.db2.gz OXZGYKCPDBHWSV-VXGBXAGGSA-N 1 1 361.467 4.351 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccn(C)n1 ZINC000414168942 1084731583 /nfs/dbraw/zinc/73/15/83/1084731583.db2.gz ASDFNIONWDYHOQ-OLZOCXBDSA-N 1 1 356.451 4.469 20 5 FIBDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000180210179 1084899266 /nfs/dbraw/zinc/89/92/66/1084899266.db2.gz RRYDRSMQTIVVBV-GOSISDBHSA-N 1 1 366.421 4.098 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccccc1OCC(F)(F)F ZINC000511104127 1084916957 /nfs/dbraw/zinc/91/69/57/1084916957.db2.gz GOXUVLYGLQFUTA-UHFFFAOYSA-N 1 1 368.355 4.210 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2ccccc2)cs1 ZINC000511141874 1085073397 /nfs/dbraw/zinc/07/33/97/1085073397.db2.gz NNSHOVKGCJJUQB-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc(-c2ccccc2)cs1 ZINC000511141874 1085073405 /nfs/dbraw/zinc/07/34/05/1085073405.db2.gz NNSHOVKGCJJUQB-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000479446896 1085164677 /nfs/dbraw/zinc/16/46/77/1085164677.db2.gz OWHJNKBTZRUEGR-PGRDOPGGSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@@H]1CC[N@@H+](Cc3ccccc3)C1)CCC2 ZINC000479446896 1085164681 /nfs/dbraw/zinc/16/46/81/1085164681.db2.gz OWHJNKBTZRUEGR-PGRDOPGGSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCN(Cc3ccccc3)C1)CCC2 ZINC000479446896 1085164689 /nfs/dbraw/zinc/16/46/89/1085164689.db2.gz OWHJNKBTZRUEGR-PGRDOPGGSA-N 1 1 365.477 4.084 20 5 FIBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1c(C)noc1C ZINC000549544904 1085540080 /nfs/dbraw/zinc/54/00/80/1085540080.db2.gz QMRVGSQAFREQQL-AWEZNQCLSA-N 1 1 357.332 4.459 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1ccccc1F)C1CC1 ZINC000109093054 1085584126 /nfs/dbraw/zinc/58/41/26/1085584126.db2.gz XLHGWNHCYYCWMK-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000111177062 1085713059 /nfs/dbraw/zinc/71/30/59/1085713059.db2.gz ZJGKKKLRDZPFAJ-HNNXBMFYSA-N 1 1 354.454 4.142 20 5 FIBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cccc2ccccc21 ZINC000051992974 1085921313 /nfs/dbraw/zinc/92/13/13/1085921313.db2.gz XBXPCNDERWFEBV-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cccc2ccccc21 ZINC000051992974 1085921317 /nfs/dbraw/zinc/92/13/17/1085921317.db2.gz XBXPCNDERWFEBV-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc(Cl)ccc1OC ZINC000178730294 1085968183 /nfs/dbraw/zinc/96/81/83/1085968183.db2.gz HLQKKJGNGNZQBL-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Br)cc2)c(Cl)c1 ZINC000049963254 1086079280 /nfs/dbraw/zinc/07/92/80/1086079280.db2.gz UEJGUNKKBUBHSK-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000093839190 1086206715 /nfs/dbraw/zinc/20/67/15/1086206715.db2.gz ADNXKVWCELKTOR-MRXNPFEDSA-N 1 1 374.412 4.385 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000511978604 1086520144 /nfs/dbraw/zinc/52/01/44/1086520144.db2.gz NVUWDKQFCHEXGO-OAHLLOKOSA-N 1 1 356.422 4.024 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@H](C)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000511979647 1086528033 /nfs/dbraw/zinc/52/80/33/1086528033.db2.gz XVYIKAYKOANWEX-HNNXBMFYSA-N 1 1 356.422 4.024 20 5 FIBDMO C[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000136827830 1086622262 /nfs/dbraw/zinc/62/22/62/1086622262.db2.gz RBZMNQPCIMVYNW-OLZOCXBDSA-N 1 1 364.829 4.101 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCC2(CCCC2)CC1 ZINC000583408916 1086655093 /nfs/dbraw/zinc/65/50/93/1086655093.db2.gz SGWIKHXSZYWIIW-CYBMUJFWSA-N 1 1 365.861 4.231 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@H]3[C@H]3CCCO3)o2)c([N+](=O)[O-])c1 ZINC000585767816 1086694498 /nfs/dbraw/zinc/69/44/98/1086694498.db2.gz DZPKAGTWVINIFZ-FXAWDEMLSA-N 1 1 372.421 4.007 20 5 FIBDMO C[C@H]1CC[C@H](c2ccccc2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000512154512 1086848436 /nfs/dbraw/zinc/84/84/36/1086848436.db2.gz YOPSQRSUKHZXML-MGPUTAFESA-N 1 1 368.433 4.435 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C)CC[C@@H]1c1ccccc1 ZINC000512166173 1086865092 /nfs/dbraw/zinc/86/50/92/1086865092.db2.gz NKXQVVRXFJGGRB-MAUKXSAKSA-N 1 1 367.449 4.315 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C)CC[C@@H]1c1ccccc1 ZINC000512166173 1086865108 /nfs/dbraw/zinc/86/51/08/1086865108.db2.gz NKXQVVRXFJGGRB-MAUKXSAKSA-N 1 1 367.449 4.315 20 5 FIBDMO Cc1ccc(C[N@H+](C)Cc2ccc(Br)c([N+](=O)[O-])c2)s1 ZINC000693857668 1087113875 /nfs/dbraw/zinc/11/38/75/1087113875.db2.gz SKEPRHWDDFACPW-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCCc1ccccc1 ZINC000052802657 1087167416 /nfs/dbraw/zinc/16/74/16/1087167416.db2.gz FSJCGYFIQXIMHF-OAHLLOKOSA-N 1 1 366.421 4.270 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccsc1 ZINC000052803851 1087167471 /nfs/dbraw/zinc/16/74/71/1087167471.db2.gz SKGSGPISJUQCPA-KRWDZBQOSA-N 1 1 359.451 4.130 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000424266805 1087892814 /nfs/dbraw/zinc/89/28/14/1087892814.db2.gz JLZRVVVGTSZXMN-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO CCOC(=O)c1oc2ccccc2c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180397219 1087896721 /nfs/dbraw/zinc/89/67/21/1087896721.db2.gz PSUAFAPWMCTDIU-ZDUSSCGKSA-N 1 1 368.389 4.369 20 5 FIBDMO CCOc1ccc([C@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000504929164 1087996459 /nfs/dbraw/zinc/99/64/59/1087996459.db2.gz HBFPOYQAYCHVQN-KBXCAEBGSA-N 1 1 351.491 4.011 20 5 FIBDMO C[C@@H](c1nc2ccccc2o1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000181125576 1088253804 /nfs/dbraw/zinc/25/38/04/1088253804.db2.gz VXZPXWYGXIYWJV-AWEZNQCLSA-N 1 1 367.405 4.340 20 5 FIBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000177533115 1088358124 /nfs/dbraw/zinc/35/81/24/1088358124.db2.gz IBJIODAFLRSHSQ-RDTXWAMCSA-N 1 1 364.405 4.023 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000434609399 1088847302 /nfs/dbraw/zinc/84/73/02/1088847302.db2.gz SOJXTJUEYBBNLK-CYBMUJFWSA-N 1 1 361.829 4.188 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000434609399 1088847319 /nfs/dbraw/zinc/84/73/19/1088847319.db2.gz SOJXTJUEYBBNLK-CYBMUJFWSA-N 1 1 361.829 4.188 20 5 FIBDMO CC(C)[C@H]1[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000430088008 1088963752 /nfs/dbraw/zinc/96/37/52/1088963752.db2.gz USXROFSEKPUXJC-LJQANCHMSA-N 1 1 354.454 4.006 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)c2C1 ZINC000066761011 1089003258 /nfs/dbraw/zinc/00/32/58/1089003258.db2.gz VGQMGOCATXOJBF-UHFFFAOYSA-N 1 1 364.405 4.054 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)c2C1 ZINC000066761011 1089003275 /nfs/dbraw/zinc/00/32/75/1089003275.db2.gz VGQMGOCATXOJBF-UHFFFAOYSA-N 1 1 364.405 4.054 20 5 FIBDMO CC1(C)C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c2cc(N)ccc2O1 ZINC000415021416 1089048307 /nfs/dbraw/zinc/04/83/07/1089048307.db2.gz AUQSBEUNSFMXHC-MRXNPFEDSA-N 1 1 361.829 4.222 20 5 FIBDMO C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549168469 1089093041 /nfs/dbraw/zinc/09/30/41/1089093041.db2.gz LILFZKKOLGHKCC-ZDUSSCGKSA-N 1 1 350.365 4.432 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000549169450 1089104610 /nfs/dbraw/zinc/10/46/10/1089104610.db2.gz UZXLGYPVRXUEGO-OAHLLOKOSA-N 1 1 358.360 4.028 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000434898007 1089115727 /nfs/dbraw/zinc/11/57/27/1089115727.db2.gz SYFVQDUVCIFVQR-APWZRJJASA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000435056116 1089245597 /nfs/dbraw/zinc/24/55/97/1089245597.db2.gz LQFPXQCFBUCPMO-LSDHHAIUSA-N 1 1 351.406 4.422 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC001167717642 1089458769 /nfs/dbraw/zinc/45/87/69/1089458769.db2.gz ZLRVLKISGKVGOA-IBGZPJMESA-N 1 1 356.422 4.425 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC001167717642 1089458779 /nfs/dbraw/zinc/45/87/79/1089458779.db2.gz ZLRVLKISGKVGOA-IBGZPJMESA-N 1 1 356.422 4.425 20 5 FIBDMO CCCO[C@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425401219 1089852344 /nfs/dbraw/zinc/85/23/44/1089852344.db2.gz GRDXAKZQINFZRU-HNNXBMFYSA-N 1 1 371.275 4.138 20 5 FIBDMO CCCO[C@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425401219 1089852356 /nfs/dbraw/zinc/85/23/56/1089852356.db2.gz GRDXAKZQINFZRU-HNNXBMFYSA-N 1 1 371.275 4.138 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1cncc(Br)c1)c1ccccc1[N+](=O)[O-] ZINC000515339537 1089973057 /nfs/dbraw/zinc/97/30/57/1089973057.db2.gz KQLGHCIXPLXQGC-WDEREUQCSA-N 1 1 350.216 4.164 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@H](c3ccccc3)C3CCC3)n2)cc1 ZINC000104696776 1090302839 /nfs/dbraw/zinc/30/28/39/1090302839.db2.gz ZZLHOLPMGWITPQ-LJQANCHMSA-N 1 1 364.405 4.276 20 5 FIBDMO COc1ccc(OCC[N@@H+]2CC[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000511613424 1090755483 /nfs/dbraw/zinc/75/54/83/1090755483.db2.gz XGZRJWWBXYOFAL-INIZCTEOSA-N 1 1 362.813 4.083 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000511613424 1090755489 /nfs/dbraw/zinc/75/54/89/1090755489.db2.gz XGZRJWWBXYOFAL-INIZCTEOSA-N 1 1 362.813 4.083 20 5 FIBDMO Cc1ccc2[nH]c(C[NH2+][C@@H]3CCCCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000417317586 1090798247 /nfs/dbraw/zinc/79/82/47/1090798247.db2.gz WYSAUGHNBHDGPV-QGZVFWFLSA-N 1 1 350.422 4.337 20 5 FIBDMO Cc1ccc2nc(C[NH2+][C@@H]3CCCCc4ccc([N+](=O)[O-])cc43)[nH]c2c1 ZINC000417317586 1090798259 /nfs/dbraw/zinc/79/82/59/1090798259.db2.gz WYSAUGHNBHDGPV-QGZVFWFLSA-N 1 1 350.422 4.337 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccn(C3CCCC3)n1)CCCC2 ZINC000417308637 1090799875 /nfs/dbraw/zinc/79/98/75/1090799875.db2.gz HWSDCNWADFGQEC-HXUWFJFHSA-N 1 1 354.454 4.464 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511628924 1090895706 /nfs/dbraw/zinc/89/57/06/1090895706.db2.gz ZJEPIBOJURBXQU-GOSISDBHSA-N 1 1 373.840 4.332 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCOc3c(Br)cccc32)cs1 ZINC000500384364 1091393047 /nfs/dbraw/zinc/39/30/47/1091393047.db2.gz ODFYTJOYRFWJRZ-LBPRGKRZSA-N 1 1 369.240 4.032 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000511759288 1091626424 /nfs/dbraw/zinc/62/64/24/1091626424.db2.gz TUVXCFMSSPSRMK-SZVBFZGTSA-N 1 1 372.852 4.253 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000511759280 1091626933 /nfs/dbraw/zinc/62/69/33/1091626933.db2.gz TUVXCFMSSPSRMK-AYBZRNKSSA-N 1 1 372.852 4.253 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cc(F)ccc1Br ZINC000571938568 1091802210 /nfs/dbraw/zinc/80/22/10/1091802210.db2.gz HJUJDHBTEYTWAD-OAHLLOKOSA-N 1 1 365.202 4.274 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512291429 1092013222 /nfs/dbraw/zinc/01/32/22/1092013222.db2.gz JJNUDTJRWOSJIY-OAHLLOKOSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512291429 1092013231 /nfs/dbraw/zinc/01/32/31/1092013231.db2.gz JJNUDTJRWOSJIY-OAHLLOKOSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1cccc(C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC(C)C)c1 ZINC000521195819 1092574707 /nfs/dbraw/zinc/57/47/07/1092574707.db2.gz VSLNNCAYTBCOHO-UHFFFAOYSA-N 1 1 370.449 4.428 20 5 FIBDMO COc1cc(C[N@H+]2CCCCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000490545428 1093114442 /nfs/dbraw/zinc/11/44/42/1093114442.db2.gz MKRATCQWBPYJJM-LBPRGKRZSA-N 1 1 358.385 4.012 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433061447 1093169038 /nfs/dbraw/zinc/16/90/38/1093169038.db2.gz PGNLDSMQXYQTTA-SFHVURJKSA-N 1 1 367.449 4.111 20 5 FIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCCc2cccnc21 ZINC000614215630 1093207854 /nfs/dbraw/zinc/20/78/54/1093207854.db2.gz NMUZSEWMYKJSEM-QGZVFWFLSA-N 1 1 366.421 4.421 20 5 FIBDMO O=[N+]([O-])c1c(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ccc2ncccc21 ZINC000383873356 1093292328 /nfs/dbraw/zinc/29/23/28/1093292328.db2.gz ZYCKWXZCXXAYTL-KRWDZBQOSA-N 1 1 362.433 4.077 20 5 FIBDMO C[C@H](c1nc2ccccc2s1)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000051878265 1093310115 /nfs/dbraw/zinc/31/01/15/1093310115.db2.gz OIPTYQWXAGCZQY-CYBMUJFWSA-N 1 1 357.435 4.276 20 5 FIBDMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000051878265 1093310124 /nfs/dbraw/zinc/31/01/24/1093310124.db2.gz OIPTYQWXAGCZQY-CYBMUJFWSA-N 1 1 357.435 4.276 20 5 FIBDMO Cc1cccc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000047284060 1093465975 /nfs/dbraw/zinc/46/59/75/1093465975.db2.gz GHVAJWOXMQIQPJ-HNNXBMFYSA-N 1 1 367.449 4.387 20 5 FIBDMO CC[C@H]1COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000509831612 1093470192 /nfs/dbraw/zinc/47/01/92/1093470192.db2.gz FTKQWLFMWPZVSS-LBPRGKRZSA-N 1 1 350.802 4.119 20 5 FIBDMO CC[C@H]1COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000509831612 1093470200 /nfs/dbraw/zinc/47/02/00/1093470200.db2.gz FTKQWLFMWPZVSS-LBPRGKRZSA-N 1 1 350.802 4.119 20 5 FIBDMO CC(C)c1ccc(C(=O)N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000474173358 1093552243 /nfs/dbraw/zinc/55/22/43/1093552243.db2.gz UCGYAXDLNRGLDT-NVXWUHKLSA-N 1 1 373.497 4.101 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H](c1ccccc1)C1(CO)CCC1 ZINC000433323856 1093585508 /nfs/dbraw/zinc/58/55/08/1093585508.db2.gz ZODOCYJQTVWQLI-SFHVURJKSA-N 1 1 360.841 4.242 20 5 FIBDMO COc1cccc(OC(F)(F)F)c1C[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000512982992 1093626517 /nfs/dbraw/zinc/62/65/17/1093626517.db2.gz KEVZDAGBRZMXIG-UHFFFAOYSA-N 1 1 370.327 4.100 20 5 FIBDMO Cc1cccc(C[N@@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1C ZINC000428754040 1093636679 /nfs/dbraw/zinc/63/66/79/1093636679.db2.gz SCYSRJOBDGFYKF-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1cccc(C[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1C ZINC000428754040 1093636687 /nfs/dbraw/zinc/63/66/87/1093636687.db2.gz SCYSRJOBDGFYKF-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO COc1ccc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-] ZINC000052611838 1093836354 /nfs/dbraw/zinc/83/63/54/1093836354.db2.gz CKQXNXPFUJSKHV-OAHLLOKOSA-N 1 1 367.405 4.124 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]1c1cccc2c1OCCO2 ZINC000513124093 1093862172 /nfs/dbraw/zinc/86/21/72/1093862172.db2.gz ZFSVLBQLXAPVHB-OCTSTCLRSA-N 1 1 366.417 4.216 20 5 FIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(Cn2cc[nH+]c2C(C)C)cc1OC ZINC000513580429 1094220744 /nfs/dbraw/zinc/22/07/44/1094220744.db2.gz NZALOAJGRLJEPC-CQSZACIVSA-N 1 1 361.442 4.397 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000501089499 1094490064 /nfs/dbraw/zinc/49/00/64/1094490064.db2.gz KHADGDKHWRMSOG-HNNXBMFYSA-N 1 1 371.437 4.015 20 5 FIBDMO C[N@@H+](CCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000501581883 1094783832 /nfs/dbraw/zinc/78/38/32/1094783832.db2.gz PYGDGQDJLPDCMJ-UHFFFAOYSA-N 1 1 368.865 4.024 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501845379 1094960030 /nfs/dbraw/zinc/96/00/30/1094960030.db2.gz WXJZFNOCGLKQDG-SJLPKXTDSA-N 1 1 367.449 4.192 20 5 FIBDMO Cc1ccc([C@H]2C[C@@H](C)[N@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000501852322 1094970621 /nfs/dbraw/zinc/97/06/21/1094970621.db2.gz QTIOXBXIBINTPN-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000444166757 1095806122 /nfs/dbraw/zinc/80/61/22/1095806122.db2.gz JYXQUSAGMATTDE-YJYMSZOUSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000444166757 1095806148 /nfs/dbraw/zinc/80/61/48/1095806148.db2.gz JYXQUSAGMATTDE-YJYMSZOUSA-N 1 1 371.412 4.064 20 5 FIBDMO CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C)c2[nH+]ccn2c1 ZINC000502888380 1095923512 /nfs/dbraw/zinc/92/35/12/1095923512.db2.gz OEKGJFFDWWWEHH-UHFFFAOYSA-N 1 1 370.434 4.305 20 5 FIBDMO Cc1ccc(C[N@H+](Cc2ccco2)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000513762880 1096074617 /nfs/dbraw/zinc/07/46/17/1096074617.db2.gz UHQWXQYKPKOOQS-UHFFFAOYSA-N 1 1 352.390 4.404 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2ccco2)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000513762880 1096074631 /nfs/dbraw/zinc/07/46/31/1096074631.db2.gz UHQWXQYKPKOOQS-UHFFFAOYSA-N 1 1 352.390 4.404 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)c1ccc(F)cc1 ZINC000532926876 1098595114 /nfs/dbraw/zinc/59/51/14/1098595114.db2.gz QIBRYXFCVDNQAV-OAHLLOKOSA-N 1 1 373.428 4.454 20 5 FIBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1ccc(C)cc1 ZINC000532929784 1098600328 /nfs/dbraw/zinc/60/03/28/1098600328.db2.gz YUABFBIUZRNIHT-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1ccc(C)cc1 ZINC000532929784 1098600334 /nfs/dbraw/zinc/60/03/34/1098600334.db2.gz YUABFBIUZRNIHT-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccc(-c4ccccn4)nc3)C2)cc1 ZINC000425470354 1098741325 /nfs/dbraw/zinc/74/13/25/1098741325.db2.gz FNGNJXLQHUJEPA-LJQANCHMSA-N 1 1 374.444 4.431 20 5 FIBDMO Cc1cccc(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)c1 ZINC000533241533 1098900233 /nfs/dbraw/zinc/90/02/33/1098900233.db2.gz AZAITJDXSDNXJQ-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO C[C@@H](c1nc2ccccc2s1)[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000505858123 1099199132 /nfs/dbraw/zinc/19/91/32/1099199132.db2.gz AXRDQEPQUZOEON-ZDUSSCGKSA-N 1 1 357.435 4.276 20 5 FIBDMO C[C@@H](c1nc2ccccc2s1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000505858123 1099199145 /nfs/dbraw/zinc/19/91/45/1099199145.db2.gz AXRDQEPQUZOEON-ZDUSSCGKSA-N 1 1 357.435 4.276 20 5 FIBDMO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000508671903 1099477045 /nfs/dbraw/zinc/47/70/45/1099477045.db2.gz PHMXUDAIHPCMGD-LJQANCHMSA-N 1 1 356.422 4.435 20 5 FIBDMO Cc1c(C[NH+]2CCC(C(=O)c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] ZINC000192473788 1099776592 /nfs/dbraw/zinc/77/65/92/1099776592.db2.gz ODVCOHGQEZGPOX-UHFFFAOYSA-N 1 1 356.397 4.137 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1)C1CC1 ZINC000508769250 1100046665 /nfs/dbraw/zinc/04/66/65/1100046665.db2.gz NZHHKMWATVBKNP-UHFFFAOYSA-N 1 1 367.449 4.448 20 5 FIBDMO C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000536667724 1100126010 /nfs/dbraw/zinc/12/60/10/1100126010.db2.gz OJWHBZHYXGCNNB-CHWSQXEVSA-N 1 1 364.829 4.244 20 5 FIBDMO Cc1nc2scc(C3CC3)n2c1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000459464886 1100208899 /nfs/dbraw/zinc/20/88/99/1100208899.db2.gz NBXFNNOOUNERCA-NSHDSACASA-N 1 1 356.451 4.341 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H](c1ccccc1)C1(CO)CCCC1 ZINC000459529606 1100278385 /nfs/dbraw/zinc/27/83/85/1100278385.db2.gz MHXMCESCLSMTCG-IBGZPJMESA-N 1 1 358.413 4.118 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000459656877 1100398911 /nfs/dbraw/zinc/39/89/11/1100398911.db2.gz WFJLHMCGPMCTIR-INIZCTEOSA-N 1 1 372.387 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCc4ncsc4C3)s2)cc1 ZINC000438360601 1100617358 /nfs/dbraw/zinc/61/73/58/1100617358.db2.gz WAIGVTRJNCAVIO-UHFFFAOYSA-N 1 1 357.460 4.338 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCc4ncsc4C3)s2)cc1 ZINC000438360601 1100617360 /nfs/dbraw/zinc/61/73/60/1100617360.db2.gz WAIGVTRJNCAVIO-UHFFFAOYSA-N 1 1 357.460 4.338 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)o1 ZINC000506326705 1100861715 /nfs/dbraw/zinc/86/17/15/1100861715.db2.gz QMCUHMQDEKIDFH-NRFANRHFSA-N 1 1 364.401 4.428 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCO[C@H](c3ccccc3)C2)o1 ZINC000506326705 1100861725 /nfs/dbraw/zinc/86/17/25/1100861725.db2.gz QMCUHMQDEKIDFH-NRFANRHFSA-N 1 1 364.401 4.428 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@H](c4ccccc4)C3)o2)cc1 ZINC000506326424 1100861933 /nfs/dbraw/zinc/86/19/33/1100861933.db2.gz PFKZDXAOKBNNNO-NRFANRHFSA-N 1 1 364.401 4.428 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@H](c4ccccc4)C3)o2)cc1 ZINC000506326424 1100861945 /nfs/dbraw/zinc/86/19/45/1100861945.db2.gz PFKZDXAOKBNNNO-NRFANRHFSA-N 1 1 364.401 4.428 20 5 FIBDMO C[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+]1CCC[C@H](C)C1 ZINC000518031468 1100874436 /nfs/dbraw/zinc/87/44/36/1100874436.db2.gz VJAGHZJMENWWTM-IRXDYDNUSA-N 1 1 361.489 4.238 20 5 FIBDMO Cc1ccc(C(C)C)c(Oc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2[N+](=O)[O-])c1 ZINC000506343344 1100904856 /nfs/dbraw/zinc/90/48/56/1100904856.db2.gz WAOZVVNCHGJNOA-QGZVFWFLSA-N 1 1 370.449 4.386 20 5 FIBDMO Cc1ccc(C(C)C)c(Oc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2[N+](=O)[O-])c1 ZINC000506343344 1100904860 /nfs/dbraw/zinc/90/48/60/1100904860.db2.gz WAOZVVNCHGJNOA-QGZVFWFLSA-N 1 1 370.449 4.386 20 5 FIBDMO COC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 ZINC000536995162 1101376072 /nfs/dbraw/zinc/37/60/72/1101376072.db2.gz RVPMTXUZJNOUBW-KZULUSFZSA-N 1 1 350.365 4.220 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2ccc(F)cc2)C2CCOCC2)cc1[N+](=O)[O-] ZINC000426378058 1101430731 /nfs/dbraw/zinc/43/07/31/1101430731.db2.gz OQAGWZQYRWLZPK-UHFFFAOYSA-N 1 1 358.413 4.224 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc(Oc2ccccc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000537078841 1101443409 /nfs/dbraw/zinc/44/34/09/1101443409.db2.gz UMTSPYNLFUQQRG-AWEZNQCLSA-N 1 1 350.378 4.028 20 5 FIBDMO COc1ccc(CC2CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)cc1 ZINC000506640092 1101652686 /nfs/dbraw/zinc/65/26/86/1101652686.db2.gz TYENTDFWUSIJMA-UHFFFAOYSA-N 1 1 358.413 4.197 20 5 FIBDMO CC(C)[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(F)cc1 ZINC000506790594 1102118569 /nfs/dbraw/zinc/11/85/69/1102118569.db2.gz OCAIJPKISVIOGZ-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO CC(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(F)cc1 ZINC000506790594 1102118576 /nfs/dbraw/zinc/11/85/76/1102118576.db2.gz OCAIJPKISVIOGZ-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC001168192128 1102256584 /nfs/dbraw/zinc/25/65/84/1102256584.db2.gz IDSBPNXSXASJIP-HOTGVXAUSA-N 1 1 373.884 4.343 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CN1CCCC1)c1ccccc1 ZINC000532451995 1102344070 /nfs/dbraw/zinc/34/40/70/1102344070.db2.gz CLBIYIMFMTUSSP-UWJYYQICSA-N 1 1 353.466 4.391 20 5 FIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000053279682 1102658476 /nfs/dbraw/zinc/65/84/76/1102658476.db2.gz MDXLNRKFZXZAGJ-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000537649427 1102672489 /nfs/dbraw/zinc/67/24/89/1102672489.db2.gz LAPOVCFTJIIRCA-KRWDZBQOSA-N 1 1 369.465 4.019 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000537660105 1102784451 /nfs/dbraw/zinc/78/44/51/1102784451.db2.gz ZDQHOGMJNKSCNM-QVKFZJNVSA-N 1 1 362.433 4.188 20 5 FIBDMO CCOc1ccccc1[C@H](CC)[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184303117 1102807743 /nfs/dbraw/zinc/80/77/43/1102807743.db2.gz PGCUZCYHJYCJSB-INIZCTEOSA-N 1 1 362.401 4.382 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC=C(c2ccccc2)C1 ZINC000551405606 1103180635 /nfs/dbraw/zinc/18/06/35/1103180635.db2.gz VNGODAVCIQFALD-UHFFFAOYSA-N 1 1 365.433 4.021 20 5 FIBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1O ZINC000438334648 1103455549 /nfs/dbraw/zinc/45/55/49/1103455549.db2.gz MKMDMXATCDFPSR-KRWDZBQOSA-N 1 1 364.829 4.101 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccn(Cc3ccccc3)n1)CCC2 ZINC000551813849 1103697788 /nfs/dbraw/zinc/69/77/88/1103697788.db2.gz SWTMHSIEBYQNKE-NRFANRHFSA-N 1 1 362.433 4.007 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000129396152 1103699090 /nfs/dbraw/zinc/69/90/90/1103699090.db2.gz QSRJPCRATAIONX-GOSISDBHSA-N 1 1 367.449 4.062 20 5 FIBDMO CC(C)c1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[nH]1 ZINC000536491096 1105173271 /nfs/dbraw/zinc/17/32/71/1105173271.db2.gz GPFVRAVEZGUXTA-LBPRGKRZSA-N 1 1 371.466 4.416 20 5 FIBDMO Cc1c([C@@H](C)[NH2+]Cc2nc3cc(Cl)ccc3n2C)cccc1[N+](=O)[O-] ZINC000427894088 1105312305 /nfs/dbraw/zinc/31/23/05/1105312305.db2.gz KFNUTVQTSYMDLZ-GFCCVEGCSA-N 1 1 358.829 4.294 20 5 FIBDMO CC(C)c1ccc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000186435641 1107097729 /nfs/dbraw/zinc/09/77/29/1107097729.db2.gz QEFKAIPPPIDDIV-NRFANRHFSA-N 1 1 352.434 4.350 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nc(C4CCCC4)no3)C2)cc1 ZINC000451547657 1107165775 /nfs/dbraw/zinc/16/57/75/1107165775.db2.gz LJFQUSMAJJTWEC-MRXNPFEDSA-N 1 1 356.426 4.015 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc(C4CCCC4)no3)C2)cc1 ZINC000451547657 1107165785 /nfs/dbraw/zinc/16/57/85/1107165785.db2.gz LJFQUSMAJJTWEC-MRXNPFEDSA-N 1 1 356.426 4.015 20 5 FIBDMO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000237517170 1107608572 /nfs/dbraw/zinc/60/85/72/1107608572.db2.gz SKKHSOKUGDFMOH-LJLILKBBSA-N 1 1 368.368 4.148 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[C@@H]1c1ccccc1 ZINC000444651924 1108048354 /nfs/dbraw/zinc/04/83/54/1108048354.db2.gz QKKTYNAHAGSCQD-PBHICJAKSA-N 1 1 350.422 4.097 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(CO)(Cc2ccccc2)CC1 ZINC000444775262 1108173534 /nfs/dbraw/zinc/17/35/34/1108173534.db2.gz MNNCCWSVLXISOA-UHFFFAOYSA-N 1 1 374.868 4.065 20 5 FIBDMO Cc1ccsc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000021793400 1108944362 /nfs/dbraw/zinc/94/43/62/1108944362.db2.gz OLQQNHKETNYBBQ-LLVKDONJSA-N 1 1 367.858 4.077 20 5 FIBDMO Cc1ccsc1C[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000021793400 1108944366 /nfs/dbraw/zinc/94/43/66/1108944366.db2.gz OLQQNHKETNYBBQ-LLVKDONJSA-N 1 1 367.858 4.077 20 5 FIBDMO CC(C)CCOc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000446846778 1109364134 /nfs/dbraw/zinc/36/41/34/1109364134.db2.gz DPVKYFKRQKBPKO-UHFFFAOYSA-N 1 1 368.437 4.186 20 5 FIBDMO CC(C)c1ccc(C[NH+]2CCC(Oc3ncccc3F)CC2)cc1[N+](=O)[O-] ZINC000447068687 1109434667 /nfs/dbraw/zinc/43/46/67/1109434667.db2.gz MKOQKJKKSNEDSR-UHFFFAOYSA-N 1 1 373.428 4.296 20 5 FIBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000525707230 1109487071 /nfs/dbraw/zinc/48/70/71/1109487071.db2.gz BALAAOSUJZHFQY-SCLBCKFNSA-N 1 1 361.467 4.160 20 5 FIBDMO COc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1 ZINC000525707229 1109487120 /nfs/dbraw/zinc/48/71/20/1109487120.db2.gz BALAAOSUJZHFQY-FZKQIMNGSA-N 1 1 361.467 4.160 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC1CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000447522382 1109560083 /nfs/dbraw/zinc/56/00/83/1109560083.db2.gz YLGDQJUSHTXOND-QFIPXVFZSA-N 1 1 365.477 4.226 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCc3c2ccc(F)c3Br)cs1 ZINC000449547538 1110105979 /nfs/dbraw/zinc/10/59/79/1110105979.db2.gz INHPNOWSRPLOFK-GFCCVEGCSA-N 1 1 371.231 4.335 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2cccs2)C2(CO)CCC2)c(Cl)c1 ZINC000449770522 1110166147 /nfs/dbraw/zinc/16/61/47/1110166147.db2.gz WRHGMPCECQUKHR-INIZCTEOSA-N 1 1 366.870 4.303 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000538730443 1111267519 /nfs/dbraw/zinc/26/75/19/1111267519.db2.gz LGHIFMZEQSASAG-OAHLLOKOSA-N 1 1 356.422 4.167 20 5 FIBDMO C[C@@H]1OCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@H]1C ZINC000538726312 1111276469 /nfs/dbraw/zinc/27/64/69/1111276469.db2.gz JVAMTAUTECJELC-RYUDHWBXSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@@H]1OCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@H]1C ZINC000538726312 1111276472 /nfs/dbraw/zinc/27/64/72/1111276472.db2.gz JVAMTAUTECJELC-RYUDHWBXSA-N 1 1 350.802 4.117 20 5 FIBDMO CCC[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)c(Cl)c1 ZINC000539259931 1111497731 /nfs/dbraw/zinc/49/77/31/1111497731.db2.gz FKVMBKHYWHKLAA-ZDUSSCGKSA-N 1 1 357.241 4.266 20 5 FIBDMO CCC[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)c(Cl)c1 ZINC000539259930 1111498055 /nfs/dbraw/zinc/49/80/55/1111498055.db2.gz FKVMBKHYWHKLAA-CYBMUJFWSA-N 1 1 357.241 4.266 20 5 FIBDMO COc1ccc(C[N@@H+]2CCC[C@H]2CF)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000552129275 1111587402 /nfs/dbraw/zinc/58/74/02/1111587402.db2.gz IEGVWJAMDSZMBR-SFHVURJKSA-N 1 1 374.412 4.116 20 5 FIBDMO COc1ccc(C[N@H+]2CCC[C@H]2CF)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000552129275 1111587403 /nfs/dbraw/zinc/58/74/03/1111587403.db2.gz IEGVWJAMDSZMBR-SFHVURJKSA-N 1 1 374.412 4.116 20 5 FIBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000479364470 1112007118 /nfs/dbraw/zinc/00/71/18/1112007118.db2.gz IQILOEOITUWHEM-OAHLLOKOSA-N 1 1 371.485 4.106 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1ccc(Br)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000479511287 1112054952 /nfs/dbraw/zinc/05/49/52/1112054952.db2.gz IZIDBORLDLLQPR-GHMZBOCLSA-N 1 1 350.216 4.164 20 5 FIBDMO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554848958 1112528617 /nfs/dbraw/zinc/52/86/17/1112528617.db2.gz ULGNQWNAVWOPCR-MRXNPFEDSA-N 1 1 369.465 4.220 20 5 FIBDMO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554848958 1112528622 /nfs/dbraw/zinc/52/86/22/1112528622.db2.gz ULGNQWNAVWOPCR-MRXNPFEDSA-N 1 1 369.465 4.220 20 5 FIBDMO CN(C)c1cc(Cl)cc(Cl)c1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000554969172 1112598178 /nfs/dbraw/zinc/59/81/78/1112598178.db2.gz GCDKSNQBWCUICW-UHFFFAOYSA-N 1 1 354.237 4.257 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000482437309 1113254544 /nfs/dbraw/zinc/25/45/44/1113254544.db2.gz DESVTWVCGGTBNG-ICSRJNTNSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000482437309 1113254548 /nfs/dbraw/zinc/25/45/48/1113254548.db2.gz DESVTWVCGGTBNG-ICSRJNTNSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1cccc(CC2(O)CC[NH+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 ZINC000482936567 1113401655 /nfs/dbraw/zinc/40/16/55/1113401655.db2.gz KYRQDYSAOVRLSC-UHFFFAOYSA-N 1 1 374.868 4.126 20 5 FIBDMO C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000160764405 1113447895 /nfs/dbraw/zinc/44/78/95/1113447895.db2.gz HPQKOLVFWMPELM-UWVAXJGDSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)C[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000160764405 1113447900 /nfs/dbraw/zinc/44/79/00/1113447900.db2.gz HPQKOLVFWMPELM-UWVAXJGDSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483240515 1113469508 /nfs/dbraw/zinc/46/95/08/1113469508.db2.gz RIZCLZXBVFSEOJ-UKRRQHHQSA-N 1 1 358.442 4.464 20 5 FIBDMO CC(C)(C)C[C@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000488730896 1113986318 /nfs/dbraw/zinc/98/63/18/1113986318.db2.gz SUYLYQGONONOJN-CYBMUJFWSA-N 1 1 353.850 4.087 20 5 FIBDMO CC(C)c1ccc([C@@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000490670472 1114315713 /nfs/dbraw/zinc/31/57/13/1114315713.db2.gz FXUZBAFBZPSSMR-FQEVSTJZSA-N 1 1 369.465 4.107 20 5 FIBDMO CC(C)[N@H+]1CCC[C@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000491035727 1114364357 /nfs/dbraw/zinc/36/43/57/1114364357.db2.gz JZWOKVIHYALPEA-XMSQKQJNSA-N 1 1 367.493 4.394 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000491083086 1114365926 /nfs/dbraw/zinc/36/59/26/1114365926.db2.gz FSJUBEZIIDVPMH-LBPRGKRZSA-N 1 1 360.401 4.114 20 5 FIBDMO COc1cc(C[N@@H+](CC(C)C)C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000491094025 1114372440 /nfs/dbraw/zinc/37/24/40/1114372440.db2.gz XERYHMUWHVRSNP-UHFFFAOYSA-N 1 1 360.401 4.114 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000165629192 1114855559 /nfs/dbraw/zinc/85/55/59/1114855559.db2.gz PUXPTQPTUVWKAY-LJQANCHMSA-N 1 1 371.412 4.208 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC(c3ccccn3)CC2)c1 ZINC000590169131 1114902842 /nfs/dbraw/zinc/90/28/42/1114902842.db2.gz KUEFIFISKHBMIE-UHFFFAOYSA-N 1 1 365.355 4.388 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2ccccn2)C1 ZINC000590599966 1114952360 /nfs/dbraw/zinc/95/23/60/1114952360.db2.gz HSHJYEKTHYESHK-MRXNPFEDSA-N 1 1 355.438 4.157 20 5 FIBDMO CC(=O)Nc1ccc(-c2cccc(C[N@@H+]3CCC[C@H]3C)c2)cc1[N+](=O)[O-] ZINC000592986412 1115278609 /nfs/dbraw/zinc/27/86/09/1115278609.db2.gz NFGRHCCEOGFIIJ-CQSZACIVSA-N 1 1 353.422 4.205 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C2(c3ccccc3Cl)CCC2)c1 ZINC000593040084 1115281437 /nfs/dbraw/zinc/28/14/37/1115281437.db2.gz OBZJZNPRLHEPIN-UHFFFAOYSA-N 1 1 374.824 4.204 20 5 FIBDMO CCCCCn1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c(C)n1 ZINC000595033231 1115510637 /nfs/dbraw/zinc/51/06/37/1115510637.db2.gz CGFAUIFXAMVFEY-OAHLLOKOSA-N 1 1 360.458 4.149 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccccc1N1CCCCC1 ZINC000595033571 1115510721 /nfs/dbraw/zinc/51/07/21/1115510721.db2.gz NNDZVBOIFJBNQM-INIZCTEOSA-N 1 1 369.465 4.445 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1nccn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000595107579 1115516746 /nfs/dbraw/zinc/51/67/46/1115516746.db2.gz NKZBMGDCIWBYNM-STQMWFEESA-N 1 1 356.451 4.469 20 5 FIBDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000761237582 1115685238 /nfs/dbraw/zinc/68/52/38/1115685238.db2.gz DVINEHYXWPHBNO-UHFFFAOYSA-N 1 1 356.756 4.482 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c(OC)c1 ZINC000598995653 1115777502 /nfs/dbraw/zinc/77/75/02/1115777502.db2.gz XNXPKTNMMUMUIU-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO CC(C)(C)OC(=O)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000593687009 1115794904 /nfs/dbraw/zinc/79/49/04/1115794904.db2.gz FTWVLBWLMAHCSC-QZTJIDSGSA-N 1 1 368.433 4.255 20 5 FIBDMO CC[C@@H]([NH2+][C@@H](Cc1ccccc1)c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593723559 1115803695 /nfs/dbraw/zinc/80/36/95/1115803695.db2.gz YKGBYLVCKYYAKA-UXHICEINSA-N 1 1 364.449 4.353 20 5 FIBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccc2ccccc21 ZINC000603892047 1115826797 /nfs/dbraw/zinc/82/67/97/1115826797.db2.gz ZVPGAGZUPBTARH-OAHLLOKOSA-N 1 1 363.417 4.207 20 5 FIBDMO CC1CCC([N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C2CC2)CC1 ZINC000603895584 1115827206 /nfs/dbraw/zinc/82/72/06/1115827206.db2.gz VPTSZZJEABWVOW-UHFFFAOYSA-N 1 1 356.426 4.188 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576661 1115827985 /nfs/dbraw/zinc/82/79/85/1115827985.db2.gz QAANANBAUBIKND-BTYIYWSLSA-N 1 1 366.417 4.156 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576661 1115827989 /nfs/dbraw/zinc/82/79/89/1115827989.db2.gz QAANANBAUBIKND-BTYIYWSLSA-N 1 1 366.417 4.156 20 5 FIBDMO Cc1cccc([C@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C(C)C)c1 ZINC000599628245 1115832132 /nfs/dbraw/zinc/83/21/32/1115832132.db2.gz RHLKWYOHFNVKRR-LJQANCHMSA-N 1 1 366.421 4.440 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000604470424 1115865902 /nfs/dbraw/zinc/86/59/02/1115865902.db2.gz XATBDZFSXHBVHS-OAHLLOKOSA-N 1 1 367.449 4.387 20 5 FIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000604521217 1115867036 /nfs/dbraw/zinc/86/70/36/1115867036.db2.gz COUNAAVZKVLLTD-NQIIRXRSSA-N 1 1 370.449 4.073 20 5 FIBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000604493273 1115867569 /nfs/dbraw/zinc/86/75/69/1115867569.db2.gz BKGRHGXZROFUFL-KRWDZBQOSA-N 1 1 355.438 4.315 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3cccc(OC(F)(F)F)c3)CC2)c(F)c1 ZINC000594034750 1115970528 /nfs/dbraw/zinc/97/05/28/1115970528.db2.gz GNTGZJKTBKBLCT-UHFFFAOYSA-N 1 1 370.302 4.411 20 5 FIBDMO C[N@H+](CCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccccc1 ZINC000608836780 1116130922 /nfs/dbraw/zinc/13/09/22/1116130922.db2.gz OOBOSTNMHKZXEB-UHFFFAOYSA-N 1 1 365.433 4.076 20 5 FIBDMO C[N@@H+](CCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)Cc1ccccc1 ZINC000608836780 1116130923 /nfs/dbraw/zinc/13/09/23/1116130923.db2.gz OOBOSTNMHKZXEB-UHFFFAOYSA-N 1 1 365.433 4.076 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@@H+]1CCC[C@@H](C)C1 ZINC000608836402 1116131246 /nfs/dbraw/zinc/13/12/46/1116131246.db2.gz WCGZRJZXIXSHGS-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@H+]1CCC[C@@H](C)C1 ZINC000608836402 1116131248 /nfs/dbraw/zinc/13/12/48/1116131248.db2.gz WCGZRJZXIXSHGS-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C)CC1 ZINC000608836960 1116131560 /nfs/dbraw/zinc/13/15/60/1116131560.db2.gz DEHAIMKAGULQKB-MRXNPFEDSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H]1C[C@@H](N(C)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000491228785 1116226126 /nfs/dbraw/zinc/22/61/26/1116226126.db2.gz SHXZGAFUMYAYMG-APWZRJJASA-N 1 1 371.456 4.219 20 5 FIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000443075204 1116343799 /nfs/dbraw/zinc/34/37/99/1116343799.db2.gz ZEEULPWEPKMUPR-VQIMIIECSA-N 1 1 369.465 4.362 20 5 FIBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000462695968 1116391868 /nfs/dbraw/zinc/39/18/68/1116391868.db2.gz QGHBGRWDBKEVGF-CQSZACIVSA-N 1 1 368.462 4.088 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)o1 ZINC000539897044 1117739979 /nfs/dbraw/zinc/73/99/79/1117739979.db2.gz XWYSYPLQAJPZBQ-JKSUJKDBSA-N 1 1 356.422 4.103 20 5 FIBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000462786829 1117771139 /nfs/dbraw/zinc/77/11/39/1117771139.db2.gz CKDGUKIPQHRYBM-OKILXGFUSA-N 1 1 371.428 4.366 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000462826991 1117798852 /nfs/dbraw/zinc/79/88/52/1117798852.db2.gz RWCWCBLQUURQSN-OQLLNIDSSA-N 1 1 350.418 4.251 20 5 FIBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000463189539 1118006859 /nfs/dbraw/zinc/00/68/59/1118006859.db2.gz ATIASSCSAWWBQR-VOQHCJDSSA-N 1 1 368.424 4.025 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccc(OC(F)F)c1 ZINC000122417406 1118435034 /nfs/dbraw/zinc/43/50/34/1118435034.db2.gz CDNROKORNXGKTQ-LLVKDONJSA-N 1 1 352.337 4.056 20 5 FIBDMO CCc1ccc([C@@H](NCCC2CC[NH+](C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541544283 1118549585 /nfs/dbraw/zinc/54/95/85/1118549585.db2.gz SPXMHZBSZLVNSY-NRFANRHFSA-N 1 1 371.481 4.161 20 5 FIBDMO C[N@H+](CCc1ccccc1O)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000541552143 1118560209 /nfs/dbraw/zinc/56/02/09/1118560209.db2.gz UPONAKVQJLTAIM-UHFFFAOYSA-N 1 1 369.446 4.098 20 5 FIBDMO C[N@@H+](CCc1ccccc1O)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000541552143 1118560212 /nfs/dbraw/zinc/56/02/12/1118560212.db2.gz UPONAKVQJLTAIM-UHFFFAOYSA-N 1 1 369.446 4.098 20 5 FIBDMO COc1cc(C[NH2+][C@H](C)c2ccccc2OC(F)F)c([N+](=O)[O-])cc1F ZINC000464492411 1118581760 /nfs/dbraw/zinc/58/17/60/1118581760.db2.gz CRUBAXLUCDMLHS-SNVBAGLBSA-N 1 1 370.327 4.195 20 5 FIBDMO COc1ccc(OCC[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2F)c([N+](=O)[O-])c1 ZINC000464727294 1118674334 /nfs/dbraw/zinc/67/43/34/1118674334.db2.gz VFZXZPRKYLSQRZ-RDTXWAMCSA-N 1 1 374.412 4.204 20 5 FIBDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000172841689 1118983067 /nfs/dbraw/zinc/98/30/67/1118983067.db2.gz XZELXXQQAYWHGF-GOSISDBHSA-N 1 1 361.489 4.334 20 5 FIBDMO CCOc1cc(C[N@@H+](CC)Cc2ccc(OC)c(OC)c2)ccc1[N+](=O)[O-] ZINC000492415903 1119086120 /nfs/dbraw/zinc/08/61/20/1119086120.db2.gz IDDCHGODOCUYHR-UHFFFAOYSA-N 1 1 374.437 4.033 20 5 FIBDMO Cc1ccccc1[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000272101353 1119173632 /nfs/dbraw/zinc/17/36/32/1119173632.db2.gz ZUCGJOVNRZUACB-LJQANCHMSA-N 1 1 364.405 4.194 20 5 FIBDMO COc1ccc2c(c1OC)CC[N@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000492756663 1119184174 /nfs/dbraw/zinc/18/41/74/1119184174.db2.gz KQMGNWXIYPVGNB-CQSZACIVSA-N 1 1 356.422 4.040 20 5 FIBDMO COc1ccc2c(c1OC)CC[N@@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000492756663 1119184176 /nfs/dbraw/zinc/18/41/76/1119184176.db2.gz KQMGNWXIYPVGNB-CQSZACIVSA-N 1 1 356.422 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Br)cc2F)cc1Cl ZINC000761527951 1119410088 /nfs/dbraw/zinc/41/00/88/1119410088.db2.gz VKFRWJGIXBLLDA-UHFFFAOYSA-N 1 1 373.609 4.440 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1nc3cc([N+](=O)[O-])ccc3o1)CCC2 ZINC000152564770 1119451043 /nfs/dbraw/zinc/45/10/43/1119451043.db2.gz VGOGGSXVWVCTFI-CQSZACIVSA-N 1 1 372.450 4.264 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1nc3cc([N+](=O)[O-])ccc3o1)CCC2 ZINC000152564770 1119451045 /nfs/dbraw/zinc/45/10/45/1119451045.db2.gz VGOGGSXVWVCTFI-CQSZACIVSA-N 1 1 372.450 4.264 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000493904778 1119504228 /nfs/dbraw/zinc/50/42/28/1119504228.db2.gz FHGUCKHRLIUZII-DOTOQJQBSA-N 1 1 368.767 4.146 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cn3cc(Cl)ccc3n2)cc1[N+](=O)[O-] ZINC000152805838 1119506057 /nfs/dbraw/zinc/50/60/57/1119506057.db2.gz CUDKTAHYFALVJH-GFCCVEGCSA-N 1 1 374.828 4.145 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000494294353 1119822787 /nfs/dbraw/zinc/82/27/87/1119822787.db2.gz YQZRLWOHZGEFGK-PTNGSMBKSA-N 1 1 364.405 4.180 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000494294353 1119822794 /nfs/dbraw/zinc/82/27/94/1119822794.db2.gz YQZRLWOHZGEFGK-PTNGSMBKSA-N 1 1 364.405 4.180 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000495239679 1120565141 /nfs/dbraw/zinc/56/51/41/1120565141.db2.gz AXLZFRQQQMTMIL-LBPRGKRZSA-N 1 1 352.431 4.257 20 5 FIBDMO O=C(c1ccc(F)cc1)C1CC[NH+](CC=Cc2ccccc2[N+](=O)[O-])CC1 ZINC000193419319 1120884144 /nfs/dbraw/zinc/88/41/44/1120884144.db2.gz DZTFJTWKLYOPEA-HWKANZROSA-N 1 1 368.408 4.342 20 5 FIBDMO C[C@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)[N@H+]1CCc2sccc2C1 ZINC000301081253 1120974915 /nfs/dbraw/zinc/97/49/15/1120974915.db2.gz GMXJUIZYRNADHY-CYBMUJFWSA-N 1 1 368.462 4.063 20 5 FIBDMO CC1CCC([N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C2CC2)CC1 ZINC000076745990 1121071437 /nfs/dbraw/zinc/07/14/37/1121071437.db2.gz SKGLZANUCGJOSY-UHFFFAOYSA-N 1 1 356.426 4.188 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000916146965 1121428349 /nfs/dbraw/zinc/42/83/49/1121428349.db2.gz CTORZXUGMXIFFO-UHFFFAOYSA-N 1 1 361.829 4.099 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000301510028 1122193186 /nfs/dbraw/zinc/19/31/86/1122193186.db2.gz DXNNHVSAUJQYRD-OXJNMPFZSA-N 1 1 369.465 4.064 20 5 FIBDMO CC(=O)c1ccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000301597022 1122230406 /nfs/dbraw/zinc/23/04/06/1122230406.db2.gz SQPYLYDHCRMHGV-DNVCBOLYSA-N 1 1 367.449 4.120 20 5 FIBDMO CC[C@@H](C)[N@H+](Cc1ccccc1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000917455593 1122320723 /nfs/dbraw/zinc/32/07/23/1122320723.db2.gz YTHHUFJUVPJRPQ-MRXNPFEDSA-N 1 1 365.437 4.112 20 5 FIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cn1cnc2cc(F)c(F)cc21 ZINC000919950725 1123279460 /nfs/dbraw/zinc/27/94/60/1123279460.db2.gz QYVVAIKKEKZNDN-UHFFFAOYSA-N 1 1 360.364 4.091 20 5 FIBDMO O=[N+]([O-])c1c(F)cccc1N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000919963287 1123288244 /nfs/dbraw/zinc/28/82/44/1123288244.db2.gz XAEAIIIBKBGSJV-UHFFFAOYSA-N 1 1 363.820 4.100 20 5 FIBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000609432182 1123712608 /nfs/dbraw/zinc/71/26/08/1123712608.db2.gz QLCURHQTSXURHK-HNNXBMFYSA-N 1 1 358.438 4.065 20 5 FIBDMO Cc1c(NC(=O)NC[C@H]2CCC[N@H+]2CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000609451553 1123717832 /nfs/dbraw/zinc/71/78/32/1123717832.db2.gz GLBCDRCXKZVRDP-QGZVFWFLSA-N 1 1 374.485 4.069 20 5 FIBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000609625696 1123773687 /nfs/dbraw/zinc/77/36/87/1123773687.db2.gz PBGDEOTZNFSXNI-LJQANCHMSA-N 1 1 367.449 4.241 20 5 FIBDMO COc1ccccc1C[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705248 1123803298 /nfs/dbraw/zinc/80/32/98/1123803298.db2.gz LUDDTWXPIVNZIM-QGZVFWFLSA-N 1 1 360.841 4.464 20 5 FIBDMO COc1cccc(C[C@H]2CCC[N@H+]2Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000609705230 1123803571 /nfs/dbraw/zinc/80/35/71/1123803571.db2.gz ISJDNCABOJZHLH-QGZVFWFLSA-N 1 1 360.841 4.464 20 5 FIBDMO CCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000610133379 1123950062 /nfs/dbraw/zinc/95/00/62/1123950062.db2.gz LSIDWHKNGZJGKI-DJIMGWMZSA-N 1 1 352.862 4.274 20 5 FIBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000615834555 1124127596 /nfs/dbraw/zinc/12/75/96/1124127596.db2.gz ODFUOJQMOZWTMX-WBILKINKSA-N 1 1 360.454 4.053 20 5 FIBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542853565 1124467069 /nfs/dbraw/zinc/46/70/69/1124467069.db2.gz GCMNJFTXCYWSCT-MGPUTAFESA-N 1 1 354.454 4.007 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cccnc2OC2CCCC2)cc1[N+](=O)[O-] ZINC000153884111 1124811040 /nfs/dbraw/zinc/81/10/40/1124811040.db2.gz JDVVAETUMAVDQC-OAHLLOKOSA-N 1 1 355.438 4.470 20 5 FIBDMO Cc1c([C@@H](C)[NH2+]Cc2cccnc2OC2CCCC2)cccc1[N+](=O)[O-] ZINC000153887262 1124811121 /nfs/dbraw/zinc/81/11/21/1124811121.db2.gz GGRHMVBEWZUVMM-OAHLLOKOSA-N 1 1 355.438 4.470 20 5 FIBDMO CN(Cc1ccc([N+](=O)[O-])cc1Cl)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542927568 1124879382 /nfs/dbraw/zinc/87/93/82/1124879382.db2.gz MALLDPUIWJSNJV-KRWDZBQOSA-N 1 1 373.884 4.202 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)cc1C(F)(F)F ZINC000715721248 1125041814 /nfs/dbraw/zinc/04/18/14/1125041814.db2.gz KWWDCAAOVKCGTC-HNNXBMFYSA-N 1 1 365.355 4.300 20 5 FIBDMO C[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311547106 1125186172 /nfs/dbraw/zinc/18/61/72/1125186172.db2.gz OUOZAOGHOCYDRE-QAPCUYQASA-N 1 1 373.884 4.248 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1C(F)(F)F ZINC000301776737 1125263944 /nfs/dbraw/zinc/26/39/44/1125263944.db2.gz LLQAUAVFXAEFDR-WBMJQRKESA-N 1 1 369.387 4.067 20 5 FIBDMO CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000109407172 206056151 /nfs/dbraw/zinc/05/61/51/206056151.db2.gz BVZQDYOXHUBILL-QGZVFWFLSA-N 1 1 361.489 4.238 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ncc(-c2ccccc2)n1C ZINC000453080013 568389429 /nfs/dbraw/zinc/38/94/29/568389429.db2.gz YONLSXPMWVPLPZ-HUUCEWRRSA-N 1 1 350.422 4.407 20 5 FIBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc2ccccc2c1 ZINC000032512322 568393655 /nfs/dbraw/zinc/39/36/55/568393655.db2.gz OHUCSBATNUKLBI-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc2ccccc2c1 ZINC000032512322 568393656 /nfs/dbraw/zinc/39/36/56/568393656.db2.gz OHUCSBATNUKLBI-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO Cc1cccc([C@H]2CC[N@H+]([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000569386204 568400100 /nfs/dbraw/zinc/40/01/00/568400100.db2.gz WFRQKJITAOBGRX-WMZOPIPTSA-N 1 1 367.449 4.028 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000619722861 1125669931 /nfs/dbraw/zinc/66/99/31/1125669931.db2.gz HVUWWALHSVRWKM-OAHLLOKOSA-N 1 1 374.872 4.161 20 5 FIBDMO Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000183145701 1125756958 /nfs/dbraw/zinc/75/69/58/1125756958.db2.gz MLKWOAAYYZNAAU-CYBMUJFWSA-N 1 1 354.385 4.079 20 5 FIBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)COC(C)C ZINC001143372497 1079686573 /nfs/dbraw/zinc/68/65/73/1079686573.db2.gz PGDZAGBCVNEBIS-UHFFFAOYSA-N 1 1 351.450 4.126 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000430222992 1080017171 /nfs/dbraw/zinc/01/71/71/1080017171.db2.gz VORPZRCIKYEFSH-XLIONFOSSA-N 1 1 374.412 4.095 20 5 FIBDMO Cc1c(C(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000157646450 1080050714 /nfs/dbraw/zinc/05/07/14/1080050714.db2.gz NXPABBGTCVAUAU-INIZCTEOSA-N 1 1 373.497 4.020 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000157669472 1080064881 /nfs/dbraw/zinc/06/48/81/1080064881.db2.gz XJQQBRAYNSJCKQ-QGZVFWFLSA-N 1 1 373.497 4.020 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccc3ccccc3n2)CC1 ZINC000471193209 1080205834 /nfs/dbraw/zinc/20/58/34/1080205834.db2.gz BOWLSAJOZFMJJI-MRXNPFEDSA-N 1 1 362.433 4.026 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000134450218 1080232327 /nfs/dbraw/zinc/23/23/27/1080232327.db2.gz JEQYOWLWROEZRE-GFCCVEGCSA-N 1 1 371.384 4.450 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccccc1)CC1CCC1 ZINC001167158357 1080763802 /nfs/dbraw/zinc/76/38/02/1080763802.db2.gz UBAWIRZNYZERJJ-UHFFFAOYSA-N 1 1 367.449 4.144 20 5 FIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)c1cccc(OC)c1 ZINC000083175661 1081284884 /nfs/dbraw/zinc/28/48/84/1081284884.db2.gz GYKRUGVOEBPKAU-ZDUSSCGKSA-N 1 1 355.394 4.328 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572152 1081301283 /nfs/dbraw/zinc/30/12/83/1081301283.db2.gz ZIWWHNYUWCDCKP-QUCCMNQESA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572152 1081301289 /nfs/dbraw/zinc/30/12/89/1081301289.db2.gz ZIWWHNYUWCDCKP-QUCCMNQESA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572152 1081301294 /nfs/dbraw/zinc/30/12/94/1081301294.db2.gz ZIWWHNYUWCDCKP-QUCCMNQESA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c(CNC[C@@H](c2ccccc2)[NH+]2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC001648895533 1081352898 /nfs/dbraw/zinc/35/28/98/1081352898.db2.gz RYRSNRIQGPADLF-QFIPXVFZSA-N 1 1 367.493 4.466 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000175827178 1081369252 /nfs/dbraw/zinc/36/92/52/1081369252.db2.gz VKBYHJYIYZLYSV-HOCLYGCPSA-N 1 1 366.870 4.398 20 5 FIBDMO COc1ccccc1[C@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001167331821 1081451672 /nfs/dbraw/zinc/45/16/72/1081451672.db2.gz ATXLVVNPLRXNLZ-LJQANCHMSA-N 1 1 356.422 4.209 20 5 FIBDMO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083199343 1081547773 /nfs/dbraw/zinc/54/77/73/1081547773.db2.gz JVORSEZERNLEFY-JSGCOSHPSA-N 1 1 355.369 4.253 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](CCc2ccc(Cl)cc2)CC2CC2)c1 ZINC001167376299 1081812415 /nfs/dbraw/zinc/81/24/15/1081812415.db2.gz IQWCQTKDXRTBPT-FQEVSTJZSA-N 1 1 374.868 4.236 20 5 FIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000610476342 1082300516 /nfs/dbraw/zinc/30/05/16/1082300516.db2.gz OKXFMBDBWPSEGS-XLIONFOSSA-N 1 1 358.413 4.334 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC001167464445 1082593516 /nfs/dbraw/zinc/59/35/16/1082593516.db2.gz MAFZDWSPNGDUFQ-BRWVUGGUSA-N 1 1 367.449 4.108 20 5 FIBDMO CCOc1ccc([C@@H]2CCC[N@@H+]2Cn2ncc3ccc([N+](=O)[O-])cc32)cc1 ZINC000023855448 1082669679 /nfs/dbraw/zinc/66/96/79/1082669679.db2.gz HWNPUWASPZNLIP-IBGZPJMESA-N 1 1 366.421 4.138 20 5 FIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cn2ncc3ccc([N+](=O)[O-])cc32)cc1 ZINC000023855448 1082669681 /nfs/dbraw/zinc/66/96/81/1082669681.db2.gz HWNPUWASPZNLIP-IBGZPJMESA-N 1 1 366.421 4.138 20 5 FIBDMO COc1cc(C[N@@H+](C)CC2CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000510440257 1082733524 /nfs/dbraw/zinc/73/35/24/1082733524.db2.gz CKMGBMRUGCKQIV-UHFFFAOYSA-N 1 1 356.422 4.024 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000055909886 1082927155 /nfs/dbraw/zinc/92/71/55/1082927155.db2.gz OMHHFQXADGPNIM-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000055909886 1082927159 /nfs/dbraw/zinc/92/71/59/1082927159.db2.gz OMHHFQXADGPNIM-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000055909885 1082927281 /nfs/dbraw/zinc/92/72/81/1082927281.db2.gz OMHHFQXADGPNIM-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000055909885 1082927284 /nfs/dbraw/zinc/92/72/84/1082927284.db2.gz OMHHFQXADGPNIM-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@@H+](C)Cc2ccco2)n1 ZINC000178236690 1083001334 /nfs/dbraw/zinc/00/13/34/1083001334.db2.gz FIOWZUNCWVYSPJ-UHFFFAOYSA-N 1 1 366.421 4.135 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3CCc3ccccc3)nc2c1 ZINC000610581206 1083210386 /nfs/dbraw/zinc/21/03/86/1083210386.db2.gz NEZBEDLYAQGWMM-MRXNPFEDSA-N 1 1 351.406 4.333 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCO[C@H]4CCC[C@H]43)o2)c(Cl)c1 ZINC000430876870 1083216764 /nfs/dbraw/zinc/21/67/64/1083216764.db2.gz HQHPFUIRRDJQRL-AEFFLSMTSA-N 1 1 362.813 4.262 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCO[C@H]4CCC[C@H]43)o2)c(Cl)c1 ZINC000430876870 1083216766 /nfs/dbraw/zinc/21/67/66/1083216766.db2.gz HQHPFUIRRDJQRL-AEFFLSMTSA-N 1 1 362.813 4.262 20 5 FIBDMO Cc1ccc(C[N@H+](C)Cc2csc(Br)c2)cc1[N+](=O)[O-] ZINC000510683786 1083237660 /nfs/dbraw/zinc/23/76/60/1083237660.db2.gz RLTIPNHQCHCWAZ-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO Cc1ccc(C[N@@H+](C)Cc2csc(Br)c2)cc1[N+](=O)[O-] ZINC000510683786 1083237663 /nfs/dbraw/zinc/23/76/63/1083237663.db2.gz RLTIPNHQCHCWAZ-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000430941357 1083244282 /nfs/dbraw/zinc/24/42/82/1083244282.db2.gz WAXOMFYPGICAMG-MJGOQNOKSA-N 1 1 354.450 4.380 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CCO[C@H]2c2ccc(Cl)cc2)c(F)c1 ZINC000510799930 1083317225 /nfs/dbraw/zinc/31/72/25/1083317225.db2.gz XKUZTTWESFONBT-SJORKVTESA-N 1 1 368.767 4.146 20 5 FIBDMO O=[N+]([O-])c1ccccc1N1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000535692061 1083582791 /nfs/dbraw/zinc/58/27/91/1083582791.db2.gz RSTCWDVSAFYHDX-UHFFFAOYSA-N 1 1 351.450 4.087 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(Cc2ccccc2)n1 ZINC000548928801 1083778512 /nfs/dbraw/zinc/77/85/12/1083778512.db2.gz WDIZLJAFQLVPMO-UHFFFAOYSA-N 1 1 367.474 4.317 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(Cc2ccccc2)n1 ZINC000548928801 1083778520 /nfs/dbraw/zinc/77/85/20/1083778520.db2.gz WDIZLJAFQLVPMO-UHFFFAOYSA-N 1 1 367.474 4.317 20 5 FIBDMO CC(C)N1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000236603612 1083811145 /nfs/dbraw/zinc/81/11/45/1083811145.db2.gz ZKMLUNMRLCKHFI-UHFFFAOYSA-N 1 1 359.495 4.286 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCCC[C@H]1C[C@@H](O)c1ccco1 ZINC000177451332 1083970222 /nfs/dbraw/zinc/97/02/22/1083970222.db2.gz PDBHFLMGZDKSQM-FUHWJXTLSA-N 1 1 362.401 4.195 20 5 FIBDMO CCC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(C)cc1 ZINC000611565497 1084229073 /nfs/dbraw/zinc/22/90/73/1084229073.db2.gz MHZBHGQHKNZNMZ-UHFFFAOYSA-N 1 1 366.421 4.365 20 5 FIBDMO CCC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(C)cc1 ZINC000611565497 1084229083 /nfs/dbraw/zinc/22/90/83/1084229083.db2.gz MHZBHGQHKNZNMZ-UHFFFAOYSA-N 1 1 366.421 4.365 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H]1c2ccccc2CC12CCOCC2 ZINC000582151290 1084716316 /nfs/dbraw/zinc/71/63/16/1084716316.db2.gz QTKBFJGVCDPCLG-LJQANCHMSA-N 1 1 372.852 4.432 20 5 FIBDMO COc1cc(C[N@@H+](Cc2ccc(C)s2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000511838677 1085123099 /nfs/dbraw/zinc/12/30/99/1085123099.db2.gz PRJJWUUHODMNIW-UHFFFAOYSA-N 1 1 364.467 4.393 20 5 FIBDMO CCC(=O)c1ccc(NCc2cccc(C[N@H+](C)CC)c2)c([N+](=O)[O-])c1 ZINC000479375822 1085155915 /nfs/dbraw/zinc/15/59/15/1085155915.db2.gz HATHXWGGVAMWIC-UHFFFAOYSA-N 1 1 355.438 4.251 20 5 FIBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1c1ccccc1 ZINC000582878289 1085869792 /nfs/dbraw/zinc/86/97/92/1085869792.db2.gz OTKHWMIMVJSMJG-OXJNMPFZSA-N 1 1 367.449 4.049 20 5 FIBDMO Cc1noc([C@H]2CCC[N@@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n1 ZINC000582991896 1085995788 /nfs/dbraw/zinc/99/57/88/1085995788.db2.gz JKWCXPUPLZESPB-MRXNPFEDSA-N 1 1 370.434 4.352 20 5 FIBDMO Cc1noc([C@H]2CCC[N@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n1 ZINC000582991896 1085995793 /nfs/dbraw/zinc/99/57/93/1085995793.db2.gz JKWCXPUPLZESPB-MRXNPFEDSA-N 1 1 370.434 4.352 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2CCc2ccccc2)c2c(c1)COCO2 ZINC000052106017 1086205251 /nfs/dbraw/zinc/20/52/51/1086205251.db2.gz VOTVCVUJSFQRSS-LJQANCHMSA-N 1 1 368.433 4.059 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1cccc(OCC(F)(F)F)c1)C2 ZINC000536000985 1086595890 /nfs/dbraw/zinc/59/58/90/1086595890.db2.gz XVRXWISEEWOQBF-UHFFFAOYSA-N 1 1 366.339 4.094 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1cccc(OCC(F)(F)F)c1)C2 ZINC000536000985 1086595895 /nfs/dbraw/zinc/59/58/95/1086595895.db2.gz XVRXWISEEWOQBF-UHFFFAOYSA-N 1 1 366.339 4.094 20 5 FIBDMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000585754354 1086686978 /nfs/dbraw/zinc/68/69/78/1086686978.db2.gz JHZRXOPXNGQWIR-UHFFFAOYSA-N 1 1 361.829 4.054 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C(C)(C)c1ccccc1 ZINC000585754380 1086687002 /nfs/dbraw/zinc/68/70/02/1086687002.db2.gz KXPORKFEEWHDNI-UHFFFAOYSA-N 1 1 355.438 4.099 20 5 FIBDMO Cc1cc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000157612424 1086954307 /nfs/dbraw/zinc/95/43/07/1086954307.db2.gz HDETZBUWTLVSGL-KRWDZBQOSA-N 1 1 373.497 4.020 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000052611827 1086985100 /nfs/dbraw/zinc/98/51/00/1086985100.db2.gz ASFYZFCRDFFMPN-ZDUSSCGKSA-N 1 1 355.369 4.255 20 5 FIBDMO COc1cc(C[NH2+][C@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])cc1OC ZINC000584022810 1087115166 /nfs/dbraw/zinc/11/51/66/1087115166.db2.gz JJOAABPSUQWPAH-NSHDSACASA-N 1 1 368.842 4.104 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000052795438 1087162442 /nfs/dbraw/zinc/16/24/42/1087162442.db2.gz MUMBWEGVIBGJGV-MRXNPFEDSA-N 1 1 367.449 4.142 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCC3CCCC3)CC2)c(Cl)c1 ZINC000543856038 1087601086 /nfs/dbraw/zinc/60/10/86/1087601086.db2.gz FVAIZMWOHIDQQK-UHFFFAOYSA-N 1 1 352.862 4.419 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000472357975 1087783482 /nfs/dbraw/zinc/78/34/82/1087783482.db2.gz DGLLIFQKGSXHGF-VLIAUNLRSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000472357975 1087783491 /nfs/dbraw/zinc/78/34/91/1087783491.db2.gz DGLLIFQKGSXHGF-VLIAUNLRSA-N 1 1 371.412 4.064 20 5 FIBDMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1cc2ccccc2c2cccnc12 ZINC000434422130 1088612294 /nfs/dbraw/zinc/61/22/94/1088612294.db2.gz PAHMLRILYVNODF-SFHVURJKSA-N 1 1 359.473 4.135 20 5 FIBDMO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000434615075 1088856489 /nfs/dbraw/zinc/85/64/89/1088856489.db2.gz LVEACTDSWBJEJJ-FQEVSTJZSA-N 1 1 373.428 4.026 20 5 FIBDMO CC(C)[C@@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000434616224 1088866000 /nfs/dbraw/zinc/86/60/00/1088866000.db2.gz PGCUQLFOHVTZMA-IBGZPJMESA-N 1 1 359.401 4.002 20 5 FIBDMO C[C@@]12CC[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]1C2(F)F ZINC000430107237 1088994847 /nfs/dbraw/zinc/99/48/47/1088994847.db2.gz RNFOTFOWCMMWGM-GOEBONIOSA-N 1 1 365.405 4.195 20 5 FIBDMO C[C@@]12CC[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]1C2(F)F ZINC000430107237 1088994855 /nfs/dbraw/zinc/99/48/55/1088994855.db2.gz RNFOTFOWCMMWGM-GOEBONIOSA-N 1 1 365.405 4.195 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000434751048 1089029134 /nfs/dbraw/zinc/02/91/34/1089029134.db2.gz BGNXUBDOPQKKBX-INIZCTEOSA-N 1 1 355.438 4.152 20 5 FIBDMO C[C@H]1[C@H](Cc2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000435039233 1089214989 /nfs/dbraw/zinc/21/49/89/1089214989.db2.gz CQVYDKANKNFWMC-HOCLYGCPSA-N 1 1 351.406 4.189 20 5 FIBDMO C[C@H]1[C@@H](Cc2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000435039232 1089215986 /nfs/dbraw/zinc/21/59/86/1089215986.db2.gz CQVYDKANKNFWMC-GOEBONIOSA-N 1 1 351.406 4.189 20 5 FIBDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000505598204 1089253435 /nfs/dbraw/zinc/25/34/35/1089253435.db2.gz YFWQYFLPUIDPEP-WCQYABFASA-N 1 1 358.385 4.010 20 5 FIBDMO Cn1cc(C[N@H+]2CCC[C@H]2C2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000511523445 1089285362 /nfs/dbraw/zinc/28/53/62/1089285362.db2.gz NXDLLGXWMYMHFZ-IBGZPJMESA-N 1 1 354.454 4.150 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CC[C@H](c3ccccc3)O2)C2CC2)c1 ZINC001167733820 1090265291 /nfs/dbraw/zinc/26/52/91/1090265291.db2.gz DPRXKLRFLYDXOI-NHCUHLMSSA-N 1 1 352.434 4.480 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCCC3(CCOCC3)C2)c1 ZINC000566574583 1091059678 /nfs/dbraw/zinc/05/96/78/1091059678.db2.gz MLDGZXMLIYFSEA-UHFFFAOYSA-N 1 1 358.360 4.006 20 5 FIBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000467218089 1091331421 /nfs/dbraw/zinc/33/14/21/1091331421.db2.gz NZHHZOFTTZXFCV-OAQYLSRUSA-N 1 1 368.433 4.059 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)c2ccc(Cl)c(F)c2)C2CC2)cc1 ZINC000759854457 1091337341 /nfs/dbraw/zinc/33/73/41/1091337341.db2.gz XHSNFIRPTVRCHS-SFHVURJKSA-N 1 1 364.804 4.085 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000053722072 1091418449 /nfs/dbraw/zinc/41/84/49/1091418449.db2.gz GRVXJSAXNSOXLM-CYBMUJFWSA-N 1 1 359.451 4.283 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000511759285 1091626662 /nfs/dbraw/zinc/62/66/62/1091626662.db2.gz TUVXCFMSSPSRMK-SUMDDJOVSA-N 1 1 372.852 4.253 20 5 FIBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])nc2)C1 ZINC000549512417 1091632401 /nfs/dbraw/zinc/63/24/01/1091632401.db2.gz CPDHQWHRRYWFQW-IYBDPMFKSA-N 1 1 354.454 4.080 20 5 FIBDMO C[C@H](C[N@@H+](C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)c1ccccc1 ZINC000728900142 1091814717 /nfs/dbraw/zinc/81/47/17/1091814717.db2.gz FPPGFAHZUZMPLD-MRXNPFEDSA-N 1 1 350.422 4.151 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@]3(CC=CCC3)C2)cccc1[N+](=O)[O-] ZINC000512213601 1091917561 /nfs/dbraw/zinc/91/75/61/1091917561.db2.gz ODHCDCKRBCFTSI-UZLBHIALSA-N 1 1 357.454 4.053 20 5 FIBDMO C[C@@H](c1ccccc1)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000512292726 1092014192 /nfs/dbraw/zinc/01/41/92/1092014192.db2.gz JCSMQRMULKMUGN-ZDUSSCGKSA-N 1 1 373.840 4.412 20 5 FIBDMO C[C@@H](c1ccccc1)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000512292726 1092014203 /nfs/dbraw/zinc/01/42/03/1092014203.db2.gz JCSMQRMULKMUGN-ZDUSSCGKSA-N 1 1 373.840 4.412 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2CC(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000500454805 1092089890 /nfs/dbraw/zinc/08/98/90/1092089890.db2.gz FDNVORMZWVNPIP-ZDUSSCGKSA-N 1 1 358.385 4.215 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000279949720 1092656841 /nfs/dbraw/zinc/65/68/41/1092656841.db2.gz BPIFAOBRUHQVPN-WDEREUQCSA-N 1 1 350.216 4.164 20 5 FIBDMO CCOC(=O)C1CCC([N@@H+](CC)C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000549825584 1092858456 /nfs/dbraw/zinc/85/84/56/1092858456.db2.gz SRSNHSHHFVBUQO-SSZFMOIBSA-N 1 1 374.481 4.442 20 5 FIBDMO Cc1cccc(C(C)C)c1NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000573545726 1092938622 /nfs/dbraw/zinc/93/86/22/1092938622.db2.gz ISNUVEWQAGYAMR-UHFFFAOYSA-N 1 1 369.465 4.140 20 5 FIBDMO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000573545726 1092938629 /nfs/dbraw/zinc/93/86/29/1092938629.db2.gz ISNUVEWQAGYAMR-UHFFFAOYSA-N 1 1 369.465 4.140 20 5 FIBDMO C[N@@H+](CCSc1ccc2ncccc2c1[N+](=O)[O-])Cc1ccccc1 ZINC000432915037 1092939304 /nfs/dbraw/zinc/93/93/04/1092939304.db2.gz CMAVCWPNMJHPQT-UHFFFAOYSA-N 1 1 353.447 4.367 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](c2nc3ccc(F)cc3o2)C1 ZINC000443639579 1093365188 /nfs/dbraw/zinc/36/51/88/1093365188.db2.gz LGLYZAVMRIWMAW-LBPRGKRZSA-N 1 1 373.359 4.394 20 5 FIBDMO COCC[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000467272170 1093389730 /nfs/dbraw/zinc/38/97/30/1093389730.db2.gz YTLIWWJUVFVXAK-MRXNPFEDSA-N 1 1 350.459 4.021 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000397991351 1093799838 /nfs/dbraw/zinc/79/98/38/1093799838.db2.gz ASGUQIKSZWTBSC-LQWHRVPQSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000397991351 1093799842 /nfs/dbraw/zinc/79/98/42/1093799842.db2.gz ASGUQIKSZWTBSC-LQWHRVPQSA-N 1 1 367.493 4.464 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1c(Cl)cccc1[N+](=O)[O-] ZINC000397988077 1093805344 /nfs/dbraw/zinc/80/53/44/1093805344.db2.gz PEEVHPFSIHJGLR-BEFAXECRSA-N 1 1 373.884 4.248 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473508576 1093895450 /nfs/dbraw/zinc/89/54/50/1093895450.db2.gz NYUXFJDRPCFXQO-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cnc(-c3ccncc3)s2)c(Cl)c1 ZINC000466468159 1093900974 /nfs/dbraw/zinc/90/09/74/1093900974.db2.gz BRIHBPSGISNEEW-UHFFFAOYSA-N 1 1 360.826 4.057 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000513242609 1094033690 /nfs/dbraw/zinc/03/36/90/1094033690.db2.gz VBFNSVOJMDSKPQ-RDTXWAMCSA-N 1 1 364.405 4.228 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513246818 1094034053 /nfs/dbraw/zinc/03/40/53/1094034053.db2.gz DDEDYOHJOWZZQY-YWZLYKJASA-N 1 1 367.449 4.315 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513272321 1094043249 /nfs/dbraw/zinc/04/32/49/1094043249.db2.gz QNAGCWYQFRODRF-DNVCBOLYSA-N 1 1 353.422 4.007 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(Br)cn1 ZINC000280188846 1094300758 /nfs/dbraw/zinc/30/07/58/1094300758.db2.gz SAOOCJATJXHQGI-WDEREUQCSA-N 1 1 350.216 4.164 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000501080897 1094496330 /nfs/dbraw/zinc/49/63/30/1094496330.db2.gz ZFHDVTDJVIJRFV-CQSZACIVSA-N 1 1 359.401 4.146 20 5 FIBDMO CC[C@H]([NH2+][C@@H](c1cnn(C)c1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000366679739 1095081179 /nfs/dbraw/zinc/08/11/79/1095081179.db2.gz OARPXBACMUNQIB-VQTJNVASSA-N 1 1 350.422 4.159 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C2CCCC2)C1 ZINC000420959451 1095199719 /nfs/dbraw/zinc/19/97/19/1095199719.db2.gz DZJFBIIEDPQCMH-CJNGLKHVSA-N 1 1 356.426 4.218 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](C2CCCC2)C1 ZINC000420959449 1095200561 /nfs/dbraw/zinc/20/05/61/1095200561.db2.gz DZJFBIIEDPQCMH-BBRMVZONSA-N 1 1 356.426 4.218 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000502342896 1095378382 /nfs/dbraw/zinc/37/83/82/1095378382.db2.gz DGKBNSLFCIGBPF-MTIYJEKLSA-N 1 1 366.465 4.020 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000444162359 1095795658 /nfs/dbraw/zinc/79/56/58/1095795658.db2.gz AAITYKCCZGPGNG-YJYMSZOUSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000444162359 1095795668 /nfs/dbraw/zinc/79/56/68/1095795668.db2.gz AAITYKCCZGPGNG-YJYMSZOUSA-N 1 1 371.412 4.064 20 5 FIBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502937490 1095979633 /nfs/dbraw/zinc/97/96/33/1095979633.db2.gz FNOHIKUZOSCNTQ-INIZCTEOSA-N 1 1 355.438 4.224 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000503437664 1096402646 /nfs/dbraw/zinc/40/26/46/1096402646.db2.gz FOINJGUOMDBYGI-CQSZACIVSA-N 1 1 374.872 4.161 20 5 FIBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000532976727 1098645998 /nfs/dbraw/zinc/64/59/98/1098645998.db2.gz DIZJOFZAMWRSEG-MRXNPFEDSA-N 1 1 355.438 4.152 20 5 FIBDMO CCN(Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000505790631 1098913505 /nfs/dbraw/zinc/91/35/05/1098913505.db2.gz ODYPRGROIRYNKV-AEFFLSMTSA-N 1 1 371.456 4.391 20 5 FIBDMO CC[N@@H+](C)Cc1cccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])c1 ZINC000436316507 1098922646 /nfs/dbraw/zinc/92/26/46/1098922646.db2.gz XJBLPIBNKXBMIT-UHFFFAOYSA-N 1 1 368.359 4.072 20 5 FIBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)c1 ZINC000515770780 1098923190 /nfs/dbraw/zinc/92/31/90/1098923190.db2.gz XIDPLEDUMYMJND-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)c1 ZINC000515770780 1098923196 /nfs/dbraw/zinc/92/31/96/1098923196.db2.gz XIDPLEDUMYMJND-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO CCCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000533289393 1098938940 /nfs/dbraw/zinc/93/89/40/1098938940.db2.gz IFBFBZYVPCZZRZ-HNNXBMFYSA-N 1 1 355.438 4.057 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+](C)Cc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000026343139 1099571025 /nfs/dbraw/zinc/57/10/25/1099571025.db2.gz UWDCGMVUXFVJMN-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)Cc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000026343139 1099571041 /nfs/dbraw/zinc/57/10/41/1099571041.db2.gz UWDCGMVUXFVJMN-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516926245 1099936598 /nfs/dbraw/zinc/93/65/98/1099936598.db2.gz HJNOEFSJHGLYNP-FXAWDEMLSA-N 1 1 365.477 4.443 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516926245 1099936600 /nfs/dbraw/zinc/93/66/00/1099936600.db2.gz HJNOEFSJHGLYNP-FXAWDEMLSA-N 1 1 365.477 4.443 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2c[nH]nc2-c2ccsc2)C2CC2)c1 ZINC000437574413 1099995261 /nfs/dbraw/zinc/99/52/61/1099995261.db2.gz FINGXGVRHQCLGK-UHFFFAOYSA-N 1 1 354.435 4.211 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000459653835 1100396576 /nfs/dbraw/zinc/39/65/76/1100396576.db2.gz DMSAQAWKKGDCQQ-BBRMVZONSA-N 1 1 372.387 4.337 20 5 FIBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000550000389 1100588545 /nfs/dbraw/zinc/58/85/45/1100588545.db2.gz QHYANIWNYDAONQ-KWQFWETISA-N 1 1 356.266 4.386 20 5 FIBDMO C[C@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000550000389 1100588553 /nfs/dbraw/zinc/58/85/53/1100588553.db2.gz QHYANIWNYDAONQ-KWQFWETISA-N 1 1 356.266 4.386 20 5 FIBDMO CC(=O)c1cc(NC[C@@H](C2CC2)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000517767308 1100649592 /nfs/dbraw/zinc/64/95/92/1100649592.db2.gz TZMMSPWXMOPRCF-NRFANRHFSA-N 1 1 367.449 4.120 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000506327895 1100862443 /nfs/dbraw/zinc/86/24/43/1100862443.db2.gz XAMBJDOTBRDKKV-UHFFFAOYSA-N 1 1 370.449 4.175 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](c2ccccc2)C[C@H]1C ZINC000439329197 1101352036 /nfs/dbraw/zinc/35/20/36/1101352036.db2.gz WYZXJRUBZHUELM-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)C[C@H]1C ZINC000439329197 1101352050 /nfs/dbraw/zinc/35/20/50/1101352050.db2.gz WYZXJRUBZHUELM-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO CC[NH+](CC)[C@H](CNCc1ccc(C)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000518771759 1101535165 /nfs/dbraw/zinc/53/51/65/1101535165.db2.gz YDSNRVNBIJFUKY-OAQYLSRUSA-N 1 1 371.481 4.085 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]3C3CCOCC3)o2)c1 ZINC000537464867 1101948368 /nfs/dbraw/zinc/94/83/68/1101948368.db2.gz ANNYVOWJNMMMEG-LJQANCHMSA-N 1 1 356.422 4.246 20 5 FIBDMO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000191190869 1102028797 /nfs/dbraw/zinc/02/87/97/1102028797.db2.gz RANAWTUOSBPYCX-UHFFFAOYSA-N 1 1 369.421 4.115 20 5 FIBDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000191190869 1102028804 /nfs/dbraw/zinc/02/88/04/1102028804.db2.gz RANAWTUOSBPYCX-UHFFFAOYSA-N 1 1 369.421 4.115 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2nccn2C(F)F)s1 ZINC000237681825 1102116374 /nfs/dbraw/zinc/11/63/74/1102116374.db2.gz TUJJWLSWPJZAGH-UHFFFAOYSA-N 1 1 364.377 4.205 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000532450932 1102341133 /nfs/dbraw/zinc/34/11/33/1102341133.db2.gz PRBNFOVHTHQRCZ-GOSISDBHSA-N 1 1 367.493 4.261 20 5 FIBDMO C[C@@H](C[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000532516305 1102450030 /nfs/dbraw/zinc/45/00/30/1102450030.db2.gz QZGNBCXYGIUYSK-LSDHHAIUSA-N 1 1 366.421 4.441 20 5 FIBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@H](c3noc(C4CC4)n3)C2)cc1[N+](=O)[O-] ZINC000537656662 1102769492 /nfs/dbraw/zinc/76/94/92/1102769492.db2.gz JSZJTKOCSJKGRV-INIZCTEOSA-N 1 1 370.453 4.358 20 5 FIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](c3noc(C4CC4)n3)C2)cc1[N+](=O)[O-] ZINC000537656662 1102769501 /nfs/dbraw/zinc/76/95/01/1102769501.db2.gz JSZJTKOCSJKGRV-INIZCTEOSA-N 1 1 370.453 4.358 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccccc2C)c([N+](=O)[O-])cc1OC ZINC000507143328 1103144551 /nfs/dbraw/zinc/14/45/51/1103144551.db2.gz LJFTYAHXOMCIPF-KRWDZBQOSA-N 1 1 356.422 4.258 20 5 FIBDMO COc1cc(C)c(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1OC ZINC000507169660 1103189201 /nfs/dbraw/zinc/18/92/01/1103189201.db2.gz KBPMCUZGJSNNDQ-UHFFFAOYSA-N 1 1 356.422 4.085 20 5 FIBDMO COc1cc(C)c(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1OC ZINC000507169660 1103189206 /nfs/dbraw/zinc/18/92/06/1103189206.db2.gz KBPMCUZGJSNNDQ-UHFFFAOYSA-N 1 1 356.422 4.085 20 5 FIBDMO COc1cccc(OC(F)(F)F)c1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000507263684 1103260567 /nfs/dbraw/zinc/26/05/67/1103260567.db2.gz CFTWVWWBMJKUCH-NSHDSACASA-N 1 1 370.327 4.353 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@H](C)C2CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000507448705 1103396741 /nfs/dbraw/zinc/39/67/41/1103396741.db2.gz DFGNOEXRZWKBDK-OAHLLOKOSA-N 1 1 370.449 4.413 20 5 FIBDMO CC[C@H](C)[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507663628 1103602508 /nfs/dbraw/zinc/60/25/08/1103602508.db2.gz NNLFIXHQDJZQLU-HNNXBMFYSA-N 1 1 356.422 4.262 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000441445858 1104732160 /nfs/dbraw/zinc/73/21/60/1104732160.db2.gz WWVHKACIFVOBEH-IBGZPJMESA-N 1 1 362.470 4.306 20 5 FIBDMO C[N@H+](Cc1ccccc1)CC1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000507918504 1105266275 /nfs/dbraw/zinc/26/62/75/1105266275.db2.gz OREWJQOYBMGQHM-UHFFFAOYSA-N 1 1 371.456 4.078 20 5 FIBDMO CCOc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1OC(F)F ZINC000168628165 1106749975 /nfs/dbraw/zinc/74/99/75/1106749975.db2.gz ZXNGXDRDCGCQTE-LBPRGKRZSA-N 1 1 366.364 4.446 20 5 FIBDMO C[C@]1(O)CCCC[C@H]1[C@@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000450958331 1106842991 /nfs/dbraw/zinc/84/29/91/1106842991.db2.gz MVSKJDFDIGYJGA-WBAXXEDZSA-N 1 1 352.862 4.154 20 5 FIBDMO Cc1ccccc1CC[N@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000451169902 1106957057 /nfs/dbraw/zinc/95/70/57/1106957057.db2.gz NHINZDJOANRWBK-OAHLLOKOSA-N 1 1 366.421 4.189 20 5 FIBDMO Cc1ccccc1CC[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000451168709 1106957289 /nfs/dbraw/zinc/95/72/89/1106957289.db2.gz WYOREBADCLQUEF-UHFFFAOYSA-N 1 1 365.433 4.275 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530522897 1107101139 /nfs/dbraw/zinc/10/11/39/1107101139.db2.gz UNEKZONFAOGVHV-MJGOQNOKSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000530522897 1107101147 /nfs/dbraw/zinc/10/11/47/1107101147.db2.gz UNEKZONFAOGVHV-MJGOQNOKSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000530522897 1107101154 /nfs/dbraw/zinc/10/11/54/1107101154.db2.gz UNEKZONFAOGVHV-MJGOQNOKSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc(C)c([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC001168133633 1107395353 /nfs/dbraw/zinc/39/53/53/1107395353.db2.gz DBUSBYYIARFVRI-SFHVURJKSA-N 1 1 355.394 4.457 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[C@@H]1c1ccccc1 ZINC000444651930 1108048622 /nfs/dbraw/zinc/04/86/22/1108048622.db2.gz QKKTYNAHAGSCQD-YOEHRIQHSA-N 1 1 350.422 4.097 20 5 FIBDMO CC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1nnc2n1CCCCC2 ZINC000531707979 1108088029 /nfs/dbraw/zinc/08/80/29/1108088029.db2.gz SFLOPTKGLSMSHR-YOEHRIQHSA-N 1 1 357.458 4.023 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCC[N@H+]1CC1CCCCC1 ZINC000520240971 1108116572 /nfs/dbraw/zinc/11/65/72/1108116572.db2.gz YGJPOUBNGSEVCR-SFHVURJKSA-N 1 1 374.485 4.069 20 5 FIBDMO C[C@H](CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[N@H+](C)C1CC1 ZINC000237577571 1108174429 /nfs/dbraw/zinc/17/44/29/1108174429.db2.gz ZJIITTYNNQCXPU-CQSZACIVSA-N 1 1 373.428 4.099 20 5 FIBDMO C[C@H](CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000237577571 1108174431 /nfs/dbraw/zinc/17/44/31/1108174431.db2.gz ZJIITTYNNQCXPU-CQSZACIVSA-N 1 1 373.428 4.099 20 5 FIBDMO C[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000453228658 1108300184 /nfs/dbraw/zinc/30/01/84/1108300184.db2.gz AUWHDDGCRKYSTL-GUMYABAYSA-N 1 1 365.477 4.441 20 5 FIBDMO CC[C@@H]([NH2+]Cc1nc(C)c(Br)s1)c1cccc([N+](=O)[O-])c1 ZINC000453273596 1108377936 /nfs/dbraw/zinc/37/79/36/1108377936.db2.gz WKKZDKRQRKZOKB-GFCCVEGCSA-N 1 1 370.272 4.363 20 5 FIBDMO Cc1ccc([C@@H]2CSCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000523860107 1108611738 /nfs/dbraw/zinc/61/17/38/1108611738.db2.gz AZVWENDFFLMREY-SFHVURJKSA-N 1 1 358.463 4.072 20 5 FIBDMO O=[N+]([O-])c1ccccc1CN1CC[C@@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000532244184 1108734152 /nfs/dbraw/zinc/73/41/52/1108734152.db2.gz XIRHIXTVWMNIEQ-TZIWHRDSSA-N 1 1 365.477 4.081 20 5 FIBDMO COc1ccc(C[N@@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000524037098 1108768637 /nfs/dbraw/zinc/76/86/37/1108768637.db2.gz UHLYSHINKSFVQG-LIRRHRJNSA-N 1 1 358.463 4.282 20 5 FIBDMO COc1ccc(C[N@H+]2CCS[C@@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000524037098 1108768645 /nfs/dbraw/zinc/76/86/45/1108768645.db2.gz UHLYSHINKSFVQG-LIRRHRJNSA-N 1 1 358.463 4.282 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@H+](Cc2ccccc2)CC2CCOCC2)cc1 ZINC000524425117 1109000794 /nfs/dbraw/zinc/00/07/94/1109000794.db2.gz DFBOOOYPBXELGD-UHFFFAOYSA-N 1 1 354.450 4.066 20 5 FIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525783990 1109518293 /nfs/dbraw/zinc/51/82/93/1109518293.db2.gz HSDUORZRHYVBEV-BFUOFWGJSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525783990 1109518298 /nfs/dbraw/zinc/51/82/98/1109518298.db2.gz HSDUORZRHYVBEV-BFUOFWGJSA-N 1 1 372.396 4.184 20 5 FIBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000447402685 1109534962 /nfs/dbraw/zinc/53/49/62/1109534962.db2.gz ADLCOLMDZAAQDR-HNNXBMFYSA-N 1 1 366.421 4.016 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](CCCO)C2)ccc1Oc1ccc(F)cc1 ZINC000449790867 1110172847 /nfs/dbraw/zinc/17/28/47/1110172847.db2.gz MOTSLOFUOLOPSG-HNNXBMFYSA-N 1 1 374.412 4.121 20 5 FIBDMO C[C@@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000450433745 1110296941 /nfs/dbraw/zinc/29/69/41/1110296941.db2.gz LLHLLSGIKOVXPX-CABCVRRESA-N 1 1 354.454 4.208 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](C[C@H]2CCOC2)C2CC2)s1 ZINC000129969323 1110319001 /nfs/dbraw/zinc/31/90/01/1110319001.db2.gz CWIWWZMDFZYJKO-CQSZACIVSA-N 1 1 358.463 4.324 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@]4(CCCOC4)C3)o2)c1 ZINC000538718896 1111260925 /nfs/dbraw/zinc/26/09/25/1111260925.db2.gz VNSFZLZMSAGISC-FQEVSTJZSA-N 1 1 356.422 4.247 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@@H+](CCCCO)C2CC2)cc1[N+](=O)[O-] ZINC000538731024 1111268029 /nfs/dbraw/zinc/26/80/29/1111268029.db2.gz PFQKHALCULRMRY-UHFFFAOYSA-N 1 1 369.465 4.100 20 5 FIBDMO CC(C)[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(Cl)c(Cl)c1 ZINC000478429244 1111774308 /nfs/dbraw/zinc/77/43/08/1111774308.db2.gz CMWZDCQZSOFUCH-UHFFFAOYSA-N 1 1 357.241 4.009 20 5 FIBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000553991265 1112153969 /nfs/dbraw/zinc/15/39/69/1112153969.db2.gz GVYASBISHOAKJE-KRWDZBQOSA-N 1 1 359.451 4.068 20 5 FIBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000553988160 1112160789 /nfs/dbraw/zinc/16/07/89/1112160789.db2.gz XXCYNMKQCNIAEY-QGZVFWFLSA-N 1 1 359.451 4.068 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+][C@@H](CN2CCCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000480282592 1112373058 /nfs/dbraw/zinc/37/30/58/1112373058.db2.gz XLMXYIKAELHJDX-PXNSSMCTSA-N 1 1 353.466 4.391 20 5 FIBDMO Cc1c([C@H](C)[NH2+]Cc2nc3cccc(Cl)c3n2C)cccc1[N+](=O)[O-] ZINC000480697112 1112558494 /nfs/dbraw/zinc/55/84/94/1112558494.db2.gz KPCYYHJWZOTNLD-LBPRGKRZSA-N 1 1 358.829 4.294 20 5 FIBDMO Cn1c(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)nc2ccc(Cl)cc21 ZINC000482544247 1113293362 /nfs/dbraw/zinc/29/33/62/1113293362.db2.gz OZPZWUZCFOUAQR-UHFFFAOYSA-N 1 1 358.829 4.160 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H](c4ccccc4)CC3)nc2c1 ZINC000482699600 1113335459 /nfs/dbraw/zinc/33/54/59/1113335459.db2.gz YFEDQMMXPPHJCD-MRXNPFEDSA-N 1 1 350.422 4.241 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(Br)o2)C2CC2)cc1 ZINC000483173892 1113457990 /nfs/dbraw/zinc/45/79/90/1113457990.db2.gz CVRAKVIZIUPWDI-UHFFFAOYSA-N 1 1 351.200 4.115 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(Br)o2)C2CC2)cc1 ZINC000483173892 1113457992 /nfs/dbraw/zinc/45/79/92/1113457992.db2.gz CVRAKVIZIUPWDI-UHFFFAOYSA-N 1 1 351.200 4.115 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000483267204 1113477316 /nfs/dbraw/zinc/47/73/16/1113477316.db2.gz BXUTVWTXPCFJGM-AWEZNQCLSA-N 1 1 374.746 4.090 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](C)c1ccc(F)cc1 ZINC000150325042 1113902496 /nfs/dbraw/zinc/90/24/96/1113902496.db2.gz KDHGVXXPUAMIPW-CQSZACIVSA-N 1 1 359.401 4.064 20 5 FIBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490033906 1114205657 /nfs/dbraw/zinc/20/56/57/1114205657.db2.gz ALULWWPDRDDTHA-KRWDZBQOSA-N 1 1 369.465 4.451 20 5 FIBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490033906 1114205659 /nfs/dbraw/zinc/20/56/59/1114205659.db2.gz ALULWWPDRDDTHA-KRWDZBQOSA-N 1 1 369.465 4.451 20 5 FIBDMO COc1cc(C[N@H+](C)[C@@H](C)c2cccs2)c([N+](=O)[O-])cc1OC(F)F ZINC000029594618 1114333194 /nfs/dbraw/zinc/33/31/94/1114333194.db2.gz SIEKJOIBJHRWNV-JTQLQIEISA-N 1 1 372.393 4.459 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cccs2)c([N+](=O)[O-])cc1OC(F)F ZINC000029594618 1114333197 /nfs/dbraw/zinc/33/31/97/1114333197.db2.gz SIEKJOIBJHRWNV-JTQLQIEISA-N 1 1 372.393 4.459 20 5 FIBDMO Cc1c(F)cccc1NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000490816924 1114338010 /nfs/dbraw/zinc/33/80/10/1114338010.db2.gz FJSXHARCYKFTDN-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)C1 ZINC000054794174 1114389615 /nfs/dbraw/zinc/38/96/15/1114389615.db2.gz LUFQKLIJWIXFIS-AWEZNQCLSA-N 1 1 371.412 4.218 20 5 FIBDMO C[C@@]1(CCCO)CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000571603167 1114483235 /nfs/dbraw/zinc/48/32/35/1114483235.db2.gz WBRZDKNVPMJZKR-IBGZPJMESA-N 1 1 360.479 4.450 20 5 FIBDMO C[C@H](CF)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000588930928 1114676624 /nfs/dbraw/zinc/67/66/24/1114676624.db2.gz ZSQYLQFHRVBUOZ-SECBINFHSA-N 1 1 357.179 4.065 20 5 FIBDMO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000590967163 1114997762 /nfs/dbraw/zinc/99/77/62/1114997762.db2.gz AKHMUEOYRSMFSZ-TXEJJXNPSA-N 1 1 360.797 4.204 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3csc([N+](=O)[O-])c3)cc2)C1 ZINC000046156238 1115192734 /nfs/dbraw/zinc/19/27/34/1115192734.db2.gz ADUNEBXFRGQFGJ-CYBMUJFWSA-N 1 1 359.451 4.141 20 5 FIBDMO Cc1cc(F)ccc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592133131 1115205729 /nfs/dbraw/zinc/20/57/29/1115205729.db2.gz SXYBBBAEVOWSPU-MXVIHJGJSA-N 1 1 372.440 4.348 20 5 FIBDMO Cc1ccccc1C1([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CCC1 ZINC000593038281 1115281356 /nfs/dbraw/zinc/28/13/56/1115281356.db2.gz BPMUGOGYACBFPP-UHFFFAOYSA-N 1 1 364.405 4.122 20 5 FIBDMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000157893949 1115379956 /nfs/dbraw/zinc/37/99/56/1115379956.db2.gz XRPKJNNWFNSMML-CQSZACIVSA-N 1 1 374.485 4.493 20 5 FIBDMO COc1ccc(Cl)cc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595012976 1115503489 /nfs/dbraw/zinc/50/34/89/1115503489.db2.gz HMHBHMBEAWTZJO-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](c1ccccc1)[C@H]1CCCO1 ZINC000595011921 1115503628 /nfs/dbraw/zinc/50/36/28/1115503628.db2.gz CPUOKVPAXLBDSD-QMIHWGKISA-N 1 1 356.422 4.174 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000595006268 1115507166 /nfs/dbraw/zinc/50/71/66/1115507166.db2.gz HXBASAARGCLJKS-SJKOYZFVSA-N 1 1 360.385 4.307 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000595005424 1115507499 /nfs/dbraw/zinc/50/74/99/1115507499.db2.gz YMEQRCMRGPORLH-INIZCTEOSA-N 1 1 369.465 4.050 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccccc1OC(F)F ZINC000595003864 1115507549 /nfs/dbraw/zinc/50/75/49/1115507549.db2.gz MBKWXYDFWARFJM-NSHDSACASA-N 1 1 352.337 4.056 20 5 FIBDMO COc1ccccc1-c1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)on1 ZINC000595102784 1115516738 /nfs/dbraw/zinc/51/67/38/1115516738.db2.gz JRRLKEOZTAPIDV-CQSZACIVSA-N 1 1 367.405 4.418 20 5 FIBDMO Cc1c([C@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000595093862 1115517564 /nfs/dbraw/zinc/51/75/64/1115517564.db2.gz OWNQPJUCHCMHEZ-NSHDSACASA-N 1 1 354.328 4.495 20 5 FIBDMO COC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000595416733 1115534965 /nfs/dbraw/zinc/53/49/65/1115534965.db2.gz JYIAQQJYADKAMY-HNNXBMFYSA-N 1 1 372.318 4.230 20 5 FIBDMO Cc1noc(C[N@H+](Cc2cccs2)C2Cc3ccccc3C2)c1[N+](=O)[O-] ZINC000595475207 1115538564 /nfs/dbraw/zinc/53/85/64/1115538564.db2.gz JOQDMYZZORFCHO-UHFFFAOYSA-N 1 1 369.446 4.122 20 5 FIBDMO Cc1noc(C[N@@H+](Cc2cccs2)C2Cc3ccccc3C2)c1[N+](=O)[O-] ZINC000595475207 1115538570 /nfs/dbraw/zinc/53/85/70/1115538570.db2.gz JOQDMYZZORFCHO-UHFFFAOYSA-N 1 1 369.446 4.122 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000593023076 1115540684 /nfs/dbraw/zinc/54/06/84/1115540684.db2.gz OSOORKHTPCAIJR-GFCCVEGCSA-N 1 1 368.842 4.337 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)c1 ZINC000595785781 1115563566 /nfs/dbraw/zinc/56/35/66/1115563566.db2.gz GOEDNUXTPJCPJZ-GUYCJALGSA-N 1 1 372.387 4.395 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CC4CC3(c3ccccc3)C4)co2)cc1 ZINC000595909236 1115566470 /nfs/dbraw/zinc/56/64/70/1115566470.db2.gz QVTRDJUXZSZRPT-UHFFFAOYSA-N 1 1 361.401 4.371 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC4CC3(c3ccccc3)C4)co2)cc1 ZINC000595909236 1115566473 /nfs/dbraw/zinc/56/64/73/1115566473.db2.gz QVTRDJUXZSZRPT-UHFFFAOYSA-N 1 1 361.401 4.371 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCc3ccccc3-n3ccnc31)CCC2 ZINC000596093997 1115574396 /nfs/dbraw/zinc/57/43/96/1115574396.db2.gz FYHJPQVNZHFUKB-WOJBJXKFSA-N 1 1 374.444 4.435 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCc2ccccc2-n2ccnc21 ZINC000596118266 1115575002 /nfs/dbraw/zinc/57/50/02/1115575002.db2.gz UZDRKWHCZJVULR-ZWKOTPCHSA-N 1 1 360.417 4.045 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000597217314 1115648603 /nfs/dbraw/zinc/64/86/03/1115648603.db2.gz CCNUMFMZKYYEOH-WNJRYGEDSA-N 1 1 368.433 4.445 20 5 FIBDMO O=[N+]([O-])c1sc(C[NH2+][C@@H]2CCCc3occc32)cc1Br ZINC000602510758 1115709120 /nfs/dbraw/zinc/70/91/20/1115709120.db2.gz NILOYWJKMGFVMG-LLVKDONJSA-N 1 1 357.229 4.179 20 5 FIBDMO CC[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1ccncc1 ZINC000602561691 1115710624 /nfs/dbraw/zinc/71/06/24/1115710624.db2.gz ZHWQCWSCCYJNKU-LBPRGKRZSA-N 1 1 356.245 4.055 20 5 FIBDMO CC(C)([NH2+]Cc1ccnn1CCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000598644517 1115742230 /nfs/dbraw/zinc/74/22/30/1115742230.db2.gz OFSZNTBNMQTZQU-UHFFFAOYSA-N 1 1 364.449 4.059 20 5 FIBDMO CN(C)C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(Cl)c(Cl)c1 ZINC000598998948 1115776094 /nfs/dbraw/zinc/77/60/94/1115776094.db2.gz ZJSAJPKHFWFAJX-KRWDZBQOSA-N 1 1 368.264 4.294 20 5 FIBDMO CCC(F)(F)C(C)(C)C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000599080605 1115787486 /nfs/dbraw/zinc/78/74/86/1115787486.db2.gz PMOLFGUVOUNQND-HNNXBMFYSA-N 1 1 366.412 4.079 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000603839054 1115818187 /nfs/dbraw/zinc/81/81/87/1115818187.db2.gz KJJDJGKWRDOPDO-LJQANCHMSA-N 1 1 356.422 4.258 20 5 FIBDMO COc1ccc(C[N@H+](C)Cc2ccccc2OC(F)(F)F)cc1[N+](=O)[O-] ZINC000603840855 1115822748 /nfs/dbraw/zinc/82/27/48/1115822748.db2.gz CVWVTVFBMRHOIR-UHFFFAOYSA-N 1 1 370.327 4.134 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2ccccc2OC(F)(F)F)cc1[N+](=O)[O-] ZINC000603840855 1115822752 /nfs/dbraw/zinc/82/27/52/1115822752.db2.gz CVWVTVFBMRHOIR-UHFFFAOYSA-N 1 1 370.327 4.134 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000599573921 1115827466 /nfs/dbraw/zinc/82/74/66/1115827466.db2.gz KVHFLVUFHUUVOJ-HXUWFJFHSA-N 1 1 355.438 4.408 20 5 FIBDMO Cc1cccc([C@@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C(C)C)c1 ZINC000599628244 1115832276 /nfs/dbraw/zinc/83/22/76/1115832276.db2.gz RHLKWYOHFNVKRR-IBGZPJMESA-N 1 1 366.421 4.440 20 5 FIBDMO COc1ccc([C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C2CC2)cn1 ZINC000599695543 1115836517 /nfs/dbraw/zinc/83/65/17/1115836517.db2.gz DCIATROVQZZEMF-FQEVSTJZSA-N 1 1 371.437 4.027 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604012516 1115840950 /nfs/dbraw/zinc/84/09/50/1115840950.db2.gz KZXIZKRWSUCSQK-HXUWFJFHSA-N 1 1 356.422 4.209 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000604521708 1115867264 /nfs/dbraw/zinc/86/72/64/1115867264.db2.gz VEZKWMBZQUUUKT-CTNGQTDRSA-N 1 1 354.450 4.237 20 5 FIBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172903582 1116002575 /nfs/dbraw/zinc/00/25/75/1116002575.db2.gz MKHIOSWPECHRCB-HXUWFJFHSA-N 1 1 365.437 4.140 20 5 FIBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000534108680 1116161323 /nfs/dbraw/zinc/16/13/23/1116161323.db2.gz KYAPHSVMBGKATB-OAQYLSRUSA-N 1 1 363.417 4.413 20 5 FIBDMO Cc1ccc2[nH]c([C@H]3CCC[N@@H+](CCc4ccc([N+](=O)[O-])cc4)C3)nc2c1 ZINC000534952029 1116255562 /nfs/dbraw/zinc/25/55/62/1116255562.db2.gz SHCMFTSSVDOAJB-KRWDZBQOSA-N 1 1 364.449 4.202 20 5 FIBDMO Cc1ccc2nc([C@H]3CCC[N@H+](CCc4ccc([N+](=O)[O-])cc4)C3)[nH]c2c1 ZINC000534952029 1116255563 /nfs/dbraw/zinc/25/55/63/1116255563.db2.gz SHCMFTSSVDOAJB-KRWDZBQOSA-N 1 1 364.449 4.202 20 5 FIBDMO Cc1ccc2nc([C@H]3CCC[N@@H+](CCc4ccc([N+](=O)[O-])cc4)C3)[nH]c2c1 ZINC000534952029 1116255564 /nfs/dbraw/zinc/25/55/64/1116255564.db2.gz SHCMFTSSVDOAJB-KRWDZBQOSA-N 1 1 364.449 4.202 20 5 FIBDMO Cc1nc2ccccc2n1C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000535207654 1116281469 /nfs/dbraw/zinc/28/14/69/1116281469.db2.gz SUZONTRMMMLYQG-QGZVFWFLSA-N 1 1 368.412 4.057 20 5 FIBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000089909908 1116351789 /nfs/dbraw/zinc/35/17/89/1116351789.db2.gz NFJULJVCPGNJHT-ZWKOTPCHSA-N 1 1 371.437 4.029 20 5 FIBDMO CC(C)c1ccc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000539899598 1117741019 /nfs/dbraw/zinc/74/10/19/1117741019.db2.gz GXFLGOZHHPMGPQ-YLJYHZDGSA-N 1 1 357.498 4.167 20 5 FIBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@@H]1CCC[C@H]1O ZINC000539912644 1117749564 /nfs/dbraw/zinc/74/95/64/1117749564.db2.gz FFFUGWPMAHLDCP-HNAYVOBHSA-N 1 1 374.412 4.119 20 5 FIBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000539928290 1117753037 /nfs/dbraw/zinc/75/30/37/1117753037.db2.gz WSIZUKLVOWMWAX-BSDKJSHOSA-N 1 1 360.454 4.052 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1CNc1ccc(-n2c[nH+]c(C)c2C)cc1 ZINC000463035148 1117928338 /nfs/dbraw/zinc/92/83/38/1117928338.db2.gz HILBMLHOAUUGAO-UHFFFAOYSA-N 1 1 366.421 4.408 20 5 FIBDMO C[C@@H](c1ccccc1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000463233148 1118054432 /nfs/dbraw/zinc/05/44/32/1118054432.db2.gz XJRTZTJLCHNEMF-KRWDZBQOSA-N 1 1 350.422 4.055 20 5 FIBDMO C[C@@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[N@H+]1C ZINC000540610968 1118150546 /nfs/dbraw/zinc/15/05/46/1118150546.db2.gz YVKWQWNKCHLRIJ-OLZOCXBDSA-N 1 1 363.845 4.081 20 5 FIBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCN1C ZINC000540610968 1118150548 /nfs/dbraw/zinc/15/05/48/1118150548.db2.gz YVKWQWNKCHLRIJ-OLZOCXBDSA-N 1 1 363.845 4.081 20 5 FIBDMO COc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000463468363 1118172987 /nfs/dbraw/zinc/17/29/87/1118172987.db2.gz DRJMMQSMNJSLBW-KRWDZBQOSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1cccc([C@@H]2CCC[N@H+]2Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000463468363 1118172988 /nfs/dbraw/zinc/17/29/88/1118172988.db2.gz DRJMMQSMNJSLBW-KRWDZBQOSA-N 1 1 360.385 4.088 20 5 FIBDMO Cc1ccccc1C1CC[NH+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000541661954 1118601348 /nfs/dbraw/zinc/60/13/48/1118601348.db2.gz DVRJEWIXESUQJC-UHFFFAOYSA-N 1 1 367.449 4.030 20 5 FIBDMO CCC1(CC)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000464583534 1118615433 /nfs/dbraw/zinc/61/54/33/1118615433.db2.gz TVWSDKWQYAYRGW-UHFFFAOYSA-N 1 1 361.467 4.357 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc1OC(F)F ZINC000541773962 1118636936 /nfs/dbraw/zinc/63/69/36/1118636936.db2.gz QCFVFEZPYKLPSC-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)c1 ZINC000595785779 1118637854 /nfs/dbraw/zinc/63/78/54/1118637854.db2.gz GOEDNUXTPJCPJZ-CXAGYDPISA-N 1 1 372.387 4.395 20 5 FIBDMO COc1ccc(C2CC[NH+](Cc3cc(OC)c(F)cc3[N+](=O)[O-])CC2)cc1 ZINC000464682415 1118649962 /nfs/dbraw/zinc/64/99/62/1118649962.db2.gz ROPDWQNJALPXKF-UHFFFAOYSA-N 1 1 374.412 4.131 20 5 FIBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000464780444 1118692229 /nfs/dbraw/zinc/69/22/29/1118692229.db2.gz SUFHBRFYLZMNSO-DOTOQJQBSA-N 1 1 352.500 4.488 20 5 FIBDMO Cc1ccc(CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@H]2CCCO2)cc1 ZINC000464782163 1118692301 /nfs/dbraw/zinc/69/23/01/1118692301.db2.gz YFDZUJFZQGASHI-OAQYLSRUSA-N 1 1 354.450 4.127 20 5 FIBDMO Cc1ccc(CC[N@H+](Cc2ccccc2[N+](=O)[O-])C[C@H]2CCCO2)cc1 ZINC000464782559 1118693391 /nfs/dbraw/zinc/69/33/91/1118693391.db2.gz XYKIDDNGFYGLBH-HXUWFJFHSA-N 1 1 354.450 4.127 20 5 FIBDMO CCc1cccc(CC)c1NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271781875 1118867740 /nfs/dbraw/zinc/86/77/40/1118867740.db2.gz SIIADXLTEFJSPV-CQSZACIVSA-N 1 1 355.438 4.009 20 5 FIBDMO C[C@H]([NH2+]Cc1cccc(SC(=O)N(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271796586 1118908176 /nfs/dbraw/zinc/90/81/76/1118908176.db2.gz VUWAAEYIUZPNEN-ZDUSSCGKSA-N 1 1 359.451 4.219 20 5 FIBDMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC2 ZINC000491822599 1118983924 /nfs/dbraw/zinc/98/39/24/1118983924.db2.gz WMPNQMAKUMWRPS-UHFFFAOYSA-N 1 1 358.825 4.052 20 5 FIBDMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC2 ZINC000491822599 1118983927 /nfs/dbraw/zinc/98/39/27/1118983927.db2.gz WMPNQMAKUMWRPS-UHFFFAOYSA-N 1 1 358.825 4.052 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000492177192 1119040004 /nfs/dbraw/zinc/04/00/04/1119040004.db2.gz XKPJMUABFBMFKJ-IBGZPJMESA-N 1 1 360.841 4.021 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000492177192 1119040010 /nfs/dbraw/zinc/04/00/10/1119040010.db2.gz XKPJMUABFBMFKJ-IBGZPJMESA-N 1 1 360.841 4.021 20 5 FIBDMO CCOc1cc(C[N@@H+]2CCC[C@H]2c2ccc(COC)o2)ccc1[N+](=O)[O-] ZINC000492874800 1119207081 /nfs/dbraw/zinc/20/70/81/1119207081.db2.gz QOBIRPWWCNERLY-INIZCTEOSA-N 1 1 360.410 4.070 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccc(COC)o2)ccc1[N+](=O)[O-] ZINC000492874800 1119207087 /nfs/dbraw/zinc/20/70/87/1119207087.db2.gz QOBIRPWWCNERLY-INIZCTEOSA-N 1 1 360.410 4.070 20 5 FIBDMO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(COC)o2)ccc1[N+](=O)[O-] ZINC000492874801 1119207289 /nfs/dbraw/zinc/20/72/89/1119207289.db2.gz QOBIRPWWCNERLY-MRXNPFEDSA-N 1 1 360.410 4.070 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccc(COC)o2)ccc1[N+](=O)[O-] ZINC000492874801 1119207293 /nfs/dbraw/zinc/20/72/93/1119207293.db2.gz QOBIRPWWCNERLY-MRXNPFEDSA-N 1 1 360.410 4.070 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000122613388 1119289949 /nfs/dbraw/zinc/28/99/49/1119289949.db2.gz ALJYXXVJLWVUFE-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO CN(c1ccccc1)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761513626 1119407093 /nfs/dbraw/zinc/40/70/93/1119407093.db2.gz BCJITTKORRRMSC-UHFFFAOYSA-N 1 1 359.857 4.349 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(OCC2CCCC2)CC1 ZINC000493367084 1119451419 /nfs/dbraw/zinc/45/14/19/1119451419.db2.gz UKTXIQJSHMRRMZ-UHFFFAOYSA-N 1 1 352.862 4.419 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(n2c(=O)[nH]c3ccccc32)CC1 ZINC000487734910 1119524632 /nfs/dbraw/zinc/52/46/32/1119524632.db2.gz UOXQNZMVMCKQDX-CQSZACIVSA-N 1 1 366.421 4.048 20 5 FIBDMO COc1ccc([C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)cc1 ZINC000609194224 1119841850 /nfs/dbraw/zinc/84/18/50/1119841850.db2.gz GNQMVTYCVLKZBJ-KRWDZBQOSA-N 1 1 370.449 4.380 20 5 FIBDMO Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000495412558 1120788611 /nfs/dbraw/zinc/78/86/11/1120788611.db2.gz BJAAFBUAEYKWDY-QWRGUYRKSA-N 1 1 370.375 4.382 20 5 FIBDMO C[N@@H+](CCSCc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1 ZINC000193627820 1120992577 /nfs/dbraw/zinc/99/25/77/1120992577.db2.gz LRANNEYRBOXZPD-UHFFFAOYSA-N 1 1 357.435 4.101 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc(CNc2cc(C)c([N+](=O)[O-])cc2Cl)cn1 ZINC000301435890 1121154985 /nfs/dbraw/zinc/15/49/85/1121154985.db2.gz JTBUOXCZGOIOQD-UHFFFAOYSA-N 1 1 357.801 4.058 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(C4CCCCC4)CC3)n2)cc1 ZINC000917133302 1122189839 /nfs/dbraw/zinc/18/98/39/1122189839.db2.gz AXTBPASSZLRHPH-UHFFFAOYSA-N 1 1 370.453 4.437 20 5 FIBDMO CC(=O)c1ccc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000301597020 1122238294 /nfs/dbraw/zinc/23/82/94/1122238294.db2.gz SQPYLYDHCRMHGV-BEFAXECRSA-N 1 1 367.449 4.120 20 5 FIBDMO C[N@@H+](Cc1csc2ccccc12)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917454417 1122319507 /nfs/dbraw/zinc/31/95/07/1122319507.db2.gz GTPWZURQJQYORX-UHFFFAOYSA-N 1 1 352.419 4.249 20 5 FIBDMO C[N@H+](Cc1csc2ccccc12)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917454417 1122319510 /nfs/dbraw/zinc/31/95/10/1122319510.db2.gz GTPWZURQJQYORX-UHFFFAOYSA-N 1 1 352.419 4.249 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1ccccc1)C(C)(C)C ZINC000130422676 1122844429 /nfs/dbraw/zinc/84/44/29/1122844429.db2.gz KWCPGEHTQPEMHM-UHFFFAOYSA-N 1 1 355.438 4.142 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000194857105 1122932523 /nfs/dbraw/zinc/93/25/23/1122932523.db2.gz PWBIOHQUIYLOLH-KRWDZBQOSA-N 1 1 373.497 4.020 20 5 FIBDMO C[C@H](CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000556872370 1123155488 /nfs/dbraw/zinc/15/54/88/1123155488.db2.gz XJRHPMUGTNQSKG-OXQOHEQNSA-N 1 1 364.449 4.201 20 5 FIBDMO Cc1cccc(C)c1NC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350559 1123706037 /nfs/dbraw/zinc/70/60/37/1123706037.db2.gz RLLQPRVVJIQWFE-UHFFFAOYSA-N 1 1 355.438 4.061 20 5 FIBDMO Cc1cccc(C)c1NC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350559 1123706041 /nfs/dbraw/zinc/70/60/41/1123706041.db2.gz RLLQPRVVJIQWFE-UHFFFAOYSA-N 1 1 355.438 4.061 20 5 FIBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705026 1123802969 /nfs/dbraw/zinc/80/29/69/1123802969.db2.gz HSFJJDNTLJGZAB-JKSUJKDBSA-N 1 1 365.905 4.335 20 5 FIBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705024 1123803961 /nfs/dbraw/zinc/80/39/61/1123803961.db2.gz HSFJJDNTLJGZAB-HOTGVXAUSA-N 1 1 365.905 4.335 20 5 FIBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000553988158 1124249089 /nfs/dbraw/zinc/24/90/89/1124249089.db2.gz XXCYNMKQCNIAEY-KRWDZBQOSA-N 1 1 359.451 4.068 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000554291371 1124325295 /nfs/dbraw/zinc/32/52/95/1124325295.db2.gz SCEZGKOUOJLBCB-OAHLLOKOSA-N 1 1 355.221 4.115 20 5 FIBDMO COc1ccc(NC(=O)C[N@@H+](C(C)C)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000428839531 1124526568 /nfs/dbraw/zinc/52/65/68/1124526568.db2.gz KHOXAMFSPHAIDC-OAHLLOKOSA-N 1 1 371.437 4.014 20 5 FIBDMO Cc1ccc(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000170905621 1124708737 /nfs/dbraw/zinc/70/87/37/1124708737.db2.gz LTDVPVSXQCXLLR-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO CC(C)(C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCCCC1 ZINC000113312653 1125147986 /nfs/dbraw/zinc/14/79/86/1125147986.db2.gz HJGYLMJZKDCIKL-UHFFFAOYSA-N 1 1 374.510 4.072 20 5 FIBDMO CCCOc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1OC ZINC001168699141 1125159125 /nfs/dbraw/zinc/15/91/25/1125159125.db2.gz IPMVVGKSDIHFQX-ZDUSSCGKSA-N 1 1 362.401 4.382 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312531593 1125399945 /nfs/dbraw/zinc/39/99/45/1125399945.db2.gz PSLQFZKLHDONTL-WAOWUJCRSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312531593 1125399951 /nfs/dbraw/zinc/39/99/51/1125399951.db2.gz PSLQFZKLHDONTL-WAOWUJCRSA-N 1 1 367.493 4.464 20 5 FIBDMO CC1CCC([N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C2CC2)CC1 ZINC000108082685 206027902 /nfs/dbraw/zinc/02/79/02/206027902.db2.gz VKPJEAVOLAKLGN-UHFFFAOYSA-N 1 1 356.426 4.188 20 5 FIBDMO COCC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccc(C)o1 ZINC000568400728 568030582 /nfs/dbraw/zinc/03/05/82/568030582.db2.gz METLESRSLNPYHG-OAHLLOKOSA-N 1 1 372.343 4.382 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3noc4c3CCCC4)s2)cc1 ZINC000568439107 568038262 /nfs/dbraw/zinc/03/82/62/568038262.db2.gz YSNRERAYILYAJV-UHFFFAOYSA-N 1 1 369.446 4.480 20 5 FIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc2c(c1)CCCC2 ZINC000181929495 568211884 /nfs/dbraw/zinc/21/18/84/568211884.db2.gz GBKLTDMPIUESDB-CYBMUJFWSA-N 1 1 351.406 4.466 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000541951228 568273244 /nfs/dbraw/zinc/27/32/44/568273244.db2.gz CYQJEKXXKUQJLT-BIENJYKASA-N 1 1 356.426 4.218 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c(F)cccc1N1CCCC1 ZINC000569968490 568444977 /nfs/dbraw/zinc/44/49/77/568444977.db2.gz HDOQZUFBAZOIJC-UHFFFAOYSA-N 1 1 357.429 4.009 20 5 FIBDMO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000182920215 1125690050 /nfs/dbraw/zinc/69/00/50/1125690050.db2.gz BHGPWWMRZLXKKV-CQSZACIVSA-N 1 1 352.394 4.112 20 5 FIBDMO CC1CCC([N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C2CC2)CC1 ZINC001167071952 1080009315 /nfs/dbraw/zinc/00/93/15/1080009315.db2.gz NTFWPCXWBVSWPI-UHFFFAOYSA-N 1 1 365.861 4.230 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1n1ccnc1 ZINC000246909994 1080543438 /nfs/dbraw/zinc/54/34/38/1080543438.db2.gz UPUHRQYIASSOMS-HNAYVOBHSA-N 1 1 366.421 4.134 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC001167131149 1080660125 /nfs/dbraw/zinc/66/01/25/1080660125.db2.gz KWSHRMODPXDHSG-OAHLLOKOSA-N 1 1 371.437 4.015 20 5 FIBDMO CCN1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000247090602 1080777975 /nfs/dbraw/zinc/77/79/75/1080777975.db2.gz PJGSUIDEKXGAAP-HUUCEWRRSA-N 1 1 359.495 4.316 20 5 FIBDMO CC[N@@H+]1CC[C@H](CN[C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000247090602 1080777981 /nfs/dbraw/zinc/77/79/81/1080777981.db2.gz PJGSUIDEKXGAAP-HUUCEWRRSA-N 1 1 359.495 4.316 20 5 FIBDMO CC[N@H+]1CC[C@H](CN[C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000247090602 1080777986 /nfs/dbraw/zinc/77/79/86/1080777986.db2.gz PJGSUIDEKXGAAP-HUUCEWRRSA-N 1 1 359.495 4.316 20 5 FIBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCc1cccc2ccccc21 ZINC001167265083 1080932417 /nfs/dbraw/zinc/93/24/17/1080932417.db2.gz XJWNOTKFTYVKLJ-UHFFFAOYSA-N 1 1 350.418 4.301 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000255073944 1081096611 /nfs/dbraw/zinc/09/66/11/1081096611.db2.gz HFLNQNALOWIKEZ-FXMBQATMSA-N 1 1 358.463 4.258 20 5 FIBDMO CN(C)c1cccc([C@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000083198694 1081546943 /nfs/dbraw/zinc/54/69/43/1081546943.db2.gz KAGMLDJAOVNRDI-GOSISDBHSA-N 1 1 366.421 4.139 20 5 FIBDMO CN(C)c1cccc([C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000083198694 1081546944 /nfs/dbraw/zinc/54/69/44/1081546944.db2.gz KAGMLDJAOVNRDI-GOSISDBHSA-N 1 1 366.421 4.139 20 5 FIBDMO COc1cc(C)cc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000127147088 1081553061 /nfs/dbraw/zinc/55/30/61/1081553061.db2.gz AHXQPZLOZLVYCD-UHFFFAOYSA-N 1 1 369.446 4.325 20 5 FIBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001167406871 1081963295 /nfs/dbraw/zinc/96/32/95/1081963295.db2.gz YAULVNIMCRBFGT-CQSZACIVSA-N 1 1 358.442 4.293 20 5 FIBDMO Cc1ccc(F)c(C[N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000580991506 1082270025 /nfs/dbraw/zinc/27/00/25/1082270025.db2.gz NUXSEOIIZIPJGD-UHFFFAOYSA-N 1 1 368.412 4.075 20 5 FIBDMO Cc1ccc(F)c(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000580991506 1082270031 /nfs/dbraw/zinc/27/00/31/1082270031.db2.gz NUXSEOIIZIPJGD-UHFFFAOYSA-N 1 1 368.412 4.075 20 5 FIBDMO Cn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000510414753 1082533434 /nfs/dbraw/zinc/53/34/34/1082533434.db2.gz RSUSOQWGFPSASQ-ZGBFETHSSA-N 1 1 362.433 4.332 20 5 FIBDMO Cn1c2ccccc2nc1[C@@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000510414753 1082533437 /nfs/dbraw/zinc/53/34/37/1082533437.db2.gz RSUSOQWGFPSASQ-ZGBFETHSSA-N 1 1 362.433 4.332 20 5 FIBDMO CC(C)C[C@@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000119362216 1082600921 /nfs/dbraw/zinc/60/09/21/1082600921.db2.gz CIBVFPHXWYPYTA-GJZGRUSLSA-N 1 1 358.442 4.464 20 5 FIBDMO COc1ccc(C[N@@H+](C)C[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000051132257 1082734966 /nfs/dbraw/zinc/73/49/66/1082734966.db2.gz UJHYDMFCVYLCPC-GHTZIAJQSA-N 1 1 370.449 4.203 20 5 FIBDMO C[N@@H+](CCCCO)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000471820072 1083053886 /nfs/dbraw/zinc/05/38/86/1083053886.db2.gz FVLBRKGDAPDSEN-UHFFFAOYSA-N 1 1 364.829 4.245 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](c4ncc[nH]4)C3)s2)cc1 ZINC000510536677 1083147333 /nfs/dbraw/zinc/14/73/33/1083147333.db2.gz YNCPGORYDFOJGE-HNNXBMFYSA-N 1 1 368.462 4.426 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CCC[C@@H]2OCc2ccccc2)c(F)c1 ZINC000510632675 1083213378 /nfs/dbraw/zinc/21/33/78/1083213378.db2.gz WPPPTMGZROTUHY-MOPGFXCFSA-N 1 1 362.376 4.101 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC2(CC1)OCc1ccccc12 ZINC000610738661 1083393080 /nfs/dbraw/zinc/39/30/80/1083393080.db2.gz QAVZMZMLJQTSAT-UHFFFAOYSA-N 1 1 358.825 4.270 20 5 FIBDMO CC[N@@H+](Cc1cccs1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000179720049 1083608677 /nfs/dbraw/zinc/60/86/77/1083608677.db2.gz UUULNHIGSHWZAS-UHFFFAOYSA-N 1 1 356.451 4.079 20 5 FIBDMO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000612530800 1083896533 /nfs/dbraw/zinc/89/65/33/1083896533.db2.gz DQIAQXVIVHOCBS-LBPRGKRZSA-N 1 1 372.812 4.192 20 5 FIBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(C)c1OC ZINC000796838399 1084045220 /nfs/dbraw/zinc/04/52/20/1084045220.db2.gz INJFYJATFFAWPQ-GFCCVEGCSA-N 1 1 364.829 4.425 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000613025672 1084275447 /nfs/dbraw/zinc/27/54/47/1084275447.db2.gz KJYCJRXEUPZMBS-FQEVSTJZSA-N 1 1 367.449 4.459 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@@H](CC(C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC001167550540 1084673524 /nfs/dbraw/zinc/67/35/24/1084673524.db2.gz WFDPEUDZPBEOND-ZDUSSCGKSA-N 1 1 372.412 4.115 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000551737846 1084706416 /nfs/dbraw/zinc/70/64/16/1084706416.db2.gz CNKPZVMQIDFMRA-AWEZNQCLSA-N 1 1 361.392 4.146 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000540476045 1084812008 /nfs/dbraw/zinc/81/20/08/1084812008.db2.gz PURLHJDMDVRAQJ-JKSUJKDBSA-N 1 1 355.438 4.198 20 5 FIBDMO Cc1ccccc1NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000174749485 1084817644 /nfs/dbraw/zinc/81/76/44/1084817644.db2.gz DNDQBYMLDBWGBX-UHFFFAOYSA-N 1 1 355.438 4.142 20 5 FIBDMO CCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCCO1 ZINC000106866085 1085234824 /nfs/dbraw/zinc/23/48/24/1085234824.db2.gz RBBWMVBKAQVQSW-SFHVURJKSA-N 1 1 373.453 4.073 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]2Cc2ccccc2)c(Br)c1 ZINC001167593762 1085310075 /nfs/dbraw/zinc/31/00/75/1085310075.db2.gz DCMDMQJKJCMONI-HNNXBMFYSA-N 1 1 361.239 4.174 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]2Cc2ccccc2)c(Br)c1 ZINC001167593762 1085310085 /nfs/dbraw/zinc/31/00/85/1085310085.db2.gz DCMDMQJKJCMONI-HNNXBMFYSA-N 1 1 361.239 4.174 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@H]2C[C@H](O)c2ccco2)c(F)c1 ZINC000121874060 1085584348 /nfs/dbraw/zinc/58/43/48/1085584348.db2.gz BWNKJSPLXOHZJM-YJBOKZPZSA-N 1 1 362.401 4.195 20 5 FIBDMO O=[N+]([O-])c1ccc(NCCc2[nH+]ccn2Cc2ccccc2)c2ccncc21 ZINC000024203546 1085664257 /nfs/dbraw/zinc/66/42/57/1085664257.db2.gz KFDGDQLMXPTBGF-UHFFFAOYSA-N 1 1 373.416 4.042 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(Br)c2)c(Cl)c1 ZINC000049963563 1086079861 /nfs/dbraw/zinc/07/98/61/1086079861.db2.gz DADORVBHZFKLKX-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCc3ccccc3[C@H]2C(C)C)c1 ZINC001167656647 1086311230 /nfs/dbraw/zinc/31/12/30/1086311230.db2.gz MXJYABHFCKFAGI-HXUWFJFHSA-N 1 1 368.433 4.137 20 5 FIBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C12CCC2 ZINC001167664831 1086521157 /nfs/dbraw/zinc/52/11/57/1086521157.db2.gz VGBRZRKQNCDONM-CVEARBPZSA-N 1 1 372.387 4.393 20 5 FIBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1 ZINC000054012120 1086630139 /nfs/dbraw/zinc/63/01/39/1086630139.db2.gz QPIQMGCVJZJENE-UHFFFAOYSA-N 1 1 370.434 4.277 20 5 FIBDMO C[N@@H+](Cc1cccc(Cl)c1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728896266 1086859319 /nfs/dbraw/zinc/85/93/19/1086859319.db2.gz PALRCSVPVQKWOU-UHFFFAOYSA-N 1 1 356.813 4.201 20 5 FIBDMO C[N@H+](Cc1cccc(Cl)c1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728896266 1086859335 /nfs/dbraw/zinc/85/93/35/1086859335.db2.gz PALRCSVPVQKWOU-UHFFFAOYSA-N 1 1 356.813 4.201 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@H]3Cc3ccccc3)c2)cc1 ZINC000728898316 1086888826 /nfs/dbraw/zinc/88/88/26/1086888826.db2.gz SQLIJXYJGRCIBO-NRFANRHFSA-N 1 1 362.433 4.123 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC=C(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000583922388 1087038700 /nfs/dbraw/zinc/03/87/00/1087038700.db2.gz OYJGARVJXHMBGK-MRXNPFEDSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC=C(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000583922388 1087038713 /nfs/dbraw/zinc/03/87/13/1087038713.db2.gz OYJGARVJXHMBGK-MRXNPFEDSA-N 1 1 365.433 4.020 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCCc1ccccc1 ZINC000052802656 1087166834 /nfs/dbraw/zinc/16/68/34/1087166834.db2.gz FSJCGYFIQXIMHF-HNNXBMFYSA-N 1 1 366.421 4.270 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ncc([N+](=O)[O-])cc2Cl)cc1 ZINC000080914847 1087282368 /nfs/dbraw/zinc/28/23/68/1087282368.db2.gz WVNZAQVXXZBTCX-NSHDSACASA-N 1 1 357.801 4.310 20 5 FIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cccnc2)cc1OC ZINC000611932121 1087590367 /nfs/dbraw/zinc/59/03/67/1087590367.db2.gz QXIWWSWXCRQNSF-HUUCEWRRSA-N 1 1 373.453 4.274 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000708576795 1087594817 /nfs/dbraw/zinc/59/48/17/1087594817.db2.gz INBGQUZVWCOONE-ZBFHGGJFSA-N 1 1 359.857 4.428 20 5 FIBDMO O=C(CC[N@H+]1CCC[C@@H]1c1cccc(Cl)c1)Nc1ccccc1[N+](=O)[O-] ZINC000409873903 1087626457 /nfs/dbraw/zinc/62/64/57/1087626457.db2.gz LZTLMPITCSGGJE-QGZVFWFLSA-N 1 1 373.840 4.414 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1ccnc1 ZINC000180609674 1087980881 /nfs/dbraw/zinc/98/08/81/1087980881.db2.gz UPUHRQYIASSOMS-KXBFYZLASA-N 1 1 366.421 4.134 20 5 FIBDMO CCOc1ccc([C@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000504929166 1087996071 /nfs/dbraw/zinc/99/60/71/1087996071.db2.gz HBFPOYQAYCHVQN-KSSFIOAISA-N 1 1 351.491 4.011 20 5 FIBDMO Cc1nn(-c2cccc(F)c2)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000414452958 1088514208 /nfs/dbraw/zinc/51/42/08/1088514208.db2.gz OBEIFOPUZMNLMR-UHFFFAOYSA-N 1 1 368.412 4.253 20 5 FIBDMO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCN(Cc2ccccc2)CC1 ZINC000311427459 1088652831 /nfs/dbraw/zinc/65/28/31/1088652831.db2.gz BZMWPVBSXHFRCC-UHFFFAOYSA-N 1 1 373.884 4.345 20 5 FIBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCN(Cc2ccccc2)CC1 ZINC000311427459 1088652839 /nfs/dbraw/zinc/65/28/39/1088652839.db2.gz BZMWPVBSXHFRCC-UHFFFAOYSA-N 1 1 373.884 4.345 20 5 FIBDMO C[C@@H]1CC[N@@H+](C)CCN1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000514105442 1088751860 /nfs/dbraw/zinc/75/18/60/1088751860.db2.gz RHVOIWVSNOOUQR-OAHLLOKOSA-N 1 1 373.428 4.052 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCOC[C@@H](C3CCC3)C2)o1 ZINC000430121202 1088993284 /nfs/dbraw/zinc/99/32/84/1088993284.db2.gz GJCAARXODHFUIP-INIZCTEOSA-N 1 1 356.422 4.103 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H](Cc4ccccc4)C3)nc2c1 ZINC000435048629 1089237428 /nfs/dbraw/zinc/23/74/28/1089237428.db2.gz JHHFCSUDCPRAOQ-INIZCTEOSA-N 1 1 351.406 4.191 20 5 FIBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000505598203 1089253479 /nfs/dbraw/zinc/25/34/79/1089253479.db2.gz YFWQYFLPUIDPEP-DGCLKSJQSA-N 1 1 358.385 4.010 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425369755 1089611669 /nfs/dbraw/zinc/61/16/69/1089611669.db2.gz HUSIXFFYJMKZGG-WNJRYGEDSA-N 1 1 356.466 4.279 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015181 1090044922 /nfs/dbraw/zinc/04/49/22/1090044922.db2.gz SWSULRIABIVZIX-PKOBYXMFSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015181 1090044935 /nfs/dbraw/zinc/04/49/35/1090044935.db2.gz SWSULRIABIVZIX-PKOBYXMFSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015181 1090044948 /nfs/dbraw/zinc/04/49/48/1090044948.db2.gz SWSULRIABIVZIX-PKOBYXMFSA-N 1 1 353.466 4.158 20 5 FIBDMO CCN(Cc1csc([N+](=O)[O-])c1)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000110265486 1090377845 /nfs/dbraw/zinc/37/78/45/1090377845.db2.gz DUOCUOHNQXIJPK-YJBOKZPZSA-N 1 1 359.495 4.314 20 5 FIBDMO O=C(CC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000511606397 1090688438 /nfs/dbraw/zinc/68/84/38/1090688438.db2.gz VLKTYIOCIXMANL-QGZVFWFLSA-N 1 1 359.813 4.024 20 5 FIBDMO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1Cc2ccccc2C1 ZINC000511641646 1090993916 /nfs/dbraw/zinc/99/39/16/1090993916.db2.gz STLUNNVOLVLKCI-UHFFFAOYSA-N 1 1 365.458 4.318 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000123034534 1090995245 /nfs/dbraw/zinc/99/52/45/1090995245.db2.gz CQDPBPJMZBIAJJ-KRWDZBQOSA-N 1 1 353.466 4.350 20 5 FIBDMO O=C(CC[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500066238 1091016742 /nfs/dbraw/zinc/01/67/42/1091016742.db2.gz FWAUOQWSUVALEY-OAHLLOKOSA-N 1 1 373.840 4.066 20 5 FIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500099848 1091037303 /nfs/dbraw/zinc/03/73/03/1091037303.db2.gz VGBLFXRSFBSNFT-KUHUBIRLSA-N 1 1 371.412 4.146 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000500124995 1091050601 /nfs/dbraw/zinc/05/06/01/1091050601.db2.gz PDGXOHPSFSCAEV-INIZCTEOSA-N 1 1 355.438 4.233 20 5 FIBDMO CCC1(CC)[C@H](OC)C[C@@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001167766316 1091600034 /nfs/dbraw/zinc/60/00/34/1091600034.db2.gz KHLSKZFDWZAHKU-RBUKOAKNSA-N 1 1 364.486 4.408 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@@H]32)c(Cl)c1 ZINC000511764955 1091649904 /nfs/dbraw/zinc/64/99/04/1091649904.db2.gz KGZYDFJGWBDDSD-HBFSDRIKSA-N 1 1 372.852 4.253 20 5 FIBDMO CC[N@@H+](CCc1cccs1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899110 1091783529 /nfs/dbraw/zinc/78/35/29/1091783529.db2.gz CCLHIGYBUYONBU-UHFFFAOYSA-N 1 1 356.451 4.042 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+]C1(c2ccc(Cl)cc2)CCOCC1 ZINC000107899154 1091973605 /nfs/dbraw/zinc/97/36/05/1091973605.db2.gz IUXSYXAMSLBYIV-UHFFFAOYSA-N 1 1 364.804 4.183 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512262128 1091975857 /nfs/dbraw/zinc/97/58/57/1091975857.db2.gz RUOQLTCUSUTJFN-HNNXBMFYSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512262128 1091975859 /nfs/dbraw/zinc/97/58/59/1091975859.db2.gz RUOQLTCUSUTJFN-HNNXBMFYSA-N 1 1 353.422 4.067 20 5 FIBDMO C[N@H+](Cc1ccc2ccccc2c1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000015306321 1092314461 /nfs/dbraw/zinc/31/44/61/1092314461.db2.gz OTGZACXQBCMMGK-UHFFFAOYSA-N 1 1 364.401 4.247 20 5 FIBDMO C[N@@H+](Cc1ccc2ccccc2c1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000015306321 1092314472 /nfs/dbraw/zinc/31/44/72/1092314472.db2.gz OTGZACXQBCMMGK-UHFFFAOYSA-N 1 1 364.401 4.247 20 5 FIBDMO C[NH+](C)[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000432786169 1092358788 /nfs/dbraw/zinc/35/87/88/1092358788.db2.gz CBPQUBODDQTIIG-INIZCTEOSA-N 1 1 359.495 4.239 20 5 FIBDMO COc1ccc2cc(C[N@H+](C)Cc3cc([N+](=O)[O-])ccc3OC)ccc2c1 ZINC000015370354 1092438186 /nfs/dbraw/zinc/43/81/86/1092438186.db2.gz PAXGMHXXRNMYEK-UHFFFAOYSA-N 1 1 366.417 4.397 20 5 FIBDMO COc1ccc2cc(C[N@@H+](C)Cc3cc([N+](=O)[O-])ccc3OC)ccc2c1 ZINC000015370354 1092438187 /nfs/dbraw/zinc/43/81/87/1092438187.db2.gz PAXGMHXXRNMYEK-UHFFFAOYSA-N 1 1 366.417 4.397 20 5 FIBDMO C[NH+](C)Cc1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)ccc1Cl ZINC000500778665 1092566484 /nfs/dbraw/zinc/56/64/84/1092566484.db2.gz KALMVHAVNXTHJR-UHFFFAOYSA-N 1 1 368.220 4.216 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000512535440 1092670941 /nfs/dbraw/zinc/67/09/41/1092670941.db2.gz ABXUFNXHJOLCRU-UHFFFAOYSA-N 1 1 362.470 4.307 20 5 FIBDMO CC[N@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236931171 1092811071 /nfs/dbraw/zinc/81/10/71/1092811071.db2.gz MRJDBGXORUAEJY-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CC[N@@H+]1CCC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236931171 1092811085 /nfs/dbraw/zinc/81/10/85/1092811085.db2.gz MRJDBGXORUAEJY-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CC[N@H+]1CCC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236931171 1092811099 /nfs/dbraw/zinc/81/10/99/1092811099.db2.gz MRJDBGXORUAEJY-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CCN1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236931171 1092811113 /nfs/dbraw/zinc/81/11/13/1092811113.db2.gz MRJDBGXORUAEJY-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CCC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000178729605 1093263388 /nfs/dbraw/zinc/26/33/88/1093263388.db2.gz FOANSCJDKUAKDT-QGZVFWFLSA-N 1 1 359.382 4.143 20 5 FIBDMO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)on1 ZINC000509828671 1093465374 /nfs/dbraw/zinc/46/53/74/1093465374.db2.gz UWIFGELMTCYSQX-QGZVFWFLSA-N 1 1 353.378 4.488 20 5 FIBDMO Cc1ccc2[nH]c(C[NH2+][C@@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000433288417 1093544371 /nfs/dbraw/zinc/54/43/71/1093544371.db2.gz NRGYKALADJDFLM-GOSISDBHSA-N 1 1 350.422 4.292 20 5 FIBDMO Cc1ccc2nc(C[NH2+][C@@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)[nH]c2c1 ZINC000433288417 1093544384 /nfs/dbraw/zinc/54/43/84/1093544384.db2.gz NRGYKALADJDFLM-GOSISDBHSA-N 1 1 350.422 4.292 20 5 FIBDMO CC(C)c1nc2n(n1)CCC[C@H]2[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433305511 1093560242 /nfs/dbraw/zinc/56/02/42/1093560242.db2.gz PRUAPRTWVFIBGB-IAGOWNOFSA-N 1 1 369.469 4.157 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](Cc1ccccc1)CC1(O)CCCC1 ZINC000474213195 1093590542 /nfs/dbraw/zinc/59/05/42/1093590542.db2.gz PMYJQNOVKDJOST-UHFFFAOYSA-N 1 1 358.413 4.041 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](Cc1ccccc1)CC1(O)CCCC1 ZINC000474213195 1093590549 /nfs/dbraw/zinc/59/05/49/1093590549.db2.gz PMYJQNOVKDJOST-UHFFFAOYSA-N 1 1 358.413 4.041 20 5 FIBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNc3ccc([N+](=O)[O-])nc3)cc2)C1 ZINC000549915915 1093897924 /nfs/dbraw/zinc/89/79/24/1093897924.db2.gz NBBLKIVDXZYXTC-IYBDPMFKSA-N 1 1 354.454 4.080 20 5 FIBDMO Cc1c([C@H](C)[NH2+]Cc2cccnc2OCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000151117575 1093904060 /nfs/dbraw/zinc/90/40/60/1093904060.db2.gz GYNGCPCCSIYFDE-LBPRGKRZSA-N 1 1 369.343 4.090 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cccnc2OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000151113743 1093904236 /nfs/dbraw/zinc/90/42/36/1093904236.db2.gz WKONZBMEWIOCPM-GFCCVEGCSA-N 1 1 369.343 4.090 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513246817 1094034570 /nfs/dbraw/zinc/03/45/70/1094034570.db2.gz DDEDYOHJOWZZQY-QRWLVFNGSA-N 1 1 367.449 4.315 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000513256911 1094039737 /nfs/dbraw/zinc/03/97/37/1094039737.db2.gz OKOGUIDEMRCSBI-RDTXWAMCSA-N 1 1 364.405 4.228 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000513277617 1094044992 /nfs/dbraw/zinc/04/49/92/1094044992.db2.gz YYEXHAKRNPKINL-IFXJQAMLSA-N 1 1 354.406 4.044 20 5 FIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(Cn2cc[nH+]c2C(C)C)cc1OC ZINC000513580428 1094220408 /nfs/dbraw/zinc/22/04/08/1094220408.db2.gz NZALOAJGRLJEPC-AWEZNQCLSA-N 1 1 361.442 4.397 20 5 FIBDMO O=C(CC[N@H+]1CCC[C@H]1/C=C\c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000500989012 1094403535 /nfs/dbraw/zinc/40/35/35/1094403535.db2.gz JVSCMJRPDACMND-SQVRQVGWSA-N 1 1 365.433 4.101 20 5 FIBDMO CCCn1nccc1C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000501554707 1094776441 /nfs/dbraw/zinc/77/64/41/1094776441.db2.gz WCXJNEZKLGDRCF-UHFFFAOYSA-N 1 1 362.861 4.234 20 5 FIBDMO Cc1ccccc1-n1nccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000474946241 1094938882 /nfs/dbraw/zinc/93/88/82/1094938882.db2.gz UCDXNMNOTXBONA-UHFFFAOYSA-N 1 1 356.813 4.032 20 5 FIBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000501852323 1094970812 /nfs/dbraw/zinc/97/08/12/1094970812.db2.gz QTIOXBXIBINTPN-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO CCOc1cc(C[N@H+]2CCS[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000617201111 1095123761 /nfs/dbraw/zinc/12/37/61/1095123761.db2.gz MADMNHJYWWISGA-IBGZPJMESA-N 1 1 358.463 4.284 20 5 FIBDMO COc1cc(C[NH2+][C@H](CC(F)F)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000420990467 1095216938 /nfs/dbraw/zinc/21/69/38/1095216938.db2.gz FTRGVJUPPVQBAV-CQSZACIVSA-N 1 1 354.328 4.229 20 5 FIBDMO COCCc1cc[nH+]c(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)c1 ZINC000508452366 1095232917 /nfs/dbraw/zinc/23/29/17/1095232917.db2.gz NRMHDICIJKLZGF-UHFFFAOYSA-N 1 1 353.378 4.051 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421008296 1095241151 /nfs/dbraw/zinc/24/11/51/1095241151.db2.gz LWXXNZMXHIUJBN-AWEZNQCLSA-N 1 1 361.467 4.375 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421008296 1095241157 /nfs/dbraw/zinc/24/11/57/1095241157.db2.gz LWXXNZMXHIUJBN-AWEZNQCLSA-N 1 1 361.467 4.375 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000502342893 1095376851 /nfs/dbraw/zinc/37/68/51/1095376851.db2.gz DGKBNSLFCIGBPF-GNJLHFKMSA-N 1 1 366.465 4.020 20 5 FIBDMO C[N@@H+](Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000513750901 1095713410 /nfs/dbraw/zinc/71/34/10/1095713410.db2.gz RDSCUMZPCGUPMW-CQSZACIVSA-N 1 1 362.813 4.261 20 5 FIBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000444239942 1095896249 /nfs/dbraw/zinc/89/62/49/1095896249.db2.gz CUTLIIQQFIWKEG-VKJFTORMSA-N 1 1 355.438 4.445 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]C2(c3nc(C)cs3)CCC2)cc1[N+](=O)[O-] ZINC000271939390 1096141395 /nfs/dbraw/zinc/14/13/95/1096141395.db2.gz GWTJRWZHEAWVLL-ZDUSSCGKSA-N 1 1 361.467 4.488 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Oc3cnccn3)cc2)c(Cl)c1 ZINC000183805051 1096204504 /nfs/dbraw/zinc/20/45/04/1096204504.db2.gz SGDKMVFJGWEBPL-UHFFFAOYSA-N 1 1 370.796 4.120 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c[nH]nc2-c2ccccc2F)c(Cl)c1 ZINC000183808342 1096210381 /nfs/dbraw/zinc/21/03/81/1096210381.db2.gz WIAGEUDWZKAVCV-UHFFFAOYSA-N 1 1 360.776 4.067 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000423483762 1096703631 /nfs/dbraw/zinc/70/36/31/1096703631.db2.gz ZICCFENHIVBQFI-MOXGXCLJSA-N 1 1 371.456 4.086 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)Cc1csc2ccccc12 ZINC000532917647 1098608091 /nfs/dbraw/zinc/60/80/91/1098608091.db2.gz HCRCZTPBUSMVGR-UHFFFAOYSA-N 1 1 369.446 4.188 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)Cc1csc2ccccc12 ZINC000532917647 1098608093 /nfs/dbraw/zinc/60/80/93/1098608093.db2.gz HCRCZTPBUSMVGR-UHFFFAOYSA-N 1 1 369.446 4.188 20 5 FIBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000532935231 1098628302 /nfs/dbraw/zinc/62/83/02/1098628302.db2.gz YJSRCJNCQMSHRZ-SFHVURJKSA-N 1 1 371.437 4.015 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000532978558 1098648564 /nfs/dbraw/zinc/64/85/64/1098648564.db2.gz VQDBAYMHZONZSK-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)c1 ZINC000515770781 1098923656 /nfs/dbraw/zinc/92/36/56/1098923656.db2.gz XIDPLEDUMYMJND-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)c1 ZINC000515770781 1098923657 /nfs/dbraw/zinc/92/36/57/1098923657.db2.gz XIDPLEDUMYMJND-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000533303366 1098955456 /nfs/dbraw/zinc/95/54/56/1098955456.db2.gz RIKOFMFWADKGLF-HIFRSBDPSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000533303366 1098955458 /nfs/dbraw/zinc/95/54/58/1098955458.db2.gz RIKOFMFWADKGLF-HIFRSBDPSA-N 1 1 373.840 4.065 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425556540 1099032331 /nfs/dbraw/zinc/03/23/31/1099032331.db2.gz UPPBKSLAGCSYFB-QGZVFWFLSA-N 1 1 350.846 4.029 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000533434867 1099054045 /nfs/dbraw/zinc/05/40/45/1099054045.db2.gz DFQIIOQBKQCCOQ-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000533434867 1099054059 /nfs/dbraw/zinc/05/40/59/1099054059.db2.gz DFQIIOQBKQCCOQ-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000533560039 1099171116 /nfs/dbraw/zinc/17/11/16/1099171116.db2.gz XFAQKIABPSFWLL-CQSZACIVSA-N 1 1 355.369 4.255 20 5 FIBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1[C@@H]1CCCO1 ZINC000516357247 1099407386 /nfs/dbraw/zinc/40/73/86/1099407386.db2.gz TZNNOCNOJBFYSX-RBUKOAKNSA-N 1 1 356.422 4.244 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@H+](C)Cc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000026343136 1099571930 /nfs/dbraw/zinc/57/19/30/1099571930.db2.gz UWDCGMVUXFVJMN-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+](C)Cc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000026343136 1099571940 /nfs/dbraw/zinc/57/19/40/1099571940.db2.gz UWDCGMVUXFVJMN-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO CCN(Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000517124072 1100092171 /nfs/dbraw/zinc/09/21/71/1100092171.db2.gz MAIRGSJOPZZJPG-LAUBAEHRSA-N 1 1 353.466 4.252 20 5 FIBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536673571 1100157645 /nfs/dbraw/zinc/15/76/45/1100157645.db2.gz MECBUBCCKIBXKE-QRGKHIHXSA-N 1 1 365.477 4.062 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](C)C2(CCC2)C1 ZINC000536703803 1100211156 /nfs/dbraw/zinc/21/11/56/1100211156.db2.gz ZNINXKKZJTYCPH-QWHCGFSZSA-N 1 1 365.861 4.087 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H](C)C2(CCC2)C1 ZINC000536703803 1100211173 /nfs/dbraw/zinc/21/11/73/1100211173.db2.gz ZNINXKKZJTYCPH-QWHCGFSZSA-N 1 1 365.861 4.087 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000536848560 1100360400 /nfs/dbraw/zinc/36/04/00/1100360400.db2.gz YOOSFXWGMHWYRL-IAQYHMDHSA-N 1 1 362.813 4.431 20 5 FIBDMO CCC1(CC)CC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438495586 1100697185 /nfs/dbraw/zinc/69/71/85/1100697185.db2.gz RFGBXFPOXIPZDF-GFCCVEGCSA-N 1 1 353.850 4.087 20 5 FIBDMO CCC1(CC)CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438495586 1100697190 /nfs/dbraw/zinc/69/71/90/1100697190.db2.gz RFGBXFPOXIPZDF-GFCCVEGCSA-N 1 1 353.850 4.087 20 5 FIBDMO COc1cc(C[NH2+]Cc2ccc(-c3ccccc3)o2)c([N+](=O)[O-])cc1OC ZINC000509570924 1100959259 /nfs/dbraw/zinc/95/92/59/1100959259.db2.gz KWJGGROFGUVYJZ-UHFFFAOYSA-N 1 1 368.389 4.162 20 5 FIBDMO C[C@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@@H+]1CCC[C@@H](C)C1 ZINC000518264562 1101049418 /nfs/dbraw/zinc/04/94/18/1101049418.db2.gz GRKWSQDBESDYOK-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@H+]1CCC[C@@H](C)C1 ZINC000518264562 1101049424 /nfs/dbraw/zinc/04/94/24/1101049424.db2.gz GRKWSQDBESDYOK-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000459673172 1101313400 /nfs/dbraw/zinc/31/34/00/1101313400.db2.gz IYPHICAPMVVODH-ZWKOTPCHSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1ccccc1C=CC[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000506617547 1101570273 /nfs/dbraw/zinc/57/02/73/1101570273.db2.gz PCQNLJYAMRKSCU-GQCTYLIASA-N 1 1 360.417 4.274 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1ccccc1Cl ZINC000026224943 1101944238 /nfs/dbraw/zinc/94/42/38/1101944238.db2.gz BTRNHCRUROSWMY-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000532475461 1102418474 /nfs/dbraw/zinc/41/84/74/1102418474.db2.gz NZWNHUUYMGXZSK-FQEVSTJZSA-N 1 1 367.449 4.377 20 5 FIBDMO Cn1cnc([N+](=O)[O-])c1C[N@@H+](Cc1cccc2ccccc21)C1CCCC1 ZINC000475877588 1102545430 /nfs/dbraw/zinc/54/54/30/1102545430.db2.gz VEGXJCWRYPBTGL-UHFFFAOYSA-N 1 1 364.449 4.426 20 5 FIBDMO Cc1cc(NC(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000473771006 1102708865 /nfs/dbraw/zinc/70/88/65/1102708865.db2.gz AZYRTZIZYPPFIM-UHFFFAOYSA-N 1 1 374.485 4.023 20 5 FIBDMO O=C(CC[N@H+]1CCC[C@H](c2ccccc2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000550990857 1102750872 /nfs/dbraw/zinc/75/08/72/1102750872.db2.gz BYGJVBUQRQELGW-SFHVURJKSA-N 1 1 367.449 4.193 20 5 FIBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000507008467 1103030036 /nfs/dbraw/zinc/03/00/36/1103030036.db2.gz UCPXSOKTUMSEHW-NVXWUHKLSA-N 1 1 362.433 4.390 20 5 FIBDMO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507154151 1103173541 /nfs/dbraw/zinc/17/35/41/1103173541.db2.gz HTTYBJWPJBXICK-UHFFFAOYSA-N 1 1 356.470 4.328 20 5 FIBDMO Cc1nn(C(C)(C)C)c(C)c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507154151 1103173549 /nfs/dbraw/zinc/17/35/49/1103173549.db2.gz HTTYBJWPJBXICK-UHFFFAOYSA-N 1 1 356.470 4.328 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cnn(-c3ccc(F)cc3)c2)C2CC2)cc1 ZINC000507169812 1103189281 /nfs/dbraw/zinc/18/92/81/1103189281.db2.gz XGOJKVZRXOWWLU-UHFFFAOYSA-N 1 1 366.396 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cnn(-c3ccc(F)cc3)c2)C2CC2)cc1 ZINC000507169812 1103189285 /nfs/dbraw/zinc/18/92/85/1103189285.db2.gz XGOJKVZRXOWWLU-UHFFFAOYSA-N 1 1 366.396 4.084 20 5 FIBDMO CC[N@@H+](Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1)C1CC1 ZINC000507221341 1103214000 /nfs/dbraw/zinc/21/40/00/1103214000.db2.gz IKPLGWLHYTWTHN-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1coc(-c3cccs3)n1)CCC2 ZINC000192738285 1103402750 /nfs/dbraw/zinc/40/27/50/1103402750.db2.gz UVNNYGNKXNVSNC-MRXNPFEDSA-N 1 1 355.419 4.479 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000537710273 1103871348 /nfs/dbraw/zinc/87/13/48/1103871348.db2.gz MCSRIVAOTYYOQW-UHFFFAOYSA-N 1 1 368.302 4.361 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000537710273 1103871363 /nfs/dbraw/zinc/87/13/63/1103871363.db2.gz MCSRIVAOTYYOQW-UHFFFAOYSA-N 1 1 368.302 4.361 20 5 FIBDMO Cc1c([C@@H](C)[NH2+][C@H](CO)c2cccc(Cl)c2F)cccc1[N+](=O)[O-] ZINC000467414314 1104061766 /nfs/dbraw/zinc/06/17/66/1104061766.db2.gz SRJCMWZUYXBCPA-IAQYHMDHSA-N 1 1 352.793 4.080 20 5 FIBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000441171972 1104181921 /nfs/dbraw/zinc/18/19/21/1104181921.db2.gz GVGLXXRYRRONML-OAHLLOKOSA-N 1 1 362.451 4.053 20 5 FIBDMO Cc1ccc(C)c([C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)[C@H](C)CO2)c1 ZINC000441448599 1104516528 /nfs/dbraw/zinc/51/65/28/1104516528.db2.gz LEQZFFCOXSUFMX-UTKZUKDTSA-N 1 1 354.450 4.216 20 5 FIBDMO C[NH+](C)[C@@H](CNCc1csc([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000184530456 1104699896 /nfs/dbraw/zinc/69/98/96/1104699896.db2.gz NZUNHUZIJSAAHI-AWEZNQCLSA-N 1 1 373.400 4.068 20 5 FIBDMO COc1cc(F)c([C@H](C)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1OC ZINC000574703004 1105024211 /nfs/dbraw/zinc/02/42/11/1105024211.db2.gz KFWQZOFYYZMOAX-MEDUHNTESA-N 1 1 360.385 4.089 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)c1Br ZINC000839581730 1105132911 /nfs/dbraw/zinc/13/29/11/1105132911.db2.gz VCRUOLLOIZJGDE-VIFPVBQESA-N 1 1 367.165 4.132 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1Br ZINC000839581730 1105132913 /nfs/dbraw/zinc/13/29/13/1105132913.db2.gz VCRUOLLOIZJGDE-VIFPVBQESA-N 1 1 367.165 4.132 20 5 FIBDMO CC(C)(O)[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000428074371 1105364911 /nfs/dbraw/zinc/36/49/11/1105364911.db2.gz HPASKIOMKRWYKW-QGZVFWFLSA-N 1 1 364.829 4.244 20 5 FIBDMO C[C@]1(O)CCCC[C@@H]1[C@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000450958329 1106844159 /nfs/dbraw/zinc/84/41/59/1106844159.db2.gz MVSKJDFDIGYJGA-OLMNPRSZSA-N 1 1 352.862 4.154 20 5 FIBDMO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451543129 1107164107 /nfs/dbraw/zinc/16/41/07/1107164107.db2.gz AYLZMBYVRDHILB-DZGCQCFKSA-N 1 1 361.467 4.138 20 5 FIBDMO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451543129 1107164118 /nfs/dbraw/zinc/16/41/18/1107164118.db2.gz AYLZMBYVRDHILB-DZGCQCFKSA-N 1 1 361.467 4.138 20 5 FIBDMO O=[N+]([O-])c1cc(CN2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)cs1 ZINC000530865478 1107369800 /nfs/dbraw/zinc/36/98/00/1107369800.db2.gz SJTHQJMETZOOSV-HXUWFJFHSA-N 1 1 371.506 4.144 20 5 FIBDMO C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1c1cccc(F)c1 ZINC000531104747 1107537431 /nfs/dbraw/zinc/53/74/31/1107537431.db2.gz UYGSNDBOHLYKLA-BFUOFWGJSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1c1cccc(F)c1 ZINC000531104747 1107537437 /nfs/dbraw/zinc/53/74/37/1107537437.db2.gz UYGSNDBOHLYKLA-BFUOFWGJSA-N 1 1 372.396 4.184 20 5 FIBDMO CCN(CC)C(=O)[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000531203847 1107645558 /nfs/dbraw/zinc/64/55/58/1107645558.db2.gz YHNKBCYOXNDDDV-JXFKEZNVSA-N 1 1 369.465 4.164 20 5 FIBDMO Cc1c([C@H](C)[NH2+][C@H](c2cnn(C)c2)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000186646830 1107832523 /nfs/dbraw/zinc/83/25/23/1107832523.db2.gz UPYUVIKXUZRZHK-XOBRGWDASA-N 1 1 368.412 4.216 20 5 FIBDMO Cc1ccc(F)c(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)c1 ZINC000444730528 1108118818 /nfs/dbraw/zinc/11/88/18/1108118818.db2.gz IFRYRDORJCISLV-UHFFFAOYSA-N 1 1 369.396 4.372 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@H](OCC4CC4)C3)cs2)c1 ZINC000428376551 1108151458 /nfs/dbraw/zinc/15/14/58/1108151458.db2.gz QKXIMECNAIAVLE-SFHVURJKSA-N 1 1 373.478 4.109 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H](OCC4CC4)C3)cs2)c1 ZINC000428376551 1108151464 /nfs/dbraw/zinc/15/14/64/1108151464.db2.gz QKXIMECNAIAVLE-SFHVURJKSA-N 1 1 373.478 4.109 20 5 FIBDMO COc1ccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C)c1 ZINC000532212197 1108714164 /nfs/dbraw/zinc/71/41/64/1108714164.db2.gz DCTMSFBMASOIEV-UHFFFAOYSA-N 1 1 369.446 4.325 20 5 FIBDMO C[C@H]1SCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000524035662 1108765726 /nfs/dbraw/zinc/76/57/26/1108765726.db2.gz AEPBTNDZKJWZHG-BEFAXECRSA-N 1 1 358.463 4.152 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@H](O)[C@@H](C)C3)cc2[N+](=O)[O-])cc1 ZINC000428449203 1109292546 /nfs/dbraw/zinc/29/25/46/1109292546.db2.gz SIIPYNXDKUZYHA-KXBFYZLASA-N 1 1 372.490 4.257 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@H+]3CC[C@H](O)[C@@H](C)C3)cc2[N+](=O)[O-])cc1 ZINC000428449203 1109292547 /nfs/dbraw/zinc/29/25/47/1109292547.db2.gz SIIPYNXDKUZYHA-KXBFYZLASA-N 1 1 372.490 4.257 20 5 FIBDMO CC[C@H]1c2ccsc2CC[N@@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000441171969 1109400149 /nfs/dbraw/zinc/40/01/49/1109400149.db2.gz GVGLXXRYRRONML-HNNXBMFYSA-N 1 1 362.451 4.053 20 5 FIBDMO CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000428483951 1109531194 /nfs/dbraw/zinc/53/11/94/1109531194.db2.gz KUSDYMUAALSMJV-LJQANCHMSA-N 1 1 360.479 4.308 20 5 FIBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000447406708 1109535288 /nfs/dbraw/zinc/53/52/88/1109535288.db2.gz WVWOGUUFNZHTGP-QGZVFWFLSA-N 1 1 369.465 4.103 20 5 FIBDMO C[N@@H+](CCc1ccccn1)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000527357862 1109748967 /nfs/dbraw/zinc/74/89/67/1109748967.db2.gz JXUVEDARYBMKQL-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnc([C@@H]4CCCO4)s3)C2)cc1 ZINC000449495737 1110093068 /nfs/dbraw/zinc/09/30/68/1110093068.db2.gz DWPQQYQWCAGIOY-YJBOKZPZSA-N 1 1 373.478 4.282 20 5 FIBDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)c2nccn21 ZINC000449569274 1110113817 /nfs/dbraw/zinc/11/38/17/1110113817.db2.gz GNNXHZRTGHUVSK-WFASDCNBSA-N 1 1 354.435 4.315 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](C[C@@H]2CCOC2)C2CC2)s1 ZINC000129969135 1110318845 /nfs/dbraw/zinc/31/88/45/1110318845.db2.gz CWIWWZMDFZYJKO-AWEZNQCLSA-N 1 1 358.463 4.324 20 5 FIBDMO Cc1ccc(C[N@H+](Cc2ccccc2)CC2CCOCC2)cc1[N+](=O)[O-] ZINC000538729585 1111266328 /nfs/dbraw/zinc/26/63/28/1111266328.db2.gz AJQHRMJLWPVLOS-UHFFFAOYSA-N 1 1 354.450 4.332 20 5 FIBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000538738175 1111271712 /nfs/dbraw/zinc/27/17/12/1111271712.db2.gz DRFGHHJCASADIF-QAPCUYQASA-N 1 1 357.454 4.159 20 5 FIBDMO CCN1CC[C@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000538738175 1111271733 /nfs/dbraw/zinc/27/17/33/1111271733.db2.gz DRFGHHJCASADIF-QAPCUYQASA-N 1 1 357.454 4.159 20 5 FIBDMO CCN1CC[C@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000538738175 1111271737 /nfs/dbraw/zinc/27/17/37/1111271737.db2.gz DRFGHHJCASADIF-QAPCUYQASA-N 1 1 357.454 4.159 20 5 FIBDMO Cc1ccc2[nH]c([C@H]3CCC[N@@H+](Cc4ccc([N+](=O)[O-])cc4F)C3)nc2c1 ZINC000539247584 1111485669 /nfs/dbraw/zinc/48/56/69/1111485669.db2.gz IDUPLAURYWXVAO-HNNXBMFYSA-N 1 1 368.412 4.298 20 5 FIBDMO Cc1ccc2nc([C@H]3CCC[N@H+](Cc4ccc([N+](=O)[O-])cc4F)C3)[nH]c2c1 ZINC000539247584 1111485673 /nfs/dbraw/zinc/48/56/73/1111485673.db2.gz IDUPLAURYWXVAO-HNNXBMFYSA-N 1 1 368.412 4.298 20 5 FIBDMO Cc1ccc2nc([C@H]3CCC[N@@H+](Cc4ccc([N+](=O)[O-])cc4F)C3)[nH]c2c1 ZINC000539247584 1111485675 /nfs/dbraw/zinc/48/56/75/1111485675.db2.gz IDUPLAURYWXVAO-HNNXBMFYSA-N 1 1 368.412 4.298 20 5 FIBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000478046332 1111663648 /nfs/dbraw/zinc/66/36/48/1111663648.db2.gz MSJTWEBPEYGVMW-FQEVSTJZSA-N 1 1 368.412 4.042 20 5 FIBDMO Cc1c([C@H](C)NCCC[N@@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000480231094 1112342520 /nfs/dbraw/zinc/34/25/20/1112342520.db2.gz NDCOKWKTHZQLGW-KRWDZBQOSA-N 1 1 353.466 4.002 20 5 FIBDMO Cc1c([C@H](C)NCCC[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000480231094 1112342526 /nfs/dbraw/zinc/34/25/26/1112342526.db2.gz NDCOKWKTHZQLGW-KRWDZBQOSA-N 1 1 353.466 4.002 20 5 FIBDMO COc1cc(C[N@@H+]2CCC(C)=C(C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000482456683 1113260992 /nfs/dbraw/zinc/26/09/92/1113260992.db2.gz IQWJVQKOGYZMSK-UHFFFAOYSA-N 1 1 374.359 4.087 20 5 FIBDMO COc1cc(C[N@H+]2CCC(C)=C(C)C2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000482456683 1113260997 /nfs/dbraw/zinc/26/09/97/1113260997.db2.gz IQWJVQKOGYZMSK-UHFFFAOYSA-N 1 1 374.359 4.087 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](Cc3ccoc3)C3CCCCC3)nc2c1 ZINC000482706645 1113337227 /nfs/dbraw/zinc/33/72/27/1113337227.db2.gz QJAAYPMYNXZWTF-UHFFFAOYSA-N 1 1 354.410 4.399 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](Cc3ccoc3)C3CCCCC3)nc2c1 ZINC000482706645 1113337232 /nfs/dbraw/zinc/33/72/32/1113337232.db2.gz QJAAYPMYNXZWTF-UHFFFAOYSA-N 1 1 354.410 4.399 20 5 FIBDMO CCC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)c1nnc2ccccn21 ZINC000129193067 1113647360 /nfs/dbraw/zinc/64/73/60/1113647360.db2.gz XQWIANXTRREHSC-HOCLYGCPSA-N 1 1 353.426 4.138 20 5 FIBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CSc3ccc(Br)cc32)c1 ZINC000486801524 1113652956 /nfs/dbraw/zinc/65/29/56/1113652956.db2.gz UUTSENKEZISXGX-CQSZACIVSA-N 1 1 365.252 4.294 20 5 FIBDMO Cc1cc(F)ccc1C[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000488117186 1113859299 /nfs/dbraw/zinc/85/92/99/1113859299.db2.gz YPQDDFVAWSOBOT-ZDUSSCGKSA-N 1 1 370.384 4.285 20 5 FIBDMO Cc1cc(F)ccc1C[N@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000488117186 1113859301 /nfs/dbraw/zinc/85/93/01/1113859301.db2.gz YPQDDFVAWSOBOT-ZDUSSCGKSA-N 1 1 370.384 4.285 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000150324820 1113900688 /nfs/dbraw/zinc/90/06/88/1113900688.db2.gz KDHGVXXPUAMIPW-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO CC[N@H+](Cc1ccc(Cl)cc1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488322607 1113911454 /nfs/dbraw/zinc/91/14/54/1113911454.db2.gz JYLVLCYMBIMNCE-CYBMUJFWSA-N 1 1 361.829 4.097 20 5 FIBDMO CC[N@@H+](Cc1ccc(Cl)cc1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488322607 1113911455 /nfs/dbraw/zinc/91/14/55/1113911455.db2.gz JYLVLCYMBIMNCE-CYBMUJFWSA-N 1 1 361.829 4.097 20 5 FIBDMO CCOc1cc(C[NH2+][C@@H](COC)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000488688213 1113973503 /nfs/dbraw/zinc/97/35/03/1113973503.db2.gz HNODICKZDYXODP-INIZCTEOSA-N 1 1 364.829 4.124 20 5 FIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000489092584 1114049192 /nfs/dbraw/zinc/04/91/92/1114049192.db2.gz CEPYUHWNPRZLRL-GOSISDBHSA-N 1 1 356.422 4.121 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000138780053 1114138242 /nfs/dbraw/zinc/13/82/42/1114138242.db2.gz IIVMFEZVAQQYPH-UHFFFAOYSA-N 1 1 371.437 4.270 20 5 FIBDMO CCn1c2ccccc2nc1[C@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000490152633 1114219003 /nfs/dbraw/zinc/21/90/03/1114219003.db2.gz OQQXGOQGEIXEFI-HXUWFJFHSA-N 1 1 364.449 4.344 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+]C1(c2ccc(F)cc2)CCOCC1 ZINC000490132656 1114222695 /nfs/dbraw/zinc/22/26/95/1114222695.db2.gz KIXSASRFZNMVJI-UHFFFAOYSA-N 1 1 364.804 4.183 20 5 FIBDMO C[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)[C@@H]1CCc2ccccc21 ZINC000029312869 1114278642 /nfs/dbraw/zinc/27/86/42/1114278642.db2.gz MSUQMAAJIHTWRP-OAHLLOKOSA-N 1 1 355.419 4.449 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)c1OC ZINC000572323415 1114629941 /nfs/dbraw/zinc/62/99/41/1114629941.db2.gz HMZABQRZHSARFY-UHFFFAOYSA-N 1 1 358.438 4.331 20 5 FIBDMO Cc1cc(N[C@@H](Cc2[nH+]ccn2C)c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000589688577 1114828005 /nfs/dbraw/zinc/82/80/05/1114828005.db2.gz DFOFGOADNCOPAT-INIZCTEOSA-N 1 1 354.385 4.172 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1nn(-c2ccccc2)c2c1CCC2 ZINC000573814931 1115184386 /nfs/dbraw/zinc/18/43/86/1115184386.db2.gz KGNUWZJWZLGZGU-LJQANCHMSA-N 1 1 374.444 4.046 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3(c4cccc(Cl)c4)CCC3)nc2c1 ZINC000592185090 1115222428 /nfs/dbraw/zinc/22/24/28/1115222428.db2.gz VJNVNYZGBWGCIE-UHFFFAOYSA-N 1 1 356.813 4.294 20 5 FIBDMO CC[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@H]1[NH3+] ZINC000592427718 1115306958 /nfs/dbraw/zinc/30/69/58/1115306958.db2.gz TUCIYQAQAIGIKG-SJKOYZFVSA-N 1 1 363.845 4.067 20 5 FIBDMO COc1ccc(C[NH2+]Cc2ccc(-c3ccco3)cc2F)cc1[N+](=O)[O-] ZINC000574267199 1115317151 /nfs/dbraw/zinc/31/71/51/1115317151.db2.gz WJRMWJCBRCANDJ-UHFFFAOYSA-N 1 1 356.353 4.292 20 5 FIBDMO C[C@@H]1CC2(C[N@H+]1Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)CCOCC2 ZINC000592526021 1115341729 /nfs/dbraw/zinc/34/17/29/1115341729.db2.gz FMFXGBZXACKUIF-OAHLLOKOSA-N 1 1 356.422 4.246 20 5 FIBDMO COc1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000574663556 1115427889 /nfs/dbraw/zinc/42/78/89/1115427889.db2.gz YMYRFDQHZKMFMG-OAHLLOKOSA-N 1 1 358.360 4.158 20 5 FIBDMO COc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000574663556 1115427893 /nfs/dbraw/zinc/42/78/93/1115427893.db2.gz YMYRFDQHZKMFMG-OAHLLOKOSA-N 1 1 358.360 4.158 20 5 FIBDMO COc1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000574663555 1115427988 /nfs/dbraw/zinc/42/79/88/1115427988.db2.gz YMYRFDQHZKMFMG-HNNXBMFYSA-N 1 1 358.360 4.158 20 5 FIBDMO COc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1[N+](=O)[O-] ZINC000574663555 1115427992 /nfs/dbraw/zinc/42/79/92/1115427992.db2.gz YMYRFDQHZKMFMG-HNNXBMFYSA-N 1 1 358.360 4.158 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@H](OC4CCC4)C3)cs2)c1 ZINC000594613742 1115470999 /nfs/dbraw/zinc/47/09/99/1115470999.db2.gz SONXHINAUHKEGP-SFHVURJKSA-N 1 1 373.478 4.252 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H](OC4CCC4)C3)cs2)c1 ZINC000594613742 1115471000 /nfs/dbraw/zinc/47/10/00/1115471000.db2.gz SONXHINAUHKEGP-SFHVURJKSA-N 1 1 373.478 4.252 20 5 FIBDMO COc1cccc(OC)c1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000595074693 1115509171 /nfs/dbraw/zinc/50/91/71/1115509171.db2.gz UCEYBUXYUZSRIR-KRWDZBQOSA-N 1 1 356.422 4.124 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1cn(C(C)(C)C)nc1C ZINC000595033938 1115510695 /nfs/dbraw/zinc/51/06/95/1115510695.db2.gz UBMVQABMZGXZNC-CHWSQXEVSA-N 1 1 360.458 4.275 20 5 FIBDMO COC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccc(Cl)cc1 ZINC000595050867 1115512466 /nfs/dbraw/zinc/51/24/66/1115512466.db2.gz UUAKKPMWNKWLSH-YVEFUNNKSA-N 1 1 364.829 4.295 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(c4ccco4)CC3)co2)cc1 ZINC000595616200 1115553733 /nfs/dbraw/zinc/55/37/33/1115553733.db2.gz QROBJKXLHJJNFA-UHFFFAOYSA-N 1 1 353.378 4.222 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCc2ccccc2-n2ccnc21 ZINC000596095306 1115574198 /nfs/dbraw/zinc/57/41/98/1115574198.db2.gz OSWHROKRPAAPJD-KXBFYZLASA-N 1 1 362.433 4.427 20 5 FIBDMO CC1CC[NH+]([C@@H](CNCc2cccc([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000060527700 1115660746 /nfs/dbraw/zinc/66/07/46/1115660746.db2.gz PBSDGUOCBVMBKD-NRFANRHFSA-N 1 1 353.466 4.158 20 5 FIBDMO C[N@H+]1CCCC[C@@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000599070733 1115787125 /nfs/dbraw/zinc/78/71/25/1115787125.db2.gz OGHJDWFKUBQJPS-LAUBAEHRSA-N 1 1 353.466 4.006 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000603661773 1115802152 /nfs/dbraw/zinc/80/21/52/1115802152.db2.gz YIMQJHQVXJHUGI-UHFFFAOYSA-N 1 1 358.419 4.331 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccco2)Cc2cccs2)c1 ZINC000603661773 1115802153 /nfs/dbraw/zinc/80/21/53/1115802153.db2.gz YIMQJHQVXJHUGI-UHFFFAOYSA-N 1 1 358.419 4.331 20 5 FIBDMO COc1ccc(C[N@@H+](C)CCCOc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000603869861 1115824204 /nfs/dbraw/zinc/82/42/04/1115824204.db2.gz SAKBVEYXYVCHQJ-UHFFFAOYSA-N 1 1 364.829 4.158 20 5 FIBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(C)c1 ZINC000604080753 1115846841 /nfs/dbraw/zinc/84/68/41/1115846841.db2.gz CPDPKHGYKOQELF-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(C)c1 ZINC000604080753 1115846842 /nfs/dbraw/zinc/84/68/42/1115846842.db2.gz CPDPKHGYKOQELF-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1cccc(F)c1)C(C)C ZINC000604435041 1115865390 /nfs/dbraw/zinc/86/53/90/1115865390.db2.gz QNRRMUOGSLCVTF-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCc1ccccc1)CC(C)C ZINC000604459666 1115867017 /nfs/dbraw/zinc/86/70/17/1115867017.db2.gz FLCSTNMSYFQWCC-UHFFFAOYSA-N 1 1 369.465 4.042 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCc3noc4ccccc43)C2)cc1 ZINC000594005320 1115957379 /nfs/dbraw/zinc/95/73/79/1115957379.db2.gz HBCUIHHHNYAWTQ-MRXNPFEDSA-N 1 1 351.406 4.158 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)no1)Cc1cccc([N+](=O)[O-])c1 ZINC000608780232 1116128350 /nfs/dbraw/zinc/12/83/50/1116128350.db2.gz OVVZTUZMUZLBDW-UHFFFAOYSA-N 1 1 369.396 4.454 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@@H+]4CCCC[C@H]34)s2)cc1 ZINC000608836008 1116131241 /nfs/dbraw/zinc/13/12/41/1116131241.db2.gz GSGRQPUHVODOTB-QZTJIDSGSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@H+]4CCCC[C@H]34)s2)cc1 ZINC000608836008 1116131242 /nfs/dbraw/zinc/13/12/42/1116131242.db2.gz GSGRQPUHVODOTB-QZTJIDSGSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)s1 ZINC000608836280 1116131367 /nfs/dbraw/zinc/13/13/67/1116131367.db2.gz ZIUNEYBSRQNFQZ-LSDHHAIUSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)s1 ZINC000608836280 1116131368 /nfs/dbraw/zinc/13/13/68/1116131368.db2.gz ZIUNEYBSRQNFQZ-LSDHHAIUSA-N 1 1 357.479 4.040 20 5 FIBDMO Cc1cccc(OCC[N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000534812450 1116238370 /nfs/dbraw/zinc/23/83/70/1116238370.db2.gz LKCMCCJYQFSXMG-UHFFFAOYSA-N 1 1 367.405 4.069 20 5 FIBDMO Cc1cccc(OCC[N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000534812450 1116238372 /nfs/dbraw/zinc/23/83/72/1116238372.db2.gz LKCMCCJYQFSXMG-UHFFFAOYSA-N 1 1 367.405 4.069 20 5 FIBDMO C[C@@H](C[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000534855284 1116243154 /nfs/dbraw/zinc/24/31/54/1116243154.db2.gz NYMPPWJZGDXOFN-HNNXBMFYSA-N 1 1 351.406 4.485 20 5 FIBDMO CCC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@H]1CCCCO1 ZINC000089912261 1116351667 /nfs/dbraw/zinc/35/16/67/1116351667.db2.gz YZYIRMVOOMYVJF-GOSISDBHSA-N 1 1 359.426 4.031 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]3C3CCOCC3)o2)cc1 ZINC000539669157 1116363551 /nfs/dbraw/zinc/36/35/51/1116363551.db2.gz LWRJYMQHGDSTKY-IBGZPJMESA-N 1 1 356.422 4.246 20 5 FIBDMO Cc1cnc(NCc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)c([N+](=O)[O-])c1 ZINC000463047193 1117939477 /nfs/dbraw/zinc/93/94/77/1117939477.db2.gz CKXHBELNHOAZKT-MRXNPFEDSA-N 1 1 354.454 4.285 20 5 FIBDMO C[C@H](NC1CC[NH+](CCc2ccc(F)cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000463085358 1117965408 /nfs/dbraw/zinc/96/54/08/1117965408.db2.gz PVVAIMOOCJTYIV-INIZCTEOSA-N 1 1 371.456 4.092 20 5 FIBDMO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000463189537 1118006454 /nfs/dbraw/zinc/00/64/54/1118006454.db2.gz ATIASSCSAWWBQR-GPDMMJAESA-N 1 1 368.424 4.025 20 5 FIBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000122361988 1118042935 /nfs/dbraw/zinc/04/29/35/1118042935.db2.gz PBCYDHINTAELDZ-AWEZNQCLSA-N 1 1 371.412 4.361 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000122361815 1118049215 /nfs/dbraw/zinc/04/92/15/1118049215.db2.gz PBCYDHINTAELDZ-CQSZACIVSA-N 1 1 371.412 4.361 20 5 FIBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000463486907 1118179599 /nfs/dbraw/zinc/17/95/99/1118179599.db2.gz NCHDTZJCZOFLRY-QGZVFWFLSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000463486907 1118179601 /nfs/dbraw/zinc/17/96/01/1118179601.db2.gz NCHDTZJCZOFLRY-QGZVFWFLSA-N 1 1 360.385 4.088 20 5 FIBDMO CCn1nc(C)c(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1C ZINC000540913587 1118312187 /nfs/dbraw/zinc/31/21/87/1118312187.db2.gz HTDUBJVLWKKSFR-OAQYLSRUSA-N 1 1 364.449 4.307 20 5 FIBDMO CCc1cnccc1[C@H](C)[NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000542124190 1118798414 /nfs/dbraw/zinc/79/84/14/1118798414.db2.gz VXJMZHAIUJGKEN-ZDUSSCGKSA-N 1 1 352.394 4.058 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@]3(CCCOC3)C2)c1 ZINC000549865182 1118953152 /nfs/dbraw/zinc/95/31/52/1118953152.db2.gz DDTFDXISMCJRBG-INIZCTEOSA-N 1 1 358.360 4.006 20 5 FIBDMO CC[N@@H+](CCNc1cc(C)nc2c1cccc2[N+](=O)[O-])CCC(F)(F)F ZINC000491601741 1118967649 /nfs/dbraw/zinc/96/76/49/1118967649.db2.gz NXKJKMHIBFMOOM-UHFFFAOYSA-N 1 1 370.375 4.138 20 5 FIBDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491890270 1118990748 /nfs/dbraw/zinc/99/07/48/1118990748.db2.gz NMNXEASCPHSPFO-CYBMUJFWSA-N 1 1 358.385 4.012 20 5 FIBDMO CC(C)([NH2+]Cc1cnn(Cc2ccc(F)cc2)c1)c1ccccc1[N+](=O)[O-] ZINC000492244487 1119054297 /nfs/dbraw/zinc/05/42/97/1119054297.db2.gz ZWHGUIXNCKJSOV-UHFFFAOYSA-N 1 1 368.412 4.004 20 5 FIBDMO CCOc1cc(C[N@@H+](C)[C@@H]2CCCc3nc(C)sc32)ccc1[N+](=O)[O-] ZINC000492533205 1119119650 /nfs/dbraw/zinc/11/96/50/1119119650.db2.gz IXDFHWVYKOUIPH-MRXNPFEDSA-N 1 1 361.467 4.268 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000492771369 1119189864 /nfs/dbraw/zinc/18/98/64/1119189864.db2.gz MCGFLPLYVNMHMC-ATZDWAIDSA-N 1 1 362.470 4.019 20 5 FIBDMO C[N@@H+](CCSc1c2ccccc2ncc1[N+](=O)[O-])Cc1ccccc1 ZINC000487762293 1119820729 /nfs/dbraw/zinc/82/07/29/1119820729.db2.gz PRLXSGQFIPLPCV-UHFFFAOYSA-N 1 1 353.447 4.367 20 5 FIBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000272492204 1121095723 /nfs/dbraw/zinc/09/57/23/1121095723.db2.gz FDOMOLACAVKADC-QGZVFWFLSA-N 1 1 370.478 4.047 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)ccc1Cl ZINC000154166912 1121841706 /nfs/dbraw/zinc/84/17/06/1121841706.db2.gz ICUQQEZKQYFWMB-CJNGLKHVSA-N 1 1 366.870 4.398 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000917095331 1122124322 /nfs/dbraw/zinc/12/43/22/1122124322.db2.gz IBRSEJIXXWJRPU-UHFFFAOYSA-N 1 1 363.417 4.244 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000301551228 1122219852 /nfs/dbraw/zinc/21/98/52/1122219852.db2.gz QRKNULZEKKYDQI-APWZRJJASA-N 1 1 369.465 4.206 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2COc2ccc(Cl)cc2)cs1 ZINC000917394839 1122286851 /nfs/dbraw/zinc/28/68/51/1122286851.db2.gz RDWLUXVYXXLWDU-CQSZACIVSA-N 1 1 352.843 4.353 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2COc2ccc(Cl)cc2)cs1 ZINC000917394839 1122286856 /nfs/dbraw/zinc/28/68/56/1122286856.db2.gz RDWLUXVYXXLWDU-CQSZACIVSA-N 1 1 352.843 4.353 20 5 FIBDMO CCC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000129134522 1122542298 /nfs/dbraw/zinc/54/22/98/1122542298.db2.gz UDPIVSNNHUDVDU-ZBFHGGJFSA-N 1 1 353.426 4.138 20 5 FIBDMO C[C@@H]1CCCC[C@H]1CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556873232 1123157086 /nfs/dbraw/zinc/15/70/86/1123157086.db2.gz VNIHPWKDGLFHJG-GJYPPUQNSA-N 1 1 356.470 4.224 20 5 FIBDMO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)Nc1ccc(C2CCC2)c[nH+]1 ZINC000556958537 1123272141 /nfs/dbraw/zinc/27/21/41/1123272141.db2.gz GVGXCESUBLQXFV-ZDUSSCGKSA-N 1 1 354.410 4.087 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000609540707 1123748322 /nfs/dbraw/zinc/74/83/22/1123748322.db2.gz NEJAHQBVHBUWQC-UHFFFAOYSA-N 1 1 370.449 4.032 20 5 FIBDMO C[N@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704724 1123803264 /nfs/dbraw/zinc/80/32/64/1123803264.db2.gz BTBUALFYJNCQQA-UHFFFAOYSA-N 1 1 356.756 4.482 20 5 FIBDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704724 1123803268 /nfs/dbraw/zinc/80/32/68/1123803268.db2.gz BTBUALFYJNCQQA-UHFFFAOYSA-N 1 1 356.756 4.482 20 5 FIBDMO CC[C@@H]1CCC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC1 ZINC000609766766 1123824842 /nfs/dbraw/zinc/82/48/42/1123824842.db2.gz PABJCWCFZKRJNZ-GFCCVEGCSA-N 1 1 358.385 4.217 20 5 FIBDMO CC(C)C[C@H]1CCCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000610133872 1123949366 /nfs/dbraw/zinc/94/93/66/1123949366.db2.gz BYJRVWJRZHDZSL-MRXNPFEDSA-N 1 1 358.442 4.436 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccn(-c3ccccc3F)n2)cc1[N+](=O)[O-] ZINC000180246010 1124273085 /nfs/dbraw/zinc/27/30/85/1124273085.db2.gz YCAUDBMXLGSPEV-AWEZNQCLSA-N 1 1 354.385 4.079 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(-c3ccccc3F)n2)cc1[N+](=O)[O-] ZINC000180245999 1124273214 /nfs/dbraw/zinc/27/32/14/1124273214.db2.gz YCAUDBMXLGSPEV-CQSZACIVSA-N 1 1 354.385 4.079 20 5 FIBDMO COC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 ZINC000091413648 1124384454 /nfs/dbraw/zinc/38/44/54/1124384454.db2.gz LJCURUCQAWBVRP-SJCJKPOMSA-N 1 1 350.365 4.220 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CCC23CCOCC3)cc1[N+](=O)[O-] ZINC000618614670 1125223110 /nfs/dbraw/zinc/22/31/10/1125223110.db2.gz QYIRJPKLJVPOMY-UHFFFAOYSA-N 1 1 367.449 4.118 20 5 FIBDMO C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311850865 1125232782 /nfs/dbraw/zinc/23/27/82/1125232782.db2.gz SJRSXTIWISVEFY-AOIWGVFYSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccc(N2CCCC2)c1 ZINC000181872148 568049278 /nfs/dbraw/zinc/04/92/78/568049278.db2.gz TYKAPWQXVMAWEI-AWEZNQCLSA-N 1 1 366.421 4.187 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000568823408 568229878 /nfs/dbraw/zinc/22/98/78/568229878.db2.gz OJHCIFJCQNRLRY-CQSZACIVSA-N 1 1 353.422 4.063 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000568823408 568229879 /nfs/dbraw/zinc/22/98/79/568229879.db2.gz OJHCIFJCQNRLRY-CQSZACIVSA-N 1 1 353.422 4.063 20 5 FIBDMO COc1cc(C[N@@H+](C)C2CCC(C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000302912770 568243353 /nfs/dbraw/zinc/24/33/53/568243353.db2.gz QWILUNQEFMYKQO-UHFFFAOYSA-N 1 1 358.385 4.215 20 5 FIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCc2ccccc21 ZINC001167205857 1080843307 /nfs/dbraw/zinc/84/33/07/1080843307.db2.gz KBWVNBDNZVBIHB-IBGZPJMESA-N 1 1 350.422 4.371 20 5 FIBDMO Cc1ccc(C[C@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001167265197 1080932389 /nfs/dbraw/zinc/93/23/89/1080932389.db2.gz YZORMZRACIXLAE-LJQANCHMSA-N 1 1 354.450 4.237 20 5 FIBDMO COc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000389229530 1081916021 /nfs/dbraw/zinc/91/60/21/1081916021.db2.gz XGIZZVZLEUNZLK-NSHDSACASA-N 1 1 365.227 4.217 20 5 FIBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001167406870 1081963163 /nfs/dbraw/zinc/96/31/63/1081963163.db2.gz YAULVNIMCRBFGT-AWEZNQCLSA-N 1 1 358.442 4.293 20 5 FIBDMO Cn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000510414751 1082533679 /nfs/dbraw/zinc/53/36/79/1082533679.db2.gz RSUSOQWGFPSASQ-NSDNCLLMSA-N 1 1 362.433 4.332 20 5 FIBDMO Cn1c2ccccc2nc1[C@@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000510414751 1082533685 /nfs/dbraw/zinc/53/36/85/1082533685.db2.gz RSUSOQWGFPSASQ-NSDNCLLMSA-N 1 1 362.433 4.332 20 5 FIBDMO CCOc1cc(N[C@@H](Cc2[nH+]ccn2C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000610516001 1082720265 /nfs/dbraw/zinc/72/02/65/1082720265.db2.gz SCDIRIKXFKDPPK-KRWDZBQOSA-N 1 1 366.421 4.123 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582439 1083212287 /nfs/dbraw/zinc/21/22/87/1083212287.db2.gz HXOIGVKTJSVRTE-SJCJKPOMSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582439 1083212291 /nfs/dbraw/zinc/21/22/91/1083212291.db2.gz HXOIGVKTJSVRTE-SJCJKPOMSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000430941355 1083244698 /nfs/dbraw/zinc/24/46/98/1083244698.db2.gz WAXOMFYPGICAMG-HKUYNNGSSA-N 1 1 354.450 4.380 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000610604716 1083260653 /nfs/dbraw/zinc/26/06/53/1083260653.db2.gz HOUALCFBPFIMMH-ZHAHWJHGSA-N 1 1 356.266 4.328 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]2CCO[C@H]2c2ccc(Cl)cc2)c(F)c1 ZINC000510799928 1083317069 /nfs/dbraw/zinc/31/70/69/1083317069.db2.gz XKUZTTWESFONBT-IRXDYDNUSA-N 1 1 368.767 4.146 20 5 FIBDMO CC(C)([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1Br ZINC000179329184 1083378831 /nfs/dbraw/zinc/37/88/31/1083378831.db2.gz NXLIVDZTVOMHKL-UHFFFAOYSA-N 1 1 355.257 4.444 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC([C@@H]4CCCO4)CC3)cs2)c1 ZINC000188252957 1083388913 /nfs/dbraw/zinc/38/89/13/1083388913.db2.gz SKUHBAZQWGVKSY-SFHVURJKSA-N 1 1 373.478 4.109 20 5 FIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(OC(F)F)cc1 ZINC000179606645 1083571208 /nfs/dbraw/zinc/57/12/08/1083571208.db2.gz ARHLVEZXICFERU-JTQLQIEISA-N 1 1 363.320 4.188 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)o2)c1 ZINC000535808672 1083693860 /nfs/dbraw/zinc/69/38/60/1083693860.db2.gz QYXFMRVFTSDHBS-IRXDYDNUSA-N 1 1 356.422 4.103 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)o2)cc1 ZINC000535809813 1083697251 /nfs/dbraw/zinc/69/72/51/1083697251.db2.gz JUXGRVNFKIFBJB-SJORKVTESA-N 1 1 356.422 4.103 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(-c2ccccc2)cs1 ZINC000548935698 1083858738 /nfs/dbraw/zinc/85/87/38/1083858738.db2.gz TUDUWJPRDXICLF-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc(-c2ccccc2)cs1 ZINC000548935698 1083858743 /nfs/dbraw/zinc/85/87/43/1083858743.db2.gz TUDUWJPRDXICLF-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCCC[C@@H]1C[C@@H](O)c1ccco1 ZINC000177451369 1083970286 /nfs/dbraw/zinc/97/02/86/1083970286.db2.gz PDBHFLMGZDKSQM-SJLPKXTDSA-N 1 1 362.401 4.195 20 5 FIBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])c2ncccc12)Cc1ccccc1 ZINC000380726148 1084163688 /nfs/dbraw/zinc/16/36/88/1084163688.db2.gz FIYMGELFYRALRF-UHFFFAOYSA-N 1 1 350.422 4.077 20 5 FIBDMO CCOc1cc(C[N@@H+](Cc2ccccc2)[C@H](CO)C(C)C)ccc1[N+](=O)[O-] ZINC001167529946 1084464647 /nfs/dbraw/zinc/46/46/47/1084464647.db2.gz WXAVADAKFLVSTB-HXUWFJFHSA-N 1 1 372.465 4.013 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(-c2ccccc2)s1 ZINC000511074201 1084640544 /nfs/dbraw/zinc/64/05/44/1084640544.db2.gz OBDZUXBSCBALLW-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO CCC[C@@H](N[C@H](C[NH+](C)C)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000551556828 1084677943 /nfs/dbraw/zinc/67/79/43/1084677943.db2.gz YATVLCNYOLFIRE-NHCUHLMSSA-N 1 1 371.481 4.337 20 5 FIBDMO CCC[C@H](N[C@H](C[NH+](C)C)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000551556827 1084678630 /nfs/dbraw/zinc/67/86/30/1084678630.db2.gz YATVLCNYOLFIRE-LEWJYISDSA-N 1 1 371.481 4.337 20 5 FIBDMO Cc1c(C[NH2+][C@H](C)c2nc3ccc(Cl)cc3n2C)cccc1[N+](=O)[O-] ZINC000478498854 1084954717 /nfs/dbraw/zinc/95/47/17/1084954717.db2.gz PGAGVWMTBFUIMH-GFCCVEGCSA-N 1 1 358.829 4.294 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccccc1C(C)(C)C ZINC000511126570 1085011266 /nfs/dbraw/zinc/01/12/66/1085011266.db2.gz YWFFHPWUMHPGEU-UHFFFAOYSA-N 1 1 369.465 4.005 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccccc1C(C)(C)C ZINC000511126570 1085011271 /nfs/dbraw/zinc/01/12/71/1085011271.db2.gz YWFFHPWUMHPGEU-UHFFFAOYSA-N 1 1 369.465 4.005 20 5 FIBDMO Cc1cc(C)n(-c2ccc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])cc2)n1 ZINC000511127437 1085013409 /nfs/dbraw/zinc/01/34/09/1085013409.db2.gz VMSOAQMJDLNEOI-UHFFFAOYSA-N 1 1 364.449 4.072 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCCc4ccccc4C3)o2)c1 ZINC000106886791 1085237623 /nfs/dbraw/zinc/23/76/23/1085237623.db2.gz ORHZDWHUQXCROY-UHFFFAOYSA-N 1 1 363.417 4.241 20 5 FIBDMO CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000158683168 1085321649 /nfs/dbraw/zinc/32/16/49/1085321649.db2.gz OLYQDCXHSMBBKG-UHFFFAOYSA-N 1 1 350.422 4.017 20 5 FIBDMO C[C@@]1(CCc2ccccc2)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001167599400 1085392381 /nfs/dbraw/zinc/39/23/81/1085392381.db2.gz UQOFAAGWBQMYAN-OAQYLSRUSA-N 1 1 354.450 4.318 20 5 FIBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](C)Cc1ccsc1 ZINC000187797761 1085557099 /nfs/dbraw/zinc/55/70/99/1085557099.db2.gz NHHNGPQRHNMUMG-CYBMUJFWSA-N 1 1 372.450 4.159 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](C)c1ccccc1F ZINC000109102150 1085589246 /nfs/dbraw/zinc/58/92/46/1085589246.db2.gz AYCFWRSDLRWNMZ-CQSZACIVSA-N 1 1 359.401 4.064 20 5 FIBDMO C[C@@H](NC1CC[NH+]([C@H](C)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000178656962 1085682648 /nfs/dbraw/zinc/68/26/48/1085682648.db2.gz JHGGDSXWLBDKIP-IAGOWNOFSA-N 1 1 353.466 4.471 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(F)(c2ccccn2)CC1 ZINC000582778409 1085703139 /nfs/dbraw/zinc/70/31/39/1085703139.db2.gz VOPPALOCXDNKDT-UHFFFAOYSA-N 1 1 373.428 4.238 20 5 FIBDMO COc1cc(C[N@@H+](C(C)C)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000111173677 1085712730 /nfs/dbraw/zinc/71/27/30/1085712730.db2.gz DOWYFEJZVLPNJL-UHFFFAOYSA-N 1 1 358.385 4.358 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@H]1c1ccccc1 ZINC000582997782 1086008113 /nfs/dbraw/zinc/00/81/13/1086008113.db2.gz GXUMZYNBMUXUIJ-IBGZPJMESA-N 1 1 353.422 4.069 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000582997782 1086008120 /nfs/dbraw/zinc/00/81/20/1086008120.db2.gz GXUMZYNBMUXUIJ-IBGZPJMESA-N 1 1 353.422 4.069 20 5 FIBDMO C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000136827760 1086622941 /nfs/dbraw/zinc/62/29/41/1086622941.db2.gz RBZMNQPCIMVYNW-CHWSQXEVSA-N 1 1 364.829 4.101 20 5 FIBDMO C[C@H](O)[C@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000136827796 1086623420 /nfs/dbraw/zinc/62/34/20/1086623420.db2.gz RBZMNQPCIMVYNW-STQMWFEESA-N 1 1 364.829 4.101 20 5 FIBDMO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)c1ccccc1 ZINC000585754744 1086688217 /nfs/dbraw/zinc/68/82/17/1086688217.db2.gz YYXAJSZDLXTGFO-UHFFFAOYSA-N 1 1 361.829 4.054 20 5 FIBDMO CC1(C)C[C@@H]([NH2+]CCc2ccc3cn[nH]c3c2)c2cc([N+](=O)[O-])ccc21 ZINC000585765409 1086691862 /nfs/dbraw/zinc/69/18/62/1086691862.db2.gz BEYDPYXMLKKQNL-LJQANCHMSA-N 1 1 350.422 4.026 20 5 FIBDMO Cc1ccc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cc1[N+](=O)[O-] ZINC000157533578 1086944984 /nfs/dbraw/zinc/94/49/84/1086944984.db2.gz OJKHNJHRTXBFDQ-KRWDZBQOSA-N 1 1 373.497 4.020 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CC[C@@H](CC(F)(F)F)C3)co2)cc1 ZINC000278699800 1087242294 /nfs/dbraw/zinc/24/22/94/1087242294.db2.gz JMSCDYCNUJKKHT-NSHDSACASA-N 1 1 355.316 4.024 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H](CC(F)(F)F)C3)co2)cc1 ZINC000278699800 1087242298 /nfs/dbraw/zinc/24/22/98/1087242298.db2.gz JMSCDYCNUJKKHT-NSHDSACASA-N 1 1 355.316 4.024 20 5 FIBDMO COc1cc(C[NH2+][C@H](C)c2ccccc2OC(C)C)c([N+](=O)[O-])cc1F ZINC000545215080 1087561931 /nfs/dbraw/zinc/56/19/31/1087561931.db2.gz WYKLDLWPEUKHIJ-CYBMUJFWSA-N 1 1 362.401 4.381 20 5 FIBDMO O=C(CC[N@H+]1CCC[C@H]1c1ccccc1Cl)Nc1ccccc1[N+](=O)[O-] ZINC000409856597 1087611241 /nfs/dbraw/zinc/61/12/41/1087611241.db2.gz QWRKCUJLSRXVIZ-KRWDZBQOSA-N 1 1 373.840 4.414 20 5 FIBDMO C[C@@H]([NH2+]Cc1cn2cc(Cl)cc(Cl)c2n1)c1cccc([N+](=O)[O-])c1 ZINC000180445409 1087919606 /nfs/dbraw/zinc/91/96/06/1087919606.db2.gz ZRTQGLIFNSAFCI-SNVBAGLBSA-N 1 1 365.220 4.400 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCO[C@@H](CF)C3)o2)c(Cl)c1 ZINC000414475615 1088690264 /nfs/dbraw/zinc/69/02/64/1088690264.db2.gz HJTVOHKWECDARF-AWEZNQCLSA-N 1 1 368.792 4.069 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](c3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000434891566 1089098534 /nfs/dbraw/zinc/09/85/34/1089098534.db2.gz IYAINUNAZZKEDM-SOLBZPMBSA-N 1 1 367.449 4.108 20 5 FIBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000023990787 1089228245 /nfs/dbraw/zinc/22/82/45/1089228245.db2.gz DSLWXNYVXOQXAN-UHFFFAOYSA-N 1 1 364.327 4.053 20 5 FIBDMO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000023990787 1089228264 /nfs/dbraw/zinc/22/82/64/1089228264.db2.gz DSLWXNYVXOQXAN-UHFFFAOYSA-N 1 1 364.327 4.053 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2cncc3ccccc32)CC1 ZINC000472744066 1089261369 /nfs/dbraw/zinc/26/13/69/1089261369.db2.gz BKHWYPJJKMOHBR-MRXNPFEDSA-N 1 1 362.433 4.026 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000103466617 1090101696 /nfs/dbraw/zinc/10/16/96/1090101696.db2.gz COMLFENJIODWQH-CYBMUJFWSA-N 1 1 355.369 4.255 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cn3cc(Cl)ccc3n1)CCCC2 ZINC000417322011 1090815410 /nfs/dbraw/zinc/81/54/10/1090815410.db2.gz MGHQZDZOKQZAIX-GOSISDBHSA-N 1 1 370.840 4.453 20 5 FIBDMO CC[C@H]([NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000105503195 1091029809 /nfs/dbraw/zinc/02/98/09/1091029809.db2.gz WWPRGCCTRABJDG-INIZCTEOSA-N 1 1 371.466 4.001 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500130060 1091056411 /nfs/dbraw/zinc/05/64/11/1091056411.db2.gz CMLYENKFXLYARU-IFXJQAMLSA-N 1 1 371.412 4.146 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)c1ccc(Cl)c(F)c1)C1CC1 ZINC000759851966 1091327256 /nfs/dbraw/zinc/32/72/56/1091327256.db2.gz XDNMZDNDMJUDQD-SFHVURJKSA-N 1 1 364.804 4.085 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000566706659 1091374956 /nfs/dbraw/zinc/37/49/56/1091374956.db2.gz FBWUISQMJWNPQI-JRGCBEDISA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000566706659 1091375011 /nfs/dbraw/zinc/37/50/11/1091375011.db2.gz FBWUISQMJWNPQI-JRGCBEDISA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1 ZINC000566706659 1091375020 /nfs/dbraw/zinc/37/50/20/1091375020.db2.gz FBWUISQMJWNPQI-JRGCBEDISA-N 1 1 365.477 4.110 20 5 FIBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)cc1 ZINC000511685485 1091539207 /nfs/dbraw/zinc/53/92/07/1091539207.db2.gz TYNJSWPZSOKSHA-MRXNPFEDSA-N 1 1 365.355 4.300 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]([C@@H](C)c2ccccc2)C2CC2)cccc1[N+](=O)[O-] ZINC000512257196 1091972182 /nfs/dbraw/zinc/97/21/82/1091972182.db2.gz BKKFMMHQUHUHCO-INIZCTEOSA-N 1 1 367.449 4.457 20 5 FIBDMO C[NH+](C)[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000432786171 1092359719 /nfs/dbraw/zinc/35/97/19/1092359719.db2.gz CBPQUBODDQTIIG-MRXNPFEDSA-N 1 1 359.495 4.239 20 5 FIBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cccc(C(F)(F)F)c1 ZINC000521040848 1092451802 /nfs/dbraw/zinc/45/18/02/1092451802.db2.gz HMFMPIFGPCATPQ-UHFFFAOYSA-N 1 1 354.328 4.124 20 5 FIBDMO Cc1cc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)ccc1[N+](=O)[O-] ZINC000500775443 1092557581 /nfs/dbraw/zinc/55/75/81/1092557581.db2.gz OXOMLEFMROVCIG-HNNXBMFYSA-N 1 1 367.449 4.387 20 5 FIBDMO Cc1cccc(C[N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1C ZINC000428736869 1092925455 /nfs/dbraw/zinc/92/54/55/1092925455.db2.gz IOMHCLRQSQDDMQ-UHFFFAOYSA-N 1 1 351.406 4.499 20 5 FIBDMO Cc1cccc(C[N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1C ZINC000428736869 1092925460 /nfs/dbraw/zinc/92/54/60/1092925460.db2.gz IOMHCLRQSQDDMQ-UHFFFAOYSA-N 1 1 351.406 4.499 20 5 FIBDMO Cc1c(C[N@H+](Cc2ccccc2)CC2CCOCC2)cccc1[N+](=O)[O-] ZINC000522083488 1093078634 /nfs/dbraw/zinc/07/86/34/1093078634.db2.gz ZCDZXUSQVPXNFN-UHFFFAOYSA-N 1 1 354.450 4.332 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]C[C@H](O)CC(C)(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544355274 1093179940 /nfs/dbraw/zinc/17/99/40/1093179940.db2.gz MGYREZWSKIYAHY-APWZRJJASA-N 1 1 360.454 4.226 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000433072867 1093199500 /nfs/dbraw/zinc/19/95/00/1093199500.db2.gz DJMMHZDMVQVZOM-SFHVURJKSA-N 1 1 367.449 4.111 20 5 FIBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000522223731 1093219387 /nfs/dbraw/zinc/21/93/87/1093219387.db2.gz CKMATGPEWQIBCR-OAQYLSRUSA-N 1 1 368.433 4.015 20 5 FIBDMO COCC[C@@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000467272169 1093389663 /nfs/dbraw/zinc/38/96/63/1093389663.db2.gz YTLIWWJUVFVXAK-INIZCTEOSA-N 1 1 350.459 4.021 20 5 FIBDMO C[N@@H+](CCCCc1ccccc1)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000052037728 1093485849 /nfs/dbraw/zinc/48/58/49/1093485849.db2.gz RETMZTKGOWMILR-UHFFFAOYSA-N 1 1 366.421 4.100 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000398169282 1093820549 /nfs/dbraw/zinc/82/05/49/1093820549.db2.gz HPQKOLVFWMPELM-FUHIMQAGSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)C[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000398169282 1093820556 /nfs/dbraw/zinc/82/05/56/1093820556.db2.gz HPQKOLVFWMPELM-FUHIMQAGSA-N 1 1 353.466 4.156 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](n4cccn4)C3)s2)cc1 ZINC000513150881 1093907986 /nfs/dbraw/zinc/90/79/86/1093907986.db2.gz SUQAZDZKQGSTOX-KRWDZBQOSA-N 1 1 368.462 4.357 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000513247245 1094029406 /nfs/dbraw/zinc/02/94/06/1094029406.db2.gz LWMQJUNXRNVZTQ-FZKQIMNGSA-N 1 1 373.840 4.270 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000513247245 1094029412 /nfs/dbraw/zinc/02/94/12/1094029412.db2.gz LWMQJUNXRNVZTQ-FZKQIMNGSA-N 1 1 373.840 4.270 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000513247154 1094034079 /nfs/dbraw/zinc/03/40/79/1094034079.db2.gz KLJNWGKVBREEKH-QRWLVFNGSA-N 1 1 367.449 4.315 20 5 FIBDMO COCc1ccccc1/C=C(\C)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000513552675 1094209779 /nfs/dbraw/zinc/20/97/79/1094209779.db2.gz CXUADBBUVCGBNI-GHRIWEEISA-N 1 1 354.450 4.319 20 5 FIBDMO CCCc1[nH+]ccn1Cc1cc(OC)c(OC[C@@H](C)CC)cc1[N+](=O)[O-] ZINC000513597323 1094231336 /nfs/dbraw/zinc/23/13/36/1094231336.db2.gz IWRASAVAZGSAPX-AWEZNQCLSA-N 1 1 361.442 4.226 20 5 FIBDMO CCC[C@@H]([NH2+][C@@H]1CCCn2nc(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000167982535 1094284486 /nfs/dbraw/zinc/28/44/86/1094284486.db2.gz TXASDSIJLJFBFU-IAGOWNOFSA-N 1 1 357.458 4.276 20 5 FIBDMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501051683 1094457434 /nfs/dbraw/zinc/45/74/34/1094457434.db2.gz FBQWUXYRKRQWLK-NRFANRHFSA-N 1 1 367.449 4.021 20 5 FIBDMO Cc1ccccc1[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)C ZINC000183204695 1094467180 /nfs/dbraw/zinc/46/71/80/1094467180.db2.gz KYNCRVLZJNCKNV-IBGZPJMESA-N 1 1 366.421 4.440 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501845376 1094959557 /nfs/dbraw/zinc/95/95/57/1094959557.db2.gz WXJZFNOCGLKQDG-AEFFLSMTSA-N 1 1 367.449 4.192 20 5 FIBDMO Cc1cc(NC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000248587430 1095004393 /nfs/dbraw/zinc/00/43/93/1095004393.db2.gz WSWKRKZSMXPPMO-IAGOWNOFSA-N 1 1 374.485 4.022 20 5 FIBDMO CC[C@H]([NH2+][C@H](c1cnn(C)c1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000366679737 1095081270 /nfs/dbraw/zinc/08/12/70/1095081270.db2.gz OARPXBACMUNQIB-PMACEKPBSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421003303 1095237432 /nfs/dbraw/zinc/23/74/32/1095237432.db2.gz HAHQQWSPPODFPH-CQSZACIVSA-N 1 1 361.467 4.375 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421003303 1095237442 /nfs/dbraw/zinc/23/74/42/1095237442.db2.gz HAHQQWSPPODFPH-CQSZACIVSA-N 1 1 361.467 4.375 20 5 FIBDMO C[N@@H+](Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)[C@H]1CCOC1 ZINC000513740965 1095323903 /nfs/dbraw/zinc/32/39/03/1095323903.db2.gz BSJVDPNLTAAFOS-HNNXBMFYSA-N 1 1 362.813 4.261 20 5 FIBDMO C[N@@H+](Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)[C@@H]1CCOC1 ZINC000513740966 1095324339 /nfs/dbraw/zinc/32/43/39/1095324339.db2.gz BSJVDPNLTAAFOS-OAHLLOKOSA-N 1 1 362.813 4.261 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000502342894 1095377187 /nfs/dbraw/zinc/37/71/87/1095377187.db2.gz DGKBNSLFCIGBPF-KRZKXXONSA-N 1 1 366.465 4.020 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])c(C)cc3C)c2C1 ZINC000421461243 1095637398 /nfs/dbraw/zinc/63/73/98/1095637398.db2.gz HXWHFSCIVBLWKD-UHFFFAOYSA-N 1 1 353.422 4.190 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])c(C)cc3C)c2C1 ZINC000421461243 1095637406 /nfs/dbraw/zinc/63/74/06/1095637406.db2.gz HXWHFSCIVBLWKD-UHFFFAOYSA-N 1 1 353.422 4.190 20 5 FIBDMO COc1cc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@H]2C)c([N+](=O)[O-])cc1F ZINC000503369932 1096370211 /nfs/dbraw/zinc/37/02/11/1096370211.db2.gz GNIKPXMWONVGKU-ZMZPIMSZSA-N 1 1 364.804 4.421 20 5 FIBDMO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425422430 1098584179 /nfs/dbraw/zinc/58/41/79/1098584179.db2.gz XDTMCFLKZYHGLG-LLVKDONJSA-N 1 1 365.227 4.256 20 5 FIBDMO C[C@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425422430 1098584185 /nfs/dbraw/zinc/58/41/85/1098584185.db2.gz XDTMCFLKZYHGLG-LLVKDONJSA-N 1 1 365.227 4.256 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCCCC[C@H]1c1ccccc1 ZINC000532929778 1098599720 /nfs/dbraw/zinc/59/97/20/1098599720.db2.gz YKAUAWVCMJGEFO-SFHVURJKSA-N 1 1 367.449 4.459 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCCC[C@H]1c1ccccc1 ZINC000532929778 1098599728 /nfs/dbraw/zinc/59/97/28/1098599728.db2.gz YKAUAWVCMJGEFO-SFHVURJKSA-N 1 1 367.449 4.459 20 5 FIBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[NH+]2C3CCC2CC3)c([N+](=O)[O-])c1 ZINC000532915995 1098606378 /nfs/dbraw/zinc/60/63/78/1098606378.db2.gz YCDYIZUUEASRSQ-LBXVMSDZSA-N 1 1 365.433 4.210 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000532918635 1098609514 /nfs/dbraw/zinc/60/95/14/1098609514.db2.gz BDIYNVVCHXKPDQ-DYVFJYSZSA-N 1 1 359.451 4.129 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000532918635 1098609517 /nfs/dbraw/zinc/60/95/17/1098609517.db2.gz BDIYNVVCHXKPDQ-DYVFJYSZSA-N 1 1 359.451 4.129 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000532978557 1098649467 /nfs/dbraw/zinc/64/94/67/1098649467.db2.gz VQDBAYMHZONZSK-SJLPKXTDSA-N 1 1 367.449 4.110 20 5 FIBDMO C[C@@H](c1ccccc1)[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC1CCC1 ZINC000532974105 1098659983 /nfs/dbraw/zinc/65/99/83/1098659983.db2.gz QGIAYTICLRECPA-HNNXBMFYSA-N 1 1 367.449 4.057 20 5 FIBDMO COc1ccc(Cl)cc1C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000425517859 1098937895 /nfs/dbraw/zinc/93/78/95/1098937895.db2.gz XMVGJPXMTJBHEC-UHFFFAOYSA-N 1 1 364.829 4.290 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000436394253 1098984602 /nfs/dbraw/zinc/98/46/02/1098984602.db2.gz VUXRHNDMNOHPBS-KRWDZBQOSA-N 1 1 374.485 4.130 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425553328 1099025227 /nfs/dbraw/zinc/02/52/27/1099025227.db2.gz MFLSNNIITDPNBQ-KRWDZBQOSA-N 1 1 350.846 4.029 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000436466436 1099033893 /nfs/dbraw/zinc/03/38/93/1099033893.db2.gz QMYPZQQELFABCW-HXUWFJFHSA-N 1 1 355.438 4.171 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000533437161 1099057731 /nfs/dbraw/zinc/05/77/31/1099057731.db2.gz WXDBIFCVIRLEFC-INIZCTEOSA-N 1 1 355.438 4.152 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000533437161 1099057746 /nfs/dbraw/zinc/05/77/46/1099057746.db2.gz WXDBIFCVIRLEFC-INIZCTEOSA-N 1 1 355.438 4.152 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)c2c(c1)COCO2 ZINC000505880412 1099308269 /nfs/dbraw/zinc/30/82/69/1099308269.db2.gz TYBTXSCPYSUKED-QWUACUGRSA-N 1 1 366.417 4.139 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2/C=C\c2ccccc2)c2c(c1)COCO2 ZINC000505880412 1099308282 /nfs/dbraw/zinc/30/82/82/1099308282.db2.gz TYBTXSCPYSUKED-QWUACUGRSA-N 1 1 366.417 4.139 20 5 FIBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000533818370 1099981020 /nfs/dbraw/zinc/98/10/20/1099981020.db2.gz DGUQSOWQIWKZDP-OAHLLOKOSA-N 1 1 351.328 4.212 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000506098431 1100092402 /nfs/dbraw/zinc/09/24/02/1100092402.db2.gz CYNGKMDUASFBHE-PXPSOEEZSA-N 1 1 366.417 4.216 20 5 FIBDMO CC(C)OC1CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000536646716 1100119454 /nfs/dbraw/zinc/11/94/54/1100119454.db2.gz AXXDATAEXZDIDF-UHFFFAOYSA-N 1 1 361.467 4.108 20 5 FIBDMO CCOC[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C1 ZINC000536669364 1100125167 /nfs/dbraw/zinc/12/51/67/1100125167.db2.gz ZKBPNTYOGLKIIA-OAHLLOKOSA-N 1 1 374.437 4.112 20 5 FIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 ZINC000536670006 1100150657 /nfs/dbraw/zinc/15/06/57/1100150657.db2.gz GZIRQSUKOBUVHP-INIZCTEOSA-N 1 1 362.813 4.261 20 5 FIBDMO CCn1cc(C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cn1 ZINC000536668835 1100151320 /nfs/dbraw/zinc/15/13/20/1100151320.db2.gz RLDDTAZGGGVSCK-UHFFFAOYSA-N 1 1 374.828 4.357 20 5 FIBDMO CCn1cc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cn1 ZINC000536668835 1100151333 /nfs/dbraw/zinc/15/13/33/1100151333.db2.gz RLDDTAZGGGVSCK-UHFFFAOYSA-N 1 1 374.828 4.357 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000536673981 1100163363 /nfs/dbraw/zinc/16/33/63/1100163363.db2.gz HZKJIMRAAYLGRU-OAHLLOKOSA-N 1 1 356.422 4.167 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC2(CC1)OCCc1ccccc12 ZINC000459530689 1100279825 /nfs/dbraw/zinc/27/98/25/1100279825.db2.gz SLUNBDCGFTXBAR-UHFFFAOYSA-N 1 1 372.852 4.312 20 5 FIBDMO Cn1cc(C[N@H+]2CCCC3(CCCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000438347682 1100615134 /nfs/dbraw/zinc/61/51/34/1100615134.db2.gz UUGIVBKFIPPFHL-UHFFFAOYSA-N 1 1 354.454 4.152 20 5 FIBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccc(Br)o1 ZINC000506232783 1100656118 /nfs/dbraw/zinc/65/61/18/1100656118.db2.gz LBJCNFWBOOKDOU-XQRVVYSFSA-N 1 1 351.200 4.096 20 5 FIBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccc(Br)o1 ZINC000506232783 1100656123 /nfs/dbraw/zinc/65/61/23/1100656123.db2.gz LBJCNFWBOOKDOU-XQRVVYSFSA-N 1 1 351.200 4.096 20 5 FIBDMO Cn1cc(C[N@H+]2CCC[C@H]2c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506294144 1100797700 /nfs/dbraw/zinc/79/77/00/1100797700.db2.gz IPSHMIJXQACRSF-FQEVSTJZSA-N 1 1 362.433 4.332 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000439312459 1101326097 /nfs/dbraw/zinc/32/60/97/1101326097.db2.gz FDJUYLGLSILTPI-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](Cc1ccc(F)cc1)C1CCOCC1 ZINC000426390892 1101460174 /nfs/dbraw/zinc/46/01/74/1101460174.db2.gz MTDIFEXXEOCPSI-HWKANZROSA-N 1 1 370.424 4.428 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[NH+]1CCC(C)CC1 ZINC000518786216 1101566598 /nfs/dbraw/zinc/56/65/98/1101566598.db2.gz VJBRBCBGCGFBRQ-MRXNPFEDSA-N 1 1 357.454 4.065 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000506631930 1101616247 /nfs/dbraw/zinc/61/62/47/1101616247.db2.gz RKGKRKWULNPUHZ-KRWDZBQOSA-N 1 1 356.422 4.258 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000506631931 1101617079 /nfs/dbraw/zinc/61/70/79/1101617079.db2.gz RKGKRKWULNPUHZ-QGZVFWFLSA-N 1 1 356.422 4.258 20 5 FIBDMO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000519026491 1101844424 /nfs/dbraw/zinc/84/44/24/1101844424.db2.gz OPTUVQVUJSCFNN-SFHVURJKSA-N 1 1 354.410 4.063 20 5 FIBDMO CC[C@@H](c1cccc(OC)c1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000519026491 1101844443 /nfs/dbraw/zinc/84/44/43/1101844443.db2.gz OPTUVQVUJSCFNN-SFHVURJKSA-N 1 1 354.410 4.063 20 5 FIBDMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000506728637 1101925961 /nfs/dbraw/zinc/92/59/61/1101925961.db2.gz YHNCEEJKMJTEAZ-ZDUSSCGKSA-N 1 1 368.462 4.176 20 5 FIBDMO COc1cc(C[N@H+]2CCC23CCC3)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000537636214 1102383163 /nfs/dbraw/zinc/38/31/63/1102383163.db2.gz SHBHWWSBBVDWCR-UHFFFAOYSA-N 1 1 368.433 4.311 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCCCC[C@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000532575882 1102498581 /nfs/dbraw/zinc/49/85/81/1102498581.db2.gz FHVLIVFBNOFWNH-SFHVURJKSA-N 1 1 371.437 4.442 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000532585889 1102506886 /nfs/dbraw/zinc/50/68/86/1102506886.db2.gz VVZRUCJMECIMPD-SFHVURJKSA-N 1 1 371.437 4.442 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000532639299 1102634932 /nfs/dbraw/zinc/63/49/32/1102634932.db2.gz MNWNNONDYFKIFX-OAHLLOKOSA-N 1 1 357.479 4.310 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nc4c(s3)CCCC4)C2)cc1 ZINC000532637961 1102640849 /nfs/dbraw/zinc/64/08/49/1102640849.db2.gz MPKKSBRSUJZIMQ-HNNXBMFYSA-N 1 1 357.479 4.310 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000619509969 1102820993 /nfs/dbraw/zinc/82/09/93/1102820993.db2.gz XYGWDYIQGYYTII-NVXWUHKLSA-N 1 1 353.422 4.007 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000184308806 1102838126 /nfs/dbraw/zinc/83/81/26/1102838126.db2.gz GMWNCOGZZQZVCM-OAHLLOKOSA-N 1 1 354.328 4.262 20 5 FIBDMO COc1cc(C[NH2+]C(C)(C)c2cccc(Cl)c2)c([N+](=O)[O-])cc1F ZINC000184308713 1102838598 /nfs/dbraw/zinc/83/85/98/1102838598.db2.gz LXFJQRUNPFCTCW-UHFFFAOYSA-N 1 1 352.793 4.421 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(F)c2cccnc12)C1CC1 ZINC000507115040 1103124254 /nfs/dbraw/zinc/12/42/54/1103124254.db2.gz CKEMLODJVMAPGZ-UHFFFAOYSA-N 1 1 351.381 4.447 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(F)c2cccnc12)C1CC1 ZINC000507115040 1103124259 /nfs/dbraw/zinc/12/42/59/1103124259.db2.gz CKEMLODJVMAPGZ-UHFFFAOYSA-N 1 1 351.381 4.447 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000532754214 1103184192 /nfs/dbraw/zinc/18/41/92/1103184192.db2.gz SRYGKHYTNHKYRC-HXUWFJFHSA-N 1 1 367.449 4.241 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cc(F)cc3cccnc32)C2CC2)c1 ZINC000507169115 1103186431 /nfs/dbraw/zinc/18/64/31/1103186431.db2.gz HWMGNRGKGFPBQX-UHFFFAOYSA-N 1 1 351.381 4.447 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@H]3CCCO3)s2)cc1 ZINC000551563859 1103364237 /nfs/dbraw/zinc/36/42/37/1103364237.db2.gz KWVVDPFFISGUPZ-QZTJIDSGSA-N 1 1 358.463 4.467 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(c2ccc3c(c2)OCCO3)CC1 ZINC000537842187 1103965360 /nfs/dbraw/zinc/96/53/60/1103965360.db2.gz WUDLRLOHRKJACH-HNNXBMFYSA-N 1 1 366.417 4.216 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000441386122 1104321536 /nfs/dbraw/zinc/32/15/36/1104321536.db2.gz WDMGXVYLMUOUOB-INIZCTEOSA-N 1 1 360.841 4.287 20 5 FIBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]2CCCC[C@H]12 ZINC000543906031 1104731540 /nfs/dbraw/zinc/73/15/40/1104731540.db2.gz QRAAUPGEECQNQG-OLMNPRSZSA-N 1 1 355.438 4.303 20 5 FIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cc2cccc(F)c2o1 ZINC000473989326 1104885656 /nfs/dbraw/zinc/88/56/56/1104885656.db2.gz LPAKKYKXYLFBDZ-NSHDSACASA-N 1 1 372.352 4.197 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530522895 1107102567 /nfs/dbraw/zinc/10/25/67/1107102567.db2.gz UNEKZONFAOGVHV-HKUYNNGSSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000530522895 1107102572 /nfs/dbraw/zinc/10/25/72/1107102572.db2.gz UNEKZONFAOGVHV-HKUYNNGSSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000530522895 1107102578 /nfs/dbraw/zinc/10/25/78/1107102578.db2.gz UNEKZONFAOGVHV-HKUYNNGSSA-N 1 1 353.466 4.076 20 5 FIBDMO CO[C@@]1(C)CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000475584045 1107807061 /nfs/dbraw/zinc/80/70/61/1107807061.db2.gz XSEMXURCBHTWGC-SFHVURJKSA-N 1 1 361.467 4.109 20 5 FIBDMO CCC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(F)cc1F ZINC000444680461 1108083854 /nfs/dbraw/zinc/08/38/54/1108083854.db2.gz PHVLMDXLRHFBPX-OAHLLOKOSA-N 1 1 360.364 4.380 20 5 FIBDMO CC[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Cl)s1 ZINC000444685058 1108085398 /nfs/dbraw/zinc/08/53/98/1108085398.db2.gz MTGIZNCGDNLKPV-JTQLQIEISA-N 1 1 350.831 4.427 20 5 FIBDMO C[N@@H+](Cc1ccccc1)C1(CNc2ccc([N+](=O)[O-])cn2)CCCCC1 ZINC000714228795 1108392663 /nfs/dbraw/zinc/39/26/63/1108392663.db2.gz QESUTHGZPAIUOD-UHFFFAOYSA-N 1 1 354.454 4.237 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H](c1ncc[nH]1)c1ccc(F)cc1 ZINC000446887436 1109384063 /nfs/dbraw/zinc/38/40/63/1109384063.db2.gz SVEISOBYXPYFAJ-QGZVFWFLSA-N 1 1 374.803 4.032 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@H]1c1ccccc1 ZINC000525639665 1109464812 /nfs/dbraw/zinc/46/48/12/1109464812.db2.gz VWXGQLQMRITJBT-MGPUTAFESA-N 1 1 368.433 4.087 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000441264267 1109549287 /nfs/dbraw/zinc/54/92/87/1109549287.db2.gz XUGQOIKOLFFAHQ-GOSISDBHSA-N 1 1 356.422 4.128 20 5 FIBDMO COc1cc(C[NH+]2[C@H](C)C[C@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000526989470 1109661021 /nfs/dbraw/zinc/66/10/21/1109661021.db2.gz HOORTPGIUCSPJB-HUUCEWRRSA-N 1 1 356.422 4.165 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccnn2C2CCCC2)cc(C(F)(F)F)c1 ZINC000449288444 1110017503 /nfs/dbraw/zinc/01/75/03/1110017503.db2.gz MXRZIWDRIMZPFT-UHFFFAOYSA-N 1 1 368.359 4.215 20 5 FIBDMO CC(C)CCn1nc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000449489841 1110090791 /nfs/dbraw/zinc/09/07/91/1110090791.db2.gz UZHLWBWAOFGEHL-UHFFFAOYSA-N 1 1 352.438 4.280 20 5 FIBDMO CC(C)(C)c1ncc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449498482 1110093429 /nfs/dbraw/zinc/09/34/29/1110093429.db2.gz KSMDTTWZQUEGMS-KRWDZBQOSA-N 1 1 354.454 4.062 20 5 FIBDMO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449563777 1110111761 /nfs/dbraw/zinc/11/17/61/1110111761.db2.gz YIXHNORMHQJBDN-CYBMUJFWSA-N 1 1 356.451 4.391 20 5 FIBDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)c2nccn21 ZINC000449569273 1110113840 /nfs/dbraw/zinc/11/38/40/1110113840.db2.gz GNNXHZRTGHUVSK-SWLSCSKDSA-N 1 1 354.435 4.315 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](C[C@H]3CCOC3)C3CC3)s2)cc1 ZINC000129919826 1110213267 /nfs/dbraw/zinc/21/32/67/1110213267.db2.gz GSCGSSRBPHEFRG-CQSZACIVSA-N 1 1 358.463 4.324 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000026363319 1110244276 /nfs/dbraw/zinc/24/42/76/1110244276.db2.gz NAMYQKHEEJQDOB-OLZOCXBDSA-N 1 1 361.829 4.234 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1cnn(C)c1 ZINC000538418030 1111125429 /nfs/dbraw/zinc/12/54/29/1111125429.db2.gz SOOLZWJLWSBPMJ-LLVKDONJSA-N 1 1 360.801 4.093 20 5 FIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(Cn2cc[nH+]c2C2CC2)cc1OC ZINC000600612246 1113104176 /nfs/dbraw/zinc/10/41/76/1113104176.db2.gz ZVBFKNVQFGIXSS-CYBMUJFWSA-N 1 1 359.426 4.151 20 5 FIBDMO Cc1c([C@H](C)N[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000482358514 1113231971 /nfs/dbraw/zinc/23/19/71/1113231971.db2.gz MPTUAIXPXLQLKQ-JENIJYKNSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1c([C@H](C)N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000482358514 1113231974 /nfs/dbraw/zinc/23/19/74/1113231974.db2.gz MPTUAIXPXLQLKQ-JENIJYKNSA-N 1 1 353.466 4.389 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482420492 1113246774 /nfs/dbraw/zinc/24/67/74/1113246774.db2.gz AICVZRKWCBIGLV-OWLMGLOSSA-N 1 1 350.418 4.130 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000482420489 1113246992 /nfs/dbraw/zinc/24/69/92/1113246992.db2.gz AICVZRKWCBIGLV-AEVNEEFTSA-N 1 1 350.418 4.130 20 5 FIBDMO CC[N@H+](Cc1ccc(Cl)cc1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488322608 1113911514 /nfs/dbraw/zinc/91/15/14/1113911514.db2.gz JYLVLCYMBIMNCE-ZDUSSCGKSA-N 1 1 361.829 4.097 20 5 FIBDMO CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488322608 1113911516 /nfs/dbraw/zinc/91/15/16/1113911516.db2.gz JYLVLCYMBIMNCE-ZDUSSCGKSA-N 1 1 361.829 4.097 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1cc(Br)cn1C ZINC000490085209 1114216447 /nfs/dbraw/zinc/21/64/47/1114216447.db2.gz DNTIFUFGAJMIOQ-GFCCVEGCSA-N 1 1 366.259 4.197 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1cc(Br)cn1C ZINC000490085209 1114216449 /nfs/dbraw/zinc/21/64/49/1114216449.db2.gz DNTIFUFGAJMIOQ-GFCCVEGCSA-N 1 1 366.259 4.197 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc(F)cc3cccnc32)C2CC2)cc1 ZINC000490802210 1114334539 /nfs/dbraw/zinc/33/45/39/1114334539.db2.gz NJQLPCSMKUWIHS-UHFFFAOYSA-N 1 1 351.381 4.447 20 5 FIBDMO CC[C@H]1c2ccsc2CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000164798298 1114585280 /nfs/dbraw/zinc/58/52/80/1114585280.db2.gz TXPAUDPBZPGGBS-KRWDZBQOSA-N 1 1 373.478 4.303 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H](c4ccccn4)C3)co2)cc1 ZINC000590600700 1114952237 /nfs/dbraw/zinc/95/22/37/1114952237.db2.gz KUCJINCHPSGRSC-INIZCTEOSA-N 1 1 364.405 4.024 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](C/C=C\c1ccccc1)[C@H]1CC[C@H](O)CC1 ZINC000592131233 1115205335 /nfs/dbraw/zinc/20/53/35/1115205335.db2.gz UQZNFNLLMHDAEZ-FOQNPZQPSA-N 1 1 366.461 4.414 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(Br)s1 ZINC000595010530 1115508042 /nfs/dbraw/zinc/50/80/42/1115508042.db2.gz XNSLYIUHJICABG-VIFPVBQESA-N 1 1 371.256 4.278 20 5 FIBDMO COc1ccc(-c2cc(C[NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)on2)cc1 ZINC000595076518 1115517103 /nfs/dbraw/zinc/51/71/03/1115517103.db2.gz KZUJFIAROJYJDU-AWEZNQCLSA-N 1 1 367.405 4.418 20 5 FIBDMO Cc1c([C@@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000595093861 1115517418 /nfs/dbraw/zinc/51/74/18/1115517418.db2.gz OWNQPJUCHCMHEZ-LLVKDONJSA-N 1 1 354.328 4.495 20 5 FIBDMO COc1cc(C[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000575026889 1115530166 /nfs/dbraw/zinc/53/01/66/1115530166.db2.gz FCZCDGDHHFVNIU-WMLDXEAASA-N 1 1 356.422 4.195 20 5 FIBDMO Cc1noc(C[N@H+](Cc2ccccc2)[C@@H]2CC(C)(C)OC2(C)C)c1[N+](=O)[O-] ZINC000595422269 1115535673 /nfs/dbraw/zinc/53/56/73/1115535673.db2.gz LRDOLRHYGVKQMI-QGZVFWFLSA-N 1 1 373.453 4.240 20 5 FIBDMO Cc1noc(C[N@@H+](Cc2ccccc2)[C@@H]2CC(C)(C)OC2(C)C)c1[N+](=O)[O-] ZINC000595422269 1115535675 /nfs/dbraw/zinc/53/56/75/1115535675.db2.gz LRDOLRHYGVKQMI-QGZVFWFLSA-N 1 1 373.453 4.240 20 5 FIBDMO Cc1noc(C[N@H+]2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1[N+](=O)[O-] ZINC000595484954 1115536690 /nfs/dbraw/zinc/53/66/90/1115536690.db2.gz PUCPHTSGMIBJNP-CYBMUJFWSA-N 1 1 369.343 4.290 20 5 FIBDMO Cc1noc(C[NH+]2CCC(F)(Cc3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000595520814 1115540118 /nfs/dbraw/zinc/54/01/18/1115540118.db2.gz FGVFFTOHZWSGFH-UHFFFAOYSA-N 1 1 367.808 4.091 20 5 FIBDMO Cc1c([C@@H](C)[NH2+][C@H]2CCc3ccccc3-n3ccnc32)cccc1[N+](=O)[O-] ZINC000596095275 1115574333 /nfs/dbraw/zinc/57/43/33/1115574333.db2.gz OOSDZSDTZMQNSG-QAPCUYQASA-N 1 1 362.433 4.427 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCc2cc(F)c(Cl)cc21 ZINC000599025971 1115778071 /nfs/dbraw/zinc/77/80/71/1115778071.db2.gz GLNJWLGZMYZLKS-MRXNPFEDSA-N 1 1 350.777 4.173 20 5 FIBDMO Cc1ccc(CNc2ccc3cnccc3c2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000599066572 1115785973 /nfs/dbraw/zinc/78/59/73/1115785973.db2.gz RXSKHLGIPOTCJD-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c(OC)c1 ZINC000599071910 1115787121 /nfs/dbraw/zinc/78/71/21/1115787121.db2.gz BNGLNXDZICAHCF-STQMWFEESA-N 1 1 360.410 4.032 20 5 FIBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCCc2ccccc21 ZINC000603580793 1115796016 /nfs/dbraw/zinc/79/60/16/1115796016.db2.gz HQQFQIWYVWLLHN-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCCc2ccccc21 ZINC000603580793 1115796017 /nfs/dbraw/zinc/79/60/17/1115796017.db2.gz HQQFQIWYVWLLHN-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO CC(C)(C)OC(=O)[C@H]1C[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)c2ccccc21 ZINC000593691726 1115797365 /nfs/dbraw/zinc/79/73/65/1115797365.db2.gz SAWMCIVKPFGWCJ-JKSUJKDBSA-N 1 1 374.462 4.316 20 5 FIBDMO COc1ccc(C[N@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)cc1[N+](=O)[O-] ZINC000603889937 1115826371 /nfs/dbraw/zinc/82/63/71/1115826371.db2.gz GNDSAHZKXMOTNO-KRWDZBQOSA-N 1 1 365.433 4.464 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000604012927 1115840715 /nfs/dbraw/zinc/84/07/15/1115840715.db2.gz FYAAMFGEFCBUFC-AWEZNQCLSA-N 1 1 370.396 4.359 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000604435460 1115865243 /nfs/dbraw/zinc/86/52/43/1115865243.db2.gz BUQUNDKWDCGPKF-INIZCTEOSA-N 1 1 355.438 4.233 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC[C@H]1C ZINC000608836316 1116131124 /nfs/dbraw/zinc/13/11/24/1116131124.db2.gz HWCNGVQCFKCFAD-CVEARBPZSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC[C@H]1C ZINC000608836316 1116131125 /nfs/dbraw/zinc/13/11/25/1116131125.db2.gz HWCNGVQCFKCFAD-CVEARBPZSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836911 1116131151 /nfs/dbraw/zinc/13/11/51/1116131151.db2.gz YIYBXRFQESDIMK-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CN1CCC[C@@H](C)C1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836911 1116131152 /nfs/dbraw/zinc/13/11/52/1116131152.db2.gz YIYBXRFQESDIMK-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO COc1cc(C[N@@H+]2CC[C@](C)(F)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000539923857 1117758057 /nfs/dbraw/zinc/75/80/57/1117758057.db2.gz KJNATTYWNOVLMP-FQEVSTJZSA-N 1 1 374.412 4.116 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@](C)(F)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000539923857 1117758064 /nfs/dbraw/zinc/75/80/64/1117758064.db2.gz KJNATTYWNOVLMP-FQEVSTJZSA-N 1 1 374.412 4.116 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCOc3c(F)ccc(F)c31)CCC2 ZINC000462963581 1117884368 /nfs/dbraw/zinc/88/43/68/1117884368.db2.gz HEGKUANIYUGHSP-DLBZAZTESA-N 1 1 360.360 4.364 20 5 FIBDMO CC[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000463036225 1117928997 /nfs/dbraw/zinc/92/89/97/1117928997.db2.gz JNHFUIKRORIERT-MRXNPFEDSA-N 1 1 360.385 4.137 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](n4cccn4)C3)o2)c(Cl)c1 ZINC000463038119 1117931770 /nfs/dbraw/zinc/93/17/70/1117931770.db2.gz XGIPVUSGBQEQJE-AWEZNQCLSA-N 1 1 372.812 4.152 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000540476043 1118076849 /nfs/dbraw/zinc/07/68/49/1118076849.db2.gz PURLHJDMDVRAQJ-HZPDHXFCSA-N 1 1 355.438 4.198 20 5 FIBDMO COc1cccc([C@H]2CCC[N@@H+]2Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000463468364 1118172975 /nfs/dbraw/zinc/17/29/75/1118172975.db2.gz DRJMMQSMNJSLBW-QGZVFWFLSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1cccc([C@H]2CCC[N@H+]2Cc2cc(OC)c(F)cc2[N+](=O)[O-])c1 ZINC000463468364 1118172979 /nfs/dbraw/zinc/17/29/79/1118172979.db2.gz DRJMMQSMNJSLBW-QGZVFWFLSA-N 1 1 360.385 4.088 20 5 FIBDMO CCn1nc(C)c(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1C ZINC000540913586 1118311826 /nfs/dbraw/zinc/31/18/26/1118311826.db2.gz HTDUBJVLWKKSFR-NRFANRHFSA-N 1 1 364.449 4.307 20 5 FIBDMO Cc1ccc([C@H](CC(=O)OC(C)C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000541205161 1118422958 /nfs/dbraw/zinc/42/29/58/1118422958.db2.gz QKEWLGJOCJTWMI-INIZCTEOSA-N 1 1 362.451 4.137 20 5 FIBDMO COc1ccc(OCC[N@H+]2C[C@@H](C)C[C@@H]2c2ccccc2F)c([N+](=O)[O-])c1 ZINC000464727287 1118674283 /nfs/dbraw/zinc/67/42/83/1118674283.db2.gz VFZXZPRKYLSQRZ-KBXCAEBGSA-N 1 1 374.412 4.204 20 5 FIBDMO CC[C@]1(C)CCC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000464774833 1118690157 /nfs/dbraw/zinc/69/01/57/1118690157.db2.gz KQSWCOUGWGYULD-QGZVFWFLSA-N 1 1 358.385 4.217 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000464857598 1118725852 /nfs/dbraw/zinc/72/58/52/1118725852.db2.gz KRAXZGGXAPBMOK-KSSFIOAISA-N 1 1 371.437 4.298 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(OCCc2ccccc2)CC1 ZINC000492975962 1119234095 /nfs/dbraw/zinc/23/40/95/1119234095.db2.gz IZPKZYDRUJXRRT-UHFFFAOYSA-N 1 1 374.868 4.472 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494292845 1119822159 /nfs/dbraw/zinc/82/21/59/1119822159.db2.gz JWUPQYGASIGIEU-VOGRQWBCSA-N 1 1 367.449 4.266 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494292845 1119822164 /nfs/dbraw/zinc/82/21/64/1119822164.db2.gz JWUPQYGASIGIEU-VOGRQWBCSA-N 1 1 367.449 4.266 20 5 FIBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccc1OC(F)F ZINC000193117834 1120415488 /nfs/dbraw/zinc/41/54/88/1120415488.db2.gz XUEXMVJCPLBTGZ-HNNXBMFYSA-N 1 1 366.364 4.446 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cncc(Br)c1 ZINC000193506684 1120935704 /nfs/dbraw/zinc/93/57/04/1120935704.db2.gz VORIAUXEZIABIC-UHFFFAOYSA-N 1 1 364.243 4.163 20 5 FIBDMO COc1ccc(C[C@@H](C)C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000090620631 1121073188 /nfs/dbraw/zinc/07/31/88/1121073188.db2.gz LXJFQEFHLIAWEN-CQSZACIVSA-N 1 1 369.421 4.055 20 5 FIBDMO CC(=O)c1ccc(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301430587 1121154749 /nfs/dbraw/zinc/15/47/49/1121154749.db2.gz QIBGGKIAOYWZQY-HNAYVOBHSA-N 1 1 373.478 4.354 20 5 FIBDMO CC(=O)c1ccc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000301542072 1122219371 /nfs/dbraw/zinc/21/93/71/1122219371.db2.gz NTIJRJMAFFYNPZ-KXBFYZLASA-N 1 1 367.449 4.262 20 5 FIBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000273411199 1122254849 /nfs/dbraw/zinc/25/48/49/1122254849.db2.gz IIGGXFAZOKPLHQ-XLIONFOSSA-N 1 1 374.412 4.095 20 5 FIBDMO COc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C[C@H]2CCCO2)c1 ZINC000542702432 1122301411 /nfs/dbraw/zinc/30/14/11/1122301411.db2.gz WLROQECPARYDJY-OAQYLSRUSA-N 1 1 370.449 4.093 20 5 FIBDMO C[N@H+](Cc1ccc(OCC(F)(F)F)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000542703602 1122303659 /nfs/dbraw/zinc/30/36/59/1122303659.db2.gz RUMUNLQDFLJAEY-UHFFFAOYSA-N 1 1 372.318 4.307 20 5 FIBDMO C[N@@H+](Cc1ccc(OCC(F)(F)F)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000542703602 1122303668 /nfs/dbraw/zinc/30/36/68/1122303668.db2.gz RUMUNLQDFLJAEY-UHFFFAOYSA-N 1 1 372.318 4.307 20 5 FIBDMO CCC[C@]1(COC)CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194931150 1123018432 /nfs/dbraw/zinc/01/84/32/1123018432.db2.gz RHDJLHZBYJCIRO-LJQANCHMSA-N 1 1 359.426 4.031 20 5 FIBDMO CCC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCCCC1 ZINC000498814957 1123030811 /nfs/dbraw/zinc/03/08/11/1123030811.db2.gz DSIUHZGIUNQEEL-UHFFFAOYSA-N 1 1 358.442 4.437 20 5 FIBDMO CC(C)[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1cccs1 ZINC000920415503 1123453925 /nfs/dbraw/zinc/45/39/25/1123453925.db2.gz KNRZGDPZHRJNDX-UHFFFAOYSA-N 1 1 367.858 4.159 20 5 FIBDMO CC(C)[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1cccs1 ZINC000920415503 1123453929 /nfs/dbraw/zinc/45/39/29/1123453929.db2.gz KNRZGDPZHRJNDX-UHFFFAOYSA-N 1 1 367.858 4.159 20 5 FIBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705247 1123803601 /nfs/dbraw/zinc/80/36/01/1123803601.db2.gz LUDDTWXPIVNZIM-KRWDZBQOSA-N 1 1 360.841 4.464 20 5 FIBDMO CCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000610133382 1123950202 /nfs/dbraw/zinc/95/02/02/1123950202.db2.gz LSIDWHKNGZJGKI-USXIJHARSA-N 1 1 352.862 4.274 20 5 FIBDMO C[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000237573565 1123987045 /nfs/dbraw/zinc/98/70/45/1123987045.db2.gz QOBBJNRDNFQZPX-QAPCUYQASA-N 1 1 373.884 4.391 20 5 FIBDMO COc1ccc(C[N@@H+](C)C/C(C)=C\c2cccc([N+](=O)[O-])c2)cc1OC ZINC000615833448 1124127592 /nfs/dbraw/zinc/12/75/92/1124127592.db2.gz HJDMWMGESXGNGC-GDNBJRDFSA-N 1 1 356.422 4.147 20 5 FIBDMO Cc1c(C[NH2+]Cc2c(Cl)cccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000616483539 1124320162 /nfs/dbraw/zinc/32/01/62/1124320162.db2.gz BWVWEOXQDVVYCI-UHFFFAOYSA-N 1 1 356.756 4.448 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cccnc2OC2CCCC2)cc1[N+](=O)[O-] ZINC000153884194 1124810600 /nfs/dbraw/zinc/81/06/00/1124810600.db2.gz JDVVAETUMAVDQC-HNNXBMFYSA-N 1 1 355.438 4.470 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542946063 1124946074 /nfs/dbraw/zinc/94/60/74/1124946074.db2.gz CPFASZZGWBOFRK-STQMWFEESA-N 1 1 368.359 4.208 20 5 FIBDMO C[C@H]1C[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301740799 1125189570 /nfs/dbraw/zinc/18/95/70/1125189570.db2.gz KQQNUODPIQCBJE-BBRMVZONSA-N 1 1 360.845 4.108 20 5 FIBDMO CCN(Cc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000517900736 567828970 /nfs/dbraw/zinc/82/89/70/567828970.db2.gz VAOCCPZATYKCRX-XLIONFOSSA-N 1 1 353.466 4.252 20 5 FIBDMO O=C(CC[N@H+]1CC2(CCC2)[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000453029749 568255598 /nfs/dbraw/zinc/25/55/98/568255598.db2.gz XUVGUOYASGMEGA-HXUWFJFHSA-N 1 1 365.433 4.151 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000008127605 568268878 /nfs/dbraw/zinc/26/88/78/568268878.db2.gz LPKLJDKAYSLMPX-UHFFFAOYSA-N 1 1 363.417 4.127 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)Cc1ccc2ccccc2c1 ZINC000008127605 568268880 /nfs/dbraw/zinc/26/88/80/568268880.db2.gz LPKLJDKAYSLMPX-UHFFFAOYSA-N 1 1 363.417 4.127 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](C(F)(F)F)C4(CCC4)C3)nc2c1 ZINC000570178453 568459387 /nfs/dbraw/zinc/45/93/87/568459387.db2.gz GCUFLWDEYNZZOW-AWEZNQCLSA-N 1 1 369.343 4.291 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](C(F)(F)F)C4(CCC4)C3)nc2c1 ZINC000570178453 568459388 /nfs/dbraw/zinc/45/93/88/568459388.db2.gz GCUFLWDEYNZZOW-AWEZNQCLSA-N 1 1 369.343 4.291 20 5 FIBDMO C[NH+](C)C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCC1 ZINC000608835642 1079935480 /nfs/dbraw/zinc/93/54/80/1079935480.db2.gz IMJREZZJTDEAPN-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(OC2CCC(C)CC2)CC1 ZINC000430225938 1080026539 /nfs/dbraw/zinc/02/65/39/1080026539.db2.gz NFUBQXFIIUWBHM-UHFFFAOYSA-N 1 1 362.470 4.163 20 5 FIBDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC001167094640 1080340540 /nfs/dbraw/zinc/34/05/40/1080340540.db2.gz XHLAHNRZUKPINI-INIZCTEOSA-N 1 1 360.841 4.464 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@H+](C)[C@H]1c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000247027279 1080710272 /nfs/dbraw/zinc/71/02/72/1080710272.db2.gz MDOYKFVAZBFHOF-URLQWDBASA-N 1 1 359.495 4.390 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000247027279 1080710280 /nfs/dbraw/zinc/71/02/80/1080710280.db2.gz MDOYKFVAZBFHOF-URLQWDBASA-N 1 1 359.495 4.390 20 5 FIBDMO CCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1OC ZINC001167216963 1080858683 /nfs/dbraw/zinc/85/86/83/1080858683.db2.gz CJXYQBJNVDQFIE-INIZCTEOSA-N 1 1 358.438 4.455 20 5 FIBDMO CC[C@@H](C)[N@@H+](CCc1ccccc1F)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC001167244069 1080901783 /nfs/dbraw/zinc/90/17/83/1080901783.db2.gz FJYIHZFTANGGGT-QRWLVFNGSA-N 1 1 360.429 4.111 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)OCc2cccc([N+](=O)[O-])c2)cc1 ZINC001125418023 1081571331 /nfs/dbraw/zinc/57/13/31/1081571331.db2.gz HPLMJMHGFLIHOI-UHFFFAOYSA-N 1 1 356.422 4.184 20 5 FIBDMO COc1ccc(OC(F)F)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000118976815 1081831940 /nfs/dbraw/zinc/83/19/40/1081831940.db2.gz OKQSRLDYTZGYJL-LLVKDONJSA-N 1 1 352.337 4.056 20 5 FIBDMO CC(=O)c1cc(N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000561155152 1082079009 /nfs/dbraw/zinc/07/90/09/1082079009.db2.gz XWEHMOVJMLZWNT-KSSFIOAISA-N 1 1 353.422 4.045 20 5 FIBDMO CCC[N@@H+](CCc1ccccn1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000581397272 1082523712 /nfs/dbraw/zinc/52/37/12/1082523712.db2.gz NYUVUTCCALLHIA-UHFFFAOYSA-N 1 1 365.380 4.046 20 5 FIBDMO Cc1ccc(Sc2ccc(C[NH2+]Cc3ccnn3C)cc2[N+](=O)[O-])cc1 ZINC000119362843 1082602782 /nfs/dbraw/zinc/60/27/82/1082602782.db2.gz PAHNKHIXTWPIKZ-UHFFFAOYSA-N 1 1 368.462 4.078 20 5 FIBDMO CCOc1cc(N[C@H](Cc2[nH+]ccn2C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000610516002 1082719404 /nfs/dbraw/zinc/71/94/04/1082719404.db2.gz SCDIRIKXFKDPPK-QGZVFWFLSA-N 1 1 366.421 4.123 20 5 FIBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132287 1082734602 /nfs/dbraw/zinc/73/46/02/1082734602.db2.gz XMOVFQAGRCKMHI-GHTZIAJQSA-N 1 1 370.449 4.073 20 5 FIBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132288 1082735264 /nfs/dbraw/zinc/73/52/64/1082735264.db2.gz XMOVFQAGRCKMHI-WIYYLYMNSA-N 1 1 370.449 4.073 20 5 FIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132002 1082735493 /nfs/dbraw/zinc/73/54/93/1082735493.db2.gz HXOQFKNHUNIWON-WIYYLYMNSA-N 1 1 370.449 4.073 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCC[C@H]2c2ccc(C)cc2)c1 ZINC001167483664 1082913883 /nfs/dbraw/zinc/91/38/83/1082913883.db2.gz YDYRJQHEFLVXMT-IBGZPJMESA-N 1 1 368.433 4.417 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@H]2c2ccc(C)cc2)c1 ZINC001167483664 1082913885 /nfs/dbraw/zinc/91/38/85/1082913885.db2.gz YDYRJQHEFLVXMT-IBGZPJMESA-N 1 1 368.433 4.417 20 5 FIBDMO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1Cl ZINC000178205849 1082977652 /nfs/dbraw/zinc/97/76/52/1082977652.db2.gz GJVGQUNOPFQTKZ-SNVBAGLBSA-N 1 1 368.220 4.191 20 5 FIBDMO CC(C)([NH2+]Cc1csc(-c2ccccn2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000175984847 1083037894 /nfs/dbraw/zinc/03/78/94/1083037894.db2.gz RHRUNQCEFFOGSH-UHFFFAOYSA-N 1 1 354.435 4.138 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCOCC2)ccc1Oc1ccccc1Cl ZINC000510517838 1083137914 /nfs/dbraw/zinc/13/79/14/1083137914.db2.gz LUWPZZJTWYDOEL-UHFFFAOYSA-N 1 1 362.813 4.263 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCOCC2)ccc1Oc1ccccc1Cl ZINC000510517838 1083137916 /nfs/dbraw/zinc/13/79/16/1083137916.db2.gz LUWPZZJTWYDOEL-UHFFFAOYSA-N 1 1 362.813 4.263 20 5 FIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581561 1083207302 /nfs/dbraw/zinc/20/73/02/1083207302.db2.gz SRXLOHBYTYSRCO-SFHVURJKSA-N 1 1 367.405 4.254 20 5 FIBDMO C[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H]1c1cccc(F)c1 ZINC000610582289 1083212815 /nfs/dbraw/zinc/21/28/15/1083212815.db2.gz BMMGTKLCKQXPQU-BUXKBTBVSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H]1c1cccc(F)c1 ZINC000610582289 1083212817 /nfs/dbraw/zinc/21/28/17/1083212817.db2.gz BMMGTKLCKQXPQU-BUXKBTBVSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582731 1083220615 /nfs/dbraw/zinc/22/06/15/1083220615.db2.gz SRQSQOBFBCATPL-SJCJKPOMSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582731 1083220619 /nfs/dbraw/zinc/22/06/19/1083220619.db2.gz SRQSQOBFBCATPL-SJCJKPOMSA-N 1 1 355.369 4.458 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC([C@H]4CCCO4)CC3)cs2)c1 ZINC000188252981 1083388797 /nfs/dbraw/zinc/38/87/97/1083388797.db2.gz SKUHBAZQWGVKSY-GOSISDBHSA-N 1 1 373.478 4.109 20 5 FIBDMO CCC1(C(=O)Nc2cc3[nH+]c4cc(N(C)C)ccc4cc3cc2C)COC1 ZINC001143461141 1083509729 /nfs/dbraw/zinc/50/97/29/1083509729.db2.gz ZTEASHZVHQMWOE-UHFFFAOYSA-N 1 1 363.461 4.128 20 5 FIBDMO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000179704248 1083607352 /nfs/dbraw/zinc/60/73/52/1083607352.db2.gz YTDZKCHLAMQEPT-SFHVURJKSA-N 1 1 368.462 4.394 20 5 FIBDMO Cn1cccc1[C@@H]1CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000179704248 1083607362 /nfs/dbraw/zinc/60/73/62/1083607362.db2.gz YTDZKCHLAMQEPT-SFHVURJKSA-N 1 1 368.462 4.394 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2c2nc3ccccc3s2)cc1 ZINC000065208679 1083892543 /nfs/dbraw/zinc/89/25/43/1083892543.db2.gz VTANZIOJIBISMS-KRWDZBQOSA-N 1 1 369.446 4.420 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CCCCC1 ZINC000071872401 1084215663 /nfs/dbraw/zinc/21/56/63/1084215663.db2.gz ISUBSWIARKGDIA-UHFFFAOYSA-N 1 1 358.385 4.359 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000511061448 1084531932 /nfs/dbraw/zinc/53/19/32/1084531932.db2.gz AWTFGBZBYYDDIK-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2ccc(F)c(F)c2)n1 ZINC000511061448 1084531946 /nfs/dbraw/zinc/53/19/46/1084531946.db2.gz AWTFGBZBYYDDIK-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)cc1Cl ZINC000478038472 1084615953 /nfs/dbraw/zinc/61/59/53/1084615953.db2.gz DHJMXPHVGNAAMQ-UHFFFAOYSA-N 1 1 372.812 4.043 20 5 FIBDMO C[C@H](c1ccc(OC(F)F)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073421 1084626726 /nfs/dbraw/zinc/62/67/26/1084626726.db2.gz POYOBPZTDHKFOR-CYBMUJFWSA-N 1 1 350.365 4.432 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@]3(CCCc4ccccc43)C2)cc1 ZINC001167582039 1085104214 /nfs/dbraw/zinc/10/42/14/1085104214.db2.gz JIJWRYYYUQBDHB-JOCHJYFZSA-N 1 1 366.461 4.344 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@H](c4ccccc4)[C@@H]4CCC[C@H]43)nc2c1 ZINC000511878141 1085275608 /nfs/dbraw/zinc/27/56/08/1085275608.db2.gz WTBNMVWHEBAPLZ-SQGPQFPESA-N 1 1 362.433 4.239 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000108093534 1085460858 /nfs/dbraw/zinc/46/08/58/1085460858.db2.gz PFPKYGSSYWCIPS-UHFFFAOYSA-N 1 1 365.355 4.089 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1ccc(F)cc1)C1CC1 ZINC000109092984 1085584504 /nfs/dbraw/zinc/58/45/04/1085584504.db2.gz AUOSMBIKOMOEET-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO Cc1nn(-c2ccccc2C)c(C)c1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000065603824 1085659735 /nfs/dbraw/zinc/65/97/35/1085659735.db2.gz KXGDQLRBLGNVMR-UHFFFAOYSA-N 1 1 364.449 4.338 20 5 FIBDMO Cc1nn(-c2ccccc2C)c(C)c1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000065603824 1085659739 /nfs/dbraw/zinc/65/97/39/1085659739.db2.gz KXGDQLRBLGNVMR-UHFFFAOYSA-N 1 1 364.449 4.338 20 5 FIBDMO C[C@H](NC1CC[NH+]([C@@H](C)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000178656912 1085682514 /nfs/dbraw/zinc/68/25/14/1085682514.db2.gz JHGGDSXWLBDKIP-IRXDYDNUSA-N 1 1 353.466 4.471 20 5 FIBDMO CO[C@H]1CCC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000611984137 1085722061 /nfs/dbraw/zinc/72/20/61/1085722061.db2.gz KNZJRJLEYJEPSG-IBGZPJMESA-N 1 1 369.465 4.364 20 5 FIBDMO Cc1ccnc(N[C@@H]2CCCCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000709632360 1085989268 /nfs/dbraw/zinc/98/92/68/1085989268.db2.gz LLSNNRUHXKCIHE-GOSISDBHSA-N 1 1 354.454 4.155 20 5 FIBDMO O=C(C[N@@H+]1CCC[C@H]1c1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000105489942 1086559750 /nfs/dbraw/zinc/55/97/50/1086559750.db2.gz USEHVAPPNKOJLD-INIZCTEOSA-N 1 1 359.813 4.024 20 5 FIBDMO O=C(C[N@H+]1CCC[C@H]1c1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000105489942 1086559757 /nfs/dbraw/zinc/55/97/57/1086559757.db2.gz USEHVAPPNKOJLD-INIZCTEOSA-N 1 1 359.813 4.024 20 5 FIBDMO CC(C)([NH2+]Cc1cscc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000511989670 1086582242 /nfs/dbraw/zinc/58/22/42/1086582242.db2.gz MAKKVDGJPVSDRW-UHFFFAOYSA-N 1 1 355.257 4.444 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1NCCc1[nH+]ccn1Cc1ccccc1 ZINC000432332788 1086611402 /nfs/dbraw/zinc/61/14/02/1086611402.db2.gz BNPKAVMNAHRZTR-UHFFFAOYSA-N 1 1 356.813 4.148 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@]3(C2)CCCOC3)s1 ZINC000585767896 1086695257 /nfs/dbraw/zinc/69/52/57/1086695257.db2.gz ACPGUCJAFDSFBO-LJQANCHMSA-N 1 1 358.463 4.326 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2noc3c2CCCC3)s1 ZINC000583957217 1087059436 /nfs/dbraw/zinc/05/94/36/1087059436.db2.gz PIEXXEDJIOKXAB-UHFFFAOYSA-N 1 1 369.446 4.480 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2ccccc2OC(C)C)c([N+](=O)[O-])cc1F ZINC000545215081 1087561700 /nfs/dbraw/zinc/56/17/00/1087561700.db2.gz WYKLDLWPEUKHIJ-ZDUSSCGKSA-N 1 1 362.401 4.381 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000708576786 1087594833 /nfs/dbraw/zinc/59/48/33/1087594833.db2.gz INBGQUZVWCOONE-GOEBONIOSA-N 1 1 359.857 4.428 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)o1 ZINC000611983734 1087674466 /nfs/dbraw/zinc/67/44/66/1087674466.db2.gz FOTAFVWVKODIJV-KRWDZBQOSA-N 1 1 363.417 4.314 20 5 FIBDMO CCCCN1CCC([NH2+][C@@H](CC)CSc2ccccc2[N+](=O)[O-])CC1 ZINC000504930344 1087996517 /nfs/dbraw/zinc/99/65/17/1087996517.db2.gz PJLYYLFOFAKMHH-INIZCTEOSA-N 1 1 365.543 4.320 20 5 FIBDMO C[C@H]1CC[C@]2(CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000541019607 1088220868 /nfs/dbraw/zinc/22/08/68/1088220868.db2.gz FJXIPSFLPBLOTB-YWZLYKJASA-N 1 1 355.438 4.304 20 5 FIBDMO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000188880351 1088329382 /nfs/dbraw/zinc/32/93/82/1088329382.db2.gz OLUJTDWEZQTCHR-OAHLLOKOSA-N 1 1 364.348 4.118 20 5 FIBDMO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000434616225 1088864805 /nfs/dbraw/zinc/86/48/05/1088864805.db2.gz PGCUQLFOHVTZMA-LJQANCHMSA-N 1 1 359.401 4.002 20 5 FIBDMO CC1(C)C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c2cc(N)ccc2O1 ZINC000415021412 1089047564 /nfs/dbraw/zinc/04/75/64/1089047564.db2.gz AUQSBEUNSFMXHC-INIZCTEOSA-N 1 1 361.829 4.222 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000435056113 1089245162 /nfs/dbraw/zinc/24/51/62/1089245162.db2.gz LQFPXQCFBUCPMO-CABCVRRESA-N 1 1 351.406 4.422 20 5 FIBDMO Cn1cc(C[N@H+]2CCC[C@@H]2C2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000511523446 1089285845 /nfs/dbraw/zinc/28/58/45/1089285845.db2.gz NXDLLGXWMYMHFZ-LJQANCHMSA-N 1 1 354.454 4.150 20 5 FIBDMO CCCCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC001167958327 1089401327 /nfs/dbraw/zinc/40/13/27/1089401327.db2.gz HCOOGEMNSXWMDO-ZWKOTPCHSA-N 1 1 350.459 4.019 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CCC[C@@H](CO)C3)cc2[N+](=O)[O-])cc1 ZINC000435247622 1089450761 /nfs/dbraw/zinc/45/07/61/1089450761.db2.gz XJRWGQNRTCTXIB-QGZVFWFLSA-N 1 1 372.490 4.259 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@H+]3CCC[C@@H](CO)C3)cc2[N+](=O)[O-])cc1 ZINC000435247622 1089450771 /nfs/dbraw/zinc/45/07/71/1089450771.db2.gz XJRWGQNRTCTXIB-QGZVFWFLSA-N 1 1 372.490 4.259 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3nc4c(s3)CCCC4)CC2)cs1 ZINC000425350153 1089563534 /nfs/dbraw/zinc/56/35/34/1089563534.db2.gz LIOUEERGVWFADM-UHFFFAOYSA-N 1 1 363.508 4.371 20 5 FIBDMO Cn1nccc1C[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000101591822 1089806141 /nfs/dbraw/zinc/80/61/41/1089806141.db2.gz LIWUEUWYYRDMFJ-UHFFFAOYSA-N 1 1 372.812 4.064 20 5 FIBDMO CC(C)COC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000104675616 1090294697 /nfs/dbraw/zinc/29/46/97/1090294697.db2.gz WZNYTVMELNTHET-UHFFFAOYSA-N 1 1 350.459 4.019 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@H](c3ccccc3)C3CCC3)n2)c1 ZINC000104697179 1090303175 /nfs/dbraw/zinc/30/31/75/1090303175.db2.gz PDQIOAXFWAQZPY-LJQANCHMSA-N 1 1 364.405 4.276 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCCC[C@@H]1c1ccco1 ZINC000072666127 1090313842 /nfs/dbraw/zinc/31/38/42/1090313842.db2.gz OQZDQVDEOWKLGP-QGZVFWFLSA-N 1 1 357.410 4.052 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000072666127 1090313856 /nfs/dbraw/zinc/31/38/56/1090313856.db2.gz OQZDQVDEOWKLGP-QGZVFWFLSA-N 1 1 357.410 4.052 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000500092212 1091033108 /nfs/dbraw/zinc/03/31/08/1091033108.db2.gz VMBAOLGOJJIGAY-OAHLLOKOSA-N 1 1 353.422 4.149 20 5 FIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500099846 1091037464 /nfs/dbraw/zinc/03/74/64/1091037464.db2.gz VGBLFXRSFBSNFT-AUUYWEPGSA-N 1 1 371.412 4.146 20 5 FIBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500133050 1091059531 /nfs/dbraw/zinc/05/95/31/1091059531.db2.gz OXXRZANIKWOKNO-HXUWFJFHSA-N 1 1 355.438 4.253 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC2(CC1)OCc1ccccc12 ZINC000759782795 1091082976 /nfs/dbraw/zinc/08/29/76/1091082976.db2.gz BYZXCSLRUPEFOC-UHFFFAOYSA-N 1 1 358.825 4.270 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc(Br)n1 ZINC000925693660 1091408293 /nfs/dbraw/zinc/40/82/93/1091408293.db2.gz QNLNMCNNTKNZNE-QWRGUYRKSA-N 1 1 350.216 4.164 20 5 FIBDMO CCC1(CC)[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1OC ZINC001167766311 1091600172 /nfs/dbraw/zinc/60/01/72/1091600172.db2.gz KHLSKZFDWZAHKU-MOPGFXCFSA-N 1 1 364.486 4.408 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@@H]3COCC[C@H]32)c(Cl)c1 ZINC000511764957 1091650220 /nfs/dbraw/zinc/65/02/20/1091650220.db2.gz KGZYDFJGWBDDSD-WSTZPKSXSA-N 1 1 372.852 4.253 20 5 FIBDMO C[C@H](c1ccccc1)[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000512291217 1092012705 /nfs/dbraw/zinc/01/27/05/1092012705.db2.gz GGZXASIUXSRPLA-CQSZACIVSA-N 1 1 364.405 4.370 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000512291217 1092012716 /nfs/dbraw/zinc/01/27/16/1092012716.db2.gz GGZXASIUXSRPLA-CQSZACIVSA-N 1 1 364.405 4.370 20 5 FIBDMO C[NH+](C)Cc1cc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)ccc1Cl ZINC000500788533 1092569188 /nfs/dbraw/zinc/56/91/88/1092569188.db2.gz SFDDHLMSPBEHSV-UHFFFAOYSA-N 1 1 372.812 4.043 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]CCOC2CCCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544363703 1092595889 /nfs/dbraw/zinc/59/58/89/1092595889.db2.gz VOTOXJSQWVZGGT-FQEVSTJZSA-N 1 1 358.438 4.388 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(-n2cccn2)c(F)c1 ZINC000549841528 1092877593 /nfs/dbraw/zinc/87/75/93/1092877593.db2.gz UXJCQAMFSKFXFT-GFCCVEGCSA-N 1 1 374.803 4.424 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC4(CCC4)[C@H]3[C@@H]3CCCO3)o2)cc1 ZINC000572807657 1092907293 /nfs/dbraw/zinc/90/72/93/1092907293.db2.gz CIOACHDBUFQVCA-VQTJNVASSA-N 1 1 368.433 4.388 20 5 FIBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000521813560 1092927823 /nfs/dbraw/zinc/92/78/23/1092927823.db2.gz ZIZRCKPJESWDFH-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CN1CCC[C@@H](C)C1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000521813560 1092927827 /nfs/dbraw/zinc/92/78/27/1092927827.db2.gz ZIZRCKPJESWDFH-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO CCc1ccc([C@H]([NH2+]C[C@H](O)CC(C)(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544355277 1093179737 /nfs/dbraw/zinc/17/97/37/1093179737.db2.gz MGYREZWSKIYAHY-VQIMIIECSA-N 1 1 360.454 4.226 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](c3nc4ccc(F)cc4o3)C2)cc1 ZINC000443662684 1093419909 /nfs/dbraw/zinc/41/99/09/1093419909.db2.gz XJEMDEMSASRWAW-HNNXBMFYSA-N 1 1 369.396 4.297 20 5 FIBDMO CCc1ccc([C@@H](COC)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000433268272 1093512196 /nfs/dbraw/zinc/51/21/96/1093512196.db2.gz CUAMVUBJDTZIRH-ZWKOTPCHSA-N 1 1 358.438 4.450 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000474227755 1093599541 /nfs/dbraw/zinc/59/95/41/1093599541.db2.gz GGVBSHBJJMBHMK-QGZVFWFLSA-N 1 1 367.405 4.342 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCCC[C@@H]1c1nc2ccccc2o1 ZINC000474227755 1093599545 /nfs/dbraw/zinc/59/95/45/1093599545.db2.gz GGVBSHBJJMBHMK-QGZVFWFLSA-N 1 1 367.405 4.342 20 5 FIBDMO Cc1cnc(NCc2ccccc2C[N@@H+](C)Cc2ccco2)c([N+](=O)[O-])c1 ZINC000078667975 1093769419 /nfs/dbraw/zinc/76/94/19/1093769419.db2.gz KJZJKMMIZYIKLS-UHFFFAOYSA-N 1 1 366.421 4.135 20 5 FIBDMO CCC[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000182329654 1093882787 /nfs/dbraw/zinc/88/27/87/1093882787.db2.gz CSXIBMQAKMKWSP-QGZVFWFLSA-N 1 1 352.394 4.276 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]([C@@H](C)c2ccco2)C2CC2)cccc1[N+](=O)[O-] ZINC000086235453 1093894884 /nfs/dbraw/zinc/89/48/84/1093894884.db2.gz FOOIESUQTCFVJA-AWEZNQCLSA-N 1 1 357.410 4.050 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542946059 1093907633 /nfs/dbraw/zinc/90/76/33/1093907633.db2.gz CPFASZZGWBOFRK-OLZOCXBDSA-N 1 1 368.359 4.208 20 5 FIBDMO CCN(C[C@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1)CC(F)(F)F ZINC000182823784 1094173079 /nfs/dbraw/zinc/17/30/79/1094173079.db2.gz WRPCSUAIEQHNCS-LSDHHAIUSA-N 1 1 373.419 4.170 20 5 FIBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000501034568 1094458483 /nfs/dbraw/zinc/45/84/83/1094458483.db2.gz CDGDOYDVCOIYLK-KRWDZBQOSA-N 1 1 367.449 4.049 20 5 FIBDMO CC(C)(C)c1cn2c([nH+]1)CC[C@@H](Nc1ccc([N+](=O)[O-])c3ncccc13)C2 ZINC000413113445 1094507694 /nfs/dbraw/zinc/50/76/94/1094507694.db2.gz WIIWBEHNLBGPGF-CYBMUJFWSA-N 1 1 365.437 4.064 20 5 FIBDMO COc1cc(C[NH2+][C@H](C)c2ccccc2SC)c([N+](=O)[O-])cc1F ZINC000501560433 1094778838 /nfs/dbraw/zinc/77/88/38/1094778838.db2.gz IGEOTOYPHXHPPI-LLVKDONJSA-N 1 1 350.415 4.315 20 5 FIBDMO Cc1cc(CNc2nccc3ccc([N+](=O)[O-])cc32)cc(N2CCCC2)[nH+]1 ZINC000413307311 1094901507 /nfs/dbraw/zinc/90/15/07/1094901507.db2.gz HCJMKZZSDOPGSU-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[N@@H+](C)C1CC1 ZINC000237409648 1095203483 /nfs/dbraw/zinc/20/34/83/1095203483.db2.gz DCQZYIFEQXKKLH-LBPRGKRZSA-N 1 1 363.845 4.081 20 5 FIBDMO C[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)N(C)C1CC1 ZINC000237409648 1095203500 /nfs/dbraw/zinc/20/35/00/1095203500.db2.gz DCQZYIFEQXKKLH-LBPRGKRZSA-N 1 1 363.845 4.081 20 5 FIBDMO C[N@@H+](CCNC(=O)c1cc2ccccc2c2cccnc12)Cc1ccccc1 ZINC000509542054 1095744900 /nfs/dbraw/zinc/74/49/00/1095744900.db2.gz LSNCNXCIJLWTOF-UHFFFAOYSA-N 1 1 369.468 4.250 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccoc1)C1CCCCC1 ZINC000444229362 1095888992 /nfs/dbraw/zinc/88/89/92/1095888992.db2.gz UNMKTDBJIUUQHM-UHFFFAOYSA-N 1 1 371.437 4.270 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000444229362 1095889011 /nfs/dbraw/zinc/88/90/11/1095889011.db2.gz UNMKTDBJIUUQHM-UHFFFAOYSA-N 1 1 371.437 4.270 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Oc3ccc(F)cc3)CC2)cc1Cl ZINC000783553065 1095906710 /nfs/dbraw/zinc/90/67/10/1095906710.db2.gz OOKOBDGZUHCWMO-UHFFFAOYSA-N 1 1 364.804 4.431 20 5 FIBDMO COc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC2CC2)c(OC)c1 ZINC000503230983 1096318831 /nfs/dbraw/zinc/31/88/31/1096318831.db2.gz DWYQTJXKORYHIA-UHFFFAOYSA-N 1 1 356.422 4.024 20 5 FIBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000425419672 1098566309 /nfs/dbraw/zinc/56/63/09/1098566309.db2.gz QVGRVDOZYHSWNH-UHFFFAOYSA-N 1 1 365.202 4.275 20 5 FIBDMO Cc1ccc(C(C)(C)[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000425431608 1098596328 /nfs/dbraw/zinc/59/63/28/1098596328.db2.gz IRSFGXCCPOMTEJ-UHFFFAOYSA-N 1 1 364.243 4.086 20 5 FIBDMO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC000532929629 1098599533 /nfs/dbraw/zinc/59/95/33/1098599533.db2.gz VGSDECJXGBJCTO-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC000532929629 1098599539 /nfs/dbraw/zinc/59/95/39/1098599539.db2.gz VGSDECJXGBJCTO-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO Cc1cccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000532920531 1098610514 /nfs/dbraw/zinc/61/05/14/1098610514.db2.gz DAQCPWVXTKXFRQ-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1cccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000532920531 1098610520 /nfs/dbraw/zinc/61/05/20/1098610520.db2.gz DAQCPWVXTKXFRQ-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO C[C@H](c1ccccc1)[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC1CCC1 ZINC000532974106 1098659693 /nfs/dbraw/zinc/65/96/93/1098659693.db2.gz QGIAYTICLRECPA-OAHLLOKOSA-N 1 1 367.449 4.057 20 5 FIBDMO Cn1cc(C[N@@H+](Cc2cccs2)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000130236382 1098825237 /nfs/dbraw/zinc/82/52/37/1098825237.db2.gz BUCXOGVAHZUJFX-UHFFFAOYSA-N 1 1 368.462 4.221 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1CCCCC1 ZINC000533222902 1098887895 /nfs/dbraw/zinc/88/78/95/1098887895.db2.gz AFJTYDVQACQURS-GFCCVEGCSA-N 1 1 353.850 4.087 20 5 FIBDMO 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C[C@@H]([NH2+]C[C@H]1CCN(C2CC2)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000152364703 1101783584 /nfs/dbraw/zinc/78/35/84/1101783584.db2.gz IUMYNSVXLBVUDQ-HUUCEWRRSA-N 1 1 371.506 4.458 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)cc1)C1CC1 ZINC000537448453 1101791528 /nfs/dbraw/zinc/79/15/28/1101791528.db2.gz DGHPNLOPWDFOCP-UHFFFAOYSA-N 1 1 353.422 4.140 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000506710824 1101863305 /nfs/dbraw/zinc/86/33/05/1101863305.db2.gz JZSFURWFVKYOFY-OPQSBORISA-N 1 1 358.463 4.351 20 5 FIBDMO COCC[N@H+](Cc1scnc1C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000426567463 1102018214 /nfs/dbraw/zinc/01/82/14/1102018214.db2.gz KSFDSNJXULIYCM-UHFFFAOYSA-N 1 1 363.483 4.132 20 5 FIBDMO COCC[N@@H+](Cc1scnc1C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000426567463 1102018230 /nfs/dbraw/zinc/01/82/30/1102018230.db2.gz KSFDSNJXULIYCM-UHFFFAOYSA-N 1 1 363.483 4.132 20 5 FIBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 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1 1 360.483 4.062 20 5 FIBDMO CC[N@H+](Cc1ccc(Cl)cc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507173763 1103193267 /nfs/dbraw/zinc/19/32/67/1103193267.db2.gz OJTXPOQIKHFTBJ-UHFFFAOYSA-N 1 1 362.813 4.137 20 5 FIBDMO CC[N@@H+](Cc1ccc(Cl)cc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507173763 1103193268 /nfs/dbraw/zinc/19/32/68/1103193268.db2.gz OJTXPOQIKHFTBJ-UHFFFAOYSA-N 1 1 362.813 4.137 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@@H]3CCCO3)s2)cc1 ZINC000551563856 1103365710 /nfs/dbraw/zinc/36/57/10/1103365710.db2.gz KWVVDPFFISGUPZ-MSOLQXFVSA-N 1 1 358.463 4.467 20 5 FIBDMO CC(C)CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCC1 ZINC000519904335 1103947969 /nfs/dbraw/zinc/94/79/69/1103947969.db2.gz GDAVRGVMROZAQD-UHFFFAOYSA-N 1 1 358.442 4.436 20 5 FIBDMO Cc1c(C[N@H+](C)Cc2csc(Br)c2)cccc1[N+](=O)[O-] ZINC000049001646 1104048266 /nfs/dbraw/zinc/04/82/66/1104048266.db2.gz ALAGXSYMJUNPHE-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO Cc1c(C[N@@H+](C)Cc2csc(Br)c2)cccc1[N+](=O)[O-] ZINC000049001646 1104048279 /nfs/dbraw/zinc/04/82/79/1104048279.db2.gz ALAGXSYMJUNPHE-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO C[N@@H+](CCc1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1)C1CC1 ZINC000538269875 1104090849 /nfs/dbraw/zinc/09/08/49/1104090849.db2.gz BBOFRYCMYYRQIY-UHFFFAOYSA-N 1 1 373.840 4.137 20 5 FIBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1 ZINC000441252265 1104223406 /nfs/dbraw/zinc/22/34/06/1104223406.db2.gz ATMHXBOEUWUZFL-AWEZNQCLSA-N 1 1 370.405 4.421 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000441403301 1104345250 /nfs/dbraw/zinc/34/52/50/1104345250.db2.gz KQHVLVCEUIXTMV-ZBFHGGJFSA-N 1 1 356.397 4.390 20 5 FIBDMO C[N@@H+](CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCCCC1 ZINC000237167020 1104753110 /nfs/dbraw/zinc/75/31/10/1104753110.db2.gz CKHHJNVUXVNUEN-UHFFFAOYSA-N 1 1 374.510 4.072 20 5 FIBDMO Cc1ccc(Sc2ccc(C[NH2+]C3CCN(C)CC3)cc2[N+](=O)[O-])cc1 ZINC000237168793 1104755407 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20 5 FIBDMO CCc1ccc([C@@H]([NH2+]C[C@H]2CCC(C)(C)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427957725 1105328169 /nfs/dbraw/zinc/32/81/69/1105328169.db2.gz LAQXVCIISQQLCG-MJGOQNOKSA-N 1 1 358.438 4.387 20 5 FIBDMO Cc1ccccc1NC(=O)CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451542830 1107161965 /nfs/dbraw/zinc/16/19/65/1107161965.db2.gz AJJDXQHVGXYMRM-SFHVURJKSA-N 1 1 367.449 4.111 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CCC[N@H+](C3CCCC3)CC2)cc1C(F)(F)F ZINC000530616702 1107193883 /nfs/dbraw/zinc/19/38/83/1107193883.db2.gz UXNFKSIXVGJEDJ-UHFFFAOYSA-N 1 1 357.376 4.068 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC000452078961 1107460960 /nfs/dbraw/zinc/46/09/60/1107460960.db2.gz MPQJEPUSCJAMJK-KGLIPLIRSA-N 1 1 358.442 4.464 20 5 FIBDMO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000531105575 1107539300 /nfs/dbraw/zinc/53/93/00/1107539300.db2.gz SNJTYWKQHSGDDT-LBPRGKRZSA-N 1 1 368.359 4.036 20 5 FIBDMO CC(C)Oc1cccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444685457 1108065377 /nfs/dbraw/zinc/06/53/77/1108065377.db2.gz ABLPRCIEEMXMID-ZDUSSCGKSA-N 1 1 354.410 4.109 20 5 FIBDMO Cc1ccc([C@@H](CNCc2ccc(C)c([N+](=O)[O-])c2)[NH+]2CCCC2)cc1 ZINC000520221789 1108071841 /nfs/dbraw/zinc/07/18/41/1108071841.db2.gz ZQNWEXQNBJICDX-OAQYLSRUSA-N 1 1 353.466 4.138 20 5 FIBDMO CC(C)[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(F)cc1F ZINC000444670294 1108073751 /nfs/dbraw/zinc/07/37/51/1108073751.db2.gz GMTTUTVPAFAQCW-SFHVURJKSA-N 1 1 360.364 4.236 20 5 FIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)CC1(c2ccccc2)CC1 ZINC000444671013 1108074182 /nfs/dbraw/zinc/07/41/82/1108074182.db2.gz HLFYBGWFPNRMEP-UHFFFAOYSA-N 1 1 363.417 4.413 20 5 FIBDMO CC[C@H]([NH2+]Cc1nc(C)c(Br)s1)c1cccc([N+](=O)[O-])c1 ZINC000453273612 1108378244 /nfs/dbraw/zinc/37/82/44/1108378244.db2.gz WKKZDKRQRKZOKB-LBPRGKRZSA-N 1 1 370.272 4.363 20 5 FIBDMO Cc1ccc([C@H]2CSCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000523860105 1108613067 /nfs/dbraw/zinc/61/30/67/1108613067.db2.gz AZVWENDFFLMREY-GOSISDBHSA-N 1 1 358.463 4.072 20 5 FIBDMO COc1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2C)C[C@H]2CCCO2)c1 ZINC000520392056 1108693380 /nfs/dbraw/zinc/69/33/80/1108693380.db2.gz IFXDAHOUVSDSKO-HXUWFJFHSA-N 1 1 370.449 4.093 20 5 FIBDMO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H](O)C(F)(F)F ZINC000428416079 1108967055 /nfs/dbraw/zinc/96/70/55/1108967055.db2.gz CRZMJEFOFKHSHC-OAHLLOKOSA-N 1 1 374.384 4.068 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCCC2(CCCC2)C1 ZINC000445840153 1109009194 /nfs/dbraw/zinc/00/91/94/1109009194.db2.gz HMXAPAYVSMQIBO-CYBMUJFWSA-N 1 1 365.861 4.231 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC2(CCCC2)C1 ZINC000445840153 1109009200 /nfs/dbraw/zinc/00/92/00/1109009200.db2.gz HMXAPAYVSMQIBO-CYBMUJFWSA-N 1 1 365.861 4.231 20 5 FIBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000525271827 1109319670 /nfs/dbraw/zinc/31/96/70/1109319670.db2.gz WJIGIGNRWSNDMT-LJQANCHMSA-N 1 1 370.449 4.223 20 5 FIBDMO CCC(CC)[N@@H+](CCOC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000508581139 1109407081 /nfs/dbraw/zinc/40/70/81/1109407081.db2.gz UOANPFXPAYKTJJ-UHFFFAOYSA-N 1 1 363.483 4.355 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H](CN1CCCC1)c1ccccc1)CCC2 ZINC000447534035 1109570435 /nfs/dbraw/zinc/57/04/35/1109570435.db2.gz ZJVOOHDAIKQWEB-VXKWHMMOSA-N 1 1 365.477 4.399 20 5 FIBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])Nc1cccc([C@H](C)[NH+]2CCOCC2)c1 ZINC000449053671 1109969457 /nfs/dbraw/zinc/96/94/57/1109969457.db2.gz LLVBZYZKPMVNPS-IRXDYDNUSA-N 1 1 369.465 4.031 20 5 FIBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nc(C2CCCCC2)no1 ZINC000449277192 1110013989 /nfs/dbraw/zinc/01/39/89/1110013989.db2.gz FFRMGEAUYOLWAE-KGLIPLIRSA-N 1 1 358.442 4.307 20 5 FIBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000449496994 1110093528 /nfs/dbraw/zinc/09/35/28/1110093528.db2.gz QPSLVGCXWLVQPX-LIRRHRJNSA-N 1 1 374.437 4.110 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000026363311 1110244079 /nfs/dbraw/zinc/24/40/79/1110244079.db2.gz NAMYQKHEEJQDOB-QWHCGFSZSA-N 1 1 361.829 4.234 20 5 FIBDMO CCOC[C@@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000538761534 1111289397 /nfs/dbraw/zinc/28/93/97/1111289397.db2.gz JWAWCIFNMPXZCP-GOSISDBHSA-N 1 1 369.465 4.221 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c32)cc1Cl ZINC000478047536 1111664892 /nfs/dbraw/zinc/66/48/92/1111664892.db2.gz QSXNSADBCQBIIT-UHFFFAOYSA-N 1 1 372.812 4.043 20 5 FIBDMO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000478433940 1111776101 /nfs/dbraw/zinc/77/61/01/1111776101.db2.gz WVIHHYFWKZMRIK-GFCCVEGCSA-N 1 1 368.359 4.036 20 5 FIBDMO CC(=O)c1cc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000553487231 1111987696 /nfs/dbraw/zinc/98/76/96/1111987696.db2.gz OWWMOURIQCTZPW-MGPUTAFESA-N 1 1 367.449 4.120 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000479446900 1112035767 /nfs/dbraw/zinc/03/57/67/1112035767.db2.gz OWHJNKBTZRUEGR-XMSQKQJNSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC[C@H]1CC[N@@H+](Cc3ccccc3)C1)CCC2 ZINC000479446900 1112035773 /nfs/dbraw/zinc/03/57/73/1112035773.db2.gz OWHJNKBTZRUEGR-XMSQKQJNSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCN(Cc3ccccc3)C1)CCC2 ZINC000479446900 1112035778 /nfs/dbraw/zinc/03/57/78/1112035778.db2.gz OWHJNKBTZRUEGR-XMSQKQJNSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000480417003 1112420565 /nfs/dbraw/zinc/42/05/65/1112420565.db2.gz IJIHQDYKZPPPKJ-UHFFFAOYSA-N 1 1 368.481 4.235 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)ccc1[N+](=O)[O-] ZINC000554849371 1112528216 /nfs/dbraw/zinc/52/82/16/1112528216.db2.gz YMCBYJICJIXWTL-OAHLLOKOSA-N 1 1 358.360 4.158 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)C1(F)F ZINC000600183739 1112918729 /nfs/dbraw/zinc/91/87/29/1112918729.db2.gz LSECVYSIYXFLKG-TXEJJXNPSA-N 1 1 367.421 4.441 20 5 FIBDMO C[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)C1(F)F ZINC000600183739 1112918731 /nfs/dbraw/zinc/91/87/31/1112918731.db2.gz LSECVYSIYXFLKG-TXEJJXNPSA-N 1 1 367.421 4.441 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H]3CCc3ccccc3)nc2c1 ZINC000482684494 1113330409 /nfs/dbraw/zinc/33/04/09/1113330409.db2.gz RXFVFSPKUSKJFI-INIZCTEOSA-N 1 1 350.422 4.068 20 5 FIBDMO CCC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000129134115 1113583306 /nfs/dbraw/zinc/58/33/06/1113583306.db2.gz UDPIVSNNHUDVDU-HOCLYGCPSA-N 1 1 353.426 4.138 20 5 FIBDMO C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486551913 1113592965 /nfs/dbraw/zinc/59/29/65/1113592965.db2.gz UJUGEQLAUDSFOO-YJATVDFVSA-N 1 1 365.477 4.108 20 5 FIBDMO C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486551913 1113592971 /nfs/dbraw/zinc/59/29/71/1113592971.db2.gz UJUGEQLAUDSFOO-YJATVDFVSA-N 1 1 365.477 4.108 20 5 FIBDMO C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000486801495 1113652874 /nfs/dbraw/zinc/65/28/74/1113652874.db2.gz UMPLOFNGPYDKLE-AYYIZTPMSA-N 1 1 357.357 4.434 20 5 FIBDMO C[C@@H](c1ccc(F)cc1)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000027557475 1113698255 /nfs/dbraw/zinc/69/82/55/1113698255.db2.gz KISGEBQRZSWTKV-NSHDSACASA-N 1 1 365.792 4.019 20 5 FIBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000027557475 1113698258 /nfs/dbraw/zinc/69/82/58/1113698258.db2.gz KISGEBQRZSWTKV-NSHDSACASA-N 1 1 365.792 4.019 20 5 FIBDMO CCn1c2ccccc2nc1[C@@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000490152632 1114218844 /nfs/dbraw/zinc/21/88/44/1114218844.db2.gz OQQXGOQGEIXEFI-FQEVSTJZSA-N 1 1 364.449 4.344 20 5 FIBDMO COc1ccc(-c2cc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])on2)cc1 ZINC000590020182 1114877712 /nfs/dbraw/zinc/87/77/12/1114877712.db2.gz OZORJIVCXHQXIQ-UHFFFAOYSA-N 1 1 367.405 4.283 20 5 FIBDMO O=[N+]([O-])c1cc(N2CCC[N@H+](C3CCCC3)CC2)ccc1C(F)(F)F ZINC000590584053 1114951077 /nfs/dbraw/zinc/95/10/77/1114951077.db2.gz GHIHMDMGUVXINT-UHFFFAOYSA-N 1 1 357.376 4.068 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCc1ccccc1F)[C@H]1CC[C@H](O)CC1 ZINC000592133663 1115204556 /nfs/dbraw/zinc/20/45/56/1115204556.db2.gz ZKQKMBIIKVCOKV-WGSAOQKQSA-N 1 1 372.440 4.082 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H]1CCC(F)(F)C1)[C@H]1CC[C@H](O)CC1 ZINC000592132511 1115205426 /nfs/dbraw/zinc/20/54/26/1115205426.db2.gz HYGILUSUDGPJDY-DJIMGWMZSA-N 1 1 368.424 4.136 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCCCC(F)(F)F)[C@H]1CC[C@H](O)CC1 ZINC000592132221 1115205489 /nfs/dbraw/zinc/20/54/89/1115205489.db2.gz COTIKFUDGQKGQD-WKILWMFISA-N 1 1 374.403 4.433 20 5 FIBDMO CC1(C)CCC[C@@H]1[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000592153474 1115215799 /nfs/dbraw/zinc/21/57/99/1115215799.db2.gz DLFIUUOOFVGEJJ-DOTOQJQBSA-N 1 1 370.453 4.293 20 5 FIBDMO C[C@H]1CC2(C[N@H+]1Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)CCOCC2 ZINC000592525645 1115341578 /nfs/dbraw/zinc/34/15/78/1115341578.db2.gz CIMYIOVHUSVAJM-AWEZNQCLSA-N 1 1 373.478 4.109 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cc(F)ccc1SC ZINC000595011822 1115503527 /nfs/dbraw/zinc/50/35/27/1115503527.db2.gz ITDGPIRHKYBKIX-LLVKDONJSA-N 1 1 350.415 4.315 20 5 FIBDMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000594984743 1115505375 /nfs/dbraw/zinc/50/53/75/1115505375.db2.gz SFXVKKYBTVIHEI-UHFFFAOYSA-N 1 1 366.421 4.146 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCc1ccccc1C[N@H+](C)C(C)C ZINC000595008160 1115507908 /nfs/dbraw/zinc/50/79/08/1115507908.db2.gz RNUUWPGJGDMRBB-INIZCTEOSA-N 1 1 371.481 4.294 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCc1ccccc1C[N@@H+](C)C(C)C ZINC000595008160 1115507909 /nfs/dbraw/zinc/50/79/09/1115507909.db2.gz RNUUWPGJGDMRBB-INIZCTEOSA-N 1 1 371.481 4.294 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccnc(OC2CCCC2)c1 ZINC000595008179 1115507943 /nfs/dbraw/zinc/50/79/43/1115507943.db2.gz RVCCHXIUWUQYNZ-AWEZNQCLSA-N 1 1 371.437 4.171 20 5 FIBDMO CCCCCn1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c(C)n1 ZINC000595033229 1115510444 /nfs/dbraw/zinc/51/04/44/1115510444.db2.gz CGFAUIFXAMVFEY-HNNXBMFYSA-N 1 1 360.458 4.149 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1cn(C(C)(C)C)nc1C ZINC000595033939 1115510582 /nfs/dbraw/zinc/51/05/82/1115510582.db2.gz UBMVQABMZGXZNC-OLZOCXBDSA-N 1 1 360.458 4.275 20 5 FIBDMO COc1ccc(-c2cc(C[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)on2)cc1 ZINC000595076972 1115517055 /nfs/dbraw/zinc/51/70/55/1115517055.db2.gz OGGVNNBLZOABSZ-AWEZNQCLSA-N 1 1 367.405 4.418 20 5 FIBDMO COc1ccc(-c2cc(C[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)on2)cc1 ZINC000595076973 1115517201 /nfs/dbraw/zinc/51/72/01/1115517201.db2.gz OGGVNNBLZOABSZ-CQSZACIVSA-N 1 1 367.405 4.418 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2oc3ccccc3c2C)c1 ZINC000593023031 1115540499 /nfs/dbraw/zinc/54/04/99/1115540499.db2.gz NQFKIZQHGQXZFC-CYBMUJFWSA-N 1 1 368.389 4.287 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000597218260 1115648676 /nfs/dbraw/zinc/64/86/76/1115648676.db2.gz OHXFQNRJFDDQQS-WSGSOLELSA-N 1 1 354.406 4.055 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000597218260 1115648680 /nfs/dbraw/zinc/64/86/80/1115648680.db2.gz OHXFQNRJFDDQQS-WSGSOLELSA-N 1 1 354.406 4.055 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2cccs2)C[C@@H]2CCCO2)ccc1Cl ZINC000761243358 1115691465 /nfs/dbraw/zinc/69/14/65/1115691465.db2.gz IRZDDMRNZOWDRD-AWEZNQCLSA-N 1 1 366.870 4.491 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)ccc1Cl ZINC000761243358 1115691470 /nfs/dbraw/zinc/69/14/70/1115691470.db2.gz IRZDDMRNZOWDRD-AWEZNQCLSA-N 1 1 366.870 4.491 20 5 FIBDMO COc1cc(C[N@H+]2CCC23CCCC3)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000593645051 1115767600 /nfs/dbraw/zinc/76/76/00/1115767600.db2.gz HXHVWODBWKBAMP-UHFFFAOYSA-N 1 1 374.359 4.063 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(C)c(Br)cn2)cc1[N+](=O)[O-] ZINC000598964948 1115771723 /nfs/dbraw/zinc/77/17/23/1115771723.db2.gz IGOSORVOQVZOLW-LBPRGKRZSA-N 1 1 364.243 4.220 20 5 FIBDMO C[C@H](Nc1ccc2cnccc2c1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000599066956 1115786682 /nfs/dbraw/zinc/78/66/82/1115786682.db2.gz VJVNNASEMWZBHB-HOCLYGCPSA-N 1 1 354.454 4.208 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2nccn2C)cc1[N+](=O)[O-] ZINC000593718357 1115802246 /nfs/dbraw/zinc/80/22/46/1115802246.db2.gz HLIDLIRFDZIMNU-APWZRJJASA-N 1 1 364.449 4.271 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](Cc1ccccc1)c1nccn1C ZINC000593723253 1115804874 /nfs/dbraw/zinc/80/48/74/1115804874.db2.gz UNNBXVPPWVKKOL-OXQOHEQNSA-N 1 1 364.449 4.271 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 ZINC000604275964 1115861525 /nfs/dbraw/zinc/86/15/25/1115861525.db2.gz CVBHNHBTGNCXIH-TXEJJXNPSA-N 1 1 370.293 4.200 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 ZINC000604275964 1115861526 /nfs/dbraw/zinc/86/15/26/1115861526.db2.gz CVBHNHBTGNCXIH-TXEJJXNPSA-N 1 1 370.293 4.200 20 5 FIBDMO CCC(CC)[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000604434789 1115865282 /nfs/dbraw/zinc/86/52/82/1115865282.db2.gz JOZPHKPAIQHTAO-UHFFFAOYSA-N 1 1 358.385 4.358 20 5 FIBDMO C[C@H](O)c1ccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000172115376 1115916742 /nfs/dbraw/zinc/91/67/42/1115916742.db2.gz ZKBYOTVTAUREGI-ZDUSSCGKSA-N 1 1 369.446 4.061 20 5 FIBDMO CCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1ccccc1 ZINC000063482230 1116073644 /nfs/dbraw/zinc/07/36/44/1116073644.db2.gz UAGLALPWSQSPAI-UHFFFAOYSA-N 1 1 355.438 4.144 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC[C@H]1C ZINC000608836318 1116131199 /nfs/dbraw/zinc/13/11/99/1116131199.db2.gz HWCNGVQCFKCFAD-HZPDHXFCSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC[C@H]1C ZINC000608836318 1116131200 /nfs/dbraw/zinc/13/12/00/1116131200.db2.gz HWCNGVQCFKCFAD-HZPDHXFCSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836912 1116131236 /nfs/dbraw/zinc/13/12/36/1116131236.db2.gz YIYBXRFQESDIMK-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CN1CCC[C@H](C)C1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836912 1116131238 /nfs/dbraw/zinc/13/12/38/1116131238.db2.gz YIYBXRFQESDIMK-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089907088 1116347065 /nfs/dbraw/zinc/34/70/65/1116347065.db2.gz LJQPJTWXTPTORL-DLBZAZTESA-N 1 1 361.467 4.356 20 5 FIBDMO CCS[C@@H]1CCCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000539830411 1116387887 /nfs/dbraw/zinc/38/78/87/1116387887.db2.gz UFULUITYBYQPHU-GOSISDBHSA-N 1 1 374.510 4.103 20 5 FIBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@@H]1CCC[C@@H]1O ZINC000539912646 1117749694 /nfs/dbraw/zinc/74/96/94/1117749694.db2.gz FFFUGWPMAHLDCP-KXBFYZLASA-N 1 1 374.412 4.119 20 5 FIBDMO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000462757359 1117758682 /nfs/dbraw/zinc/75/86/82/1117758682.db2.gz SKKHSOKUGDFMOH-UJZCVKTISA-N 1 1 368.368 4.148 20 5 FIBDMO C[N@@H+](Cc1ccco1)Cc1ccccc1CNc1ccc([N+](=O)[O-])cc1 ZINC000462873553 1117832401 /nfs/dbraw/zinc/83/24/01/1117832401.db2.gz HONPSFJRGFSNSM-UHFFFAOYSA-N 1 1 351.406 4.432 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@](CO)(Cc3ccccc3)C2)c(Cl)c1 ZINC000463032424 1117935608 /nfs/dbraw/zinc/93/56/08/1117935608.db2.gz GVJZIUIRYCSRLF-FQEVSTJZSA-N 1 1 374.868 4.065 20 5 FIBDMO C[C@H]([NH2+]C1CCN(CCc2ccc(F)cc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000463276235 1118075197 /nfs/dbraw/zinc/07/51/97/1118075197.db2.gz OZPKFBHNKWDDEF-INIZCTEOSA-N 1 1 371.456 4.092 20 5 FIBDMO Cc1ccc([C@H]2CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)cc1 ZINC000541390867 1118491673 /nfs/dbraw/zinc/49/16/73/1118491673.db2.gz VSRIJUJSQQZJKX-SFHVURJKSA-N 1 1 367.449 4.030 20 5 FIBDMO CCc1ccc([C@H](NCCC2CC[NH+](C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541544284 1118549547 /nfs/dbraw/zinc/54/95/47/1118549547.db2.gz SPXMHZBSZLVNSY-OAQYLSRUSA-N 1 1 371.481 4.161 20 5 FIBDMO CCc1ccc([C@H]([NH2+]CCC(=O)OC(C)(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541546455 1118549975 /nfs/dbraw/zinc/54/99/75/1118549975.db2.gz WLRUOSFFQAJSDM-LJQANCHMSA-N 1 1 374.437 4.161 20 5 FIBDMO C[N@@H+](CCc1ccccc1O)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000541551431 1118559161 /nfs/dbraw/zinc/55/91/61/1118559161.db2.gz NIUFKEQWPCUPFZ-UHFFFAOYSA-N 1 1 352.390 4.235 20 5 FIBDMO COc1cc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])cc1F ZINC000464500660 1118586515 /nfs/dbraw/zinc/58/65/15/1118586515.db2.gz QUZFXAYCZKFASU-UHFFFAOYSA-N 1 1 350.777 4.175 20 5 FIBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2ccc(C)s2)c([N+](=O)[O-])cc1F ZINC000464687411 1118655985 /nfs/dbraw/zinc/65/59/85/1118655985.db2.gz OJRRYMYVOFVYLE-AWEZNQCLSA-N 1 1 350.415 4.450 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(C)s2)c([N+](=O)[O-])cc1F ZINC000464687411 1118655988 /nfs/dbraw/zinc/65/59/88/1118655988.db2.gz OJRRYMYVOFVYLE-AWEZNQCLSA-N 1 1 350.415 4.450 20 5 FIBDMO COc1ccc(OCC[N@H+]2C[C@H](C)C[C@H]2c2ccccc2F)c([N+](=O)[O-])c1 ZINC000464727290 1118674354 /nfs/dbraw/zinc/67/43/54/1118674354.db2.gz VFZXZPRKYLSQRZ-KDOFPFPSSA-N 1 1 374.412 4.204 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)C[C@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000464862011 1118727895 /nfs/dbraw/zinc/72/78/95/1118727895.db2.gz WGMHJGHFCSXNCJ-KDOFPFPSSA-N 1 1 371.437 4.298 20 5 FIBDMO Cc1cccc(C(C)C)c1NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271800625 1118902884 /nfs/dbraw/zinc/90/28/84/1118902884.db2.gz WNOITTBNGMCMQN-OAHLLOKOSA-N 1 1 355.438 4.316 20 5 FIBDMO Cc1cnc(CC[N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)s1 ZINC000549922112 1118974081 /nfs/dbraw/zinc/97/40/81/1118974081.db2.gz ZEDHAWHBAOQXKD-UHFFFAOYSA-N 1 1 359.373 4.053 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(Nc2ccc(F)cc2)CC1 ZINC000492106575 1119025860 /nfs/dbraw/zinc/02/58/60/1119025860.db2.gz NZLYWJOHHXSWLS-UHFFFAOYSA-N 1 1 363.820 4.464 20 5 FIBDMO CCOc1cc(C[NH+]2CCC(Oc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000492776979 1119186151 /nfs/dbraw/zinc/18/61/51/1119186151.db2.gz WATJEQZENILKIB-UHFFFAOYSA-N 1 1 374.412 4.176 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000597218257 1119334799 /nfs/dbraw/zinc/33/47/99/1119334799.db2.gz OHXFQNRJFDDQQS-MTGFJVSHSA-N 1 1 354.406 4.055 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000597218257 1119334803 /nfs/dbraw/zinc/33/48/03/1119334803.db2.gz OHXFQNRJFDDQQS-MTGFJVSHSA-N 1 1 354.406 4.055 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 ZINC000493904782 1119504294 /nfs/dbraw/zinc/50/42/94/1119504294.db2.gz FHGUCKHRLIUZII-NVXWUHKLSA-N 1 1 368.767 4.146 20 5 FIBDMO CCc1ccc(C[N@@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000609193607 1119841121 /nfs/dbraw/zinc/84/11/21/1119841121.db2.gz ORZRQDACXDGUJR-UHFFFAOYSA-N 1 1 365.433 4.487 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000494794873 1120250285 /nfs/dbraw/zinc/25/02/85/1120250285.db2.gz ZPTOJYLAUGHAMK-CQSZACIVSA-N 1 1 356.813 4.045 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000494794873 1120250295 /nfs/dbraw/zinc/25/02/95/1120250295.db2.gz ZPTOJYLAUGHAMK-CQSZACIVSA-N 1 1 356.813 4.045 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccccc1OC(F)F ZINC000193117855 1120415819 /nfs/dbraw/zinc/41/58/19/1120415819.db2.gz XUEXMVJCPLBTGZ-OAHLLOKOSA-N 1 1 366.364 4.446 20 5 FIBDMO C[C@@H](CNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)[NH+](C)C ZINC000609223485 1121013108 /nfs/dbraw/zinc/01/31/08/1121013108.db2.gz XNODTJXMRDSGEM-ZDUSSCGKSA-N 1 1 363.845 4.080 20 5 FIBDMO COCC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)c1ccc(C)o1 ZINC000542577491 1121020641 /nfs/dbraw/zinc/02/06/41/1121020641.db2.gz PACGTGDTGDSDQN-QGZVFWFLSA-N 1 1 362.426 4.151 20 5 FIBDMO O=[N+]([O-])c1ccc2nc(NCCc3[nH+]ccn3Cc3ccccc3)ccc2c1 ZINC000301127810 1121400444 /nfs/dbraw/zinc/40/04/44/1121400444.db2.gz XOSZRCOPRGGJLI-UHFFFAOYSA-N 1 1 373.416 4.042 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000917082343 1122082648 /nfs/dbraw/zinc/08/26/48/1122082648.db2.gz QGLPCCVKSHJELP-UWVGGRQHSA-N 1 1 363.767 4.306 20 5 FIBDMO C[N@H+]1CCC[C@@H](CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301203369 1122156455 /nfs/dbraw/zinc/15/64/55/1122156455.db2.gz NOGJQEJESCXICM-VIFPVBQESA-N 1 1 351.756 4.021 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1CCC(C2CCCCC2)CC1 ZINC000917131482 1122187792 /nfs/dbraw/zinc/18/77/92/1122187792.db2.gz REJRRAHLOWJKFZ-UHFFFAOYSA-N 1 1 359.470 4.134 20 5 FIBDMO Cc1c([C@@H](C)NCc2cccc(C[NH+]3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000123034804 1122243026 /nfs/dbraw/zinc/24/30/26/1122243026.db2.gz SMDPONDLHYCJMG-QGZVFWFLSA-N 1 1 353.466 4.350 20 5 FIBDMO O=[N+]([O-])c1ccc(CSC[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1 ZINC000556339601 1122822088 /nfs/dbraw/zinc/82/20/88/1122822088.db2.gz BBDVCEJXGWSLOF-FQEVSTJZSA-N 1 1 372.490 4.119 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CC3CC3)C3CCCCC3)o2)cc1 ZINC000170820941 1123511434 /nfs/dbraw/zinc/51/14/34/1123511434.db2.gz ARULOYNVQDOJSL-UHFFFAOYSA-N 1 1 356.426 4.190 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+]Cc2cc[nH]n2)cc1 ZINC000609620518 1123770848 /nfs/dbraw/zinc/77/08/48/1123770848.db2.gz OIEBESJKAYWJGR-UHFFFAOYSA-N 1 1 358.785 4.053 20 5 FIBDMO C[C@H]1C[C@@H](N(C)c2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000609964793 1123898570 /nfs/dbraw/zinc/89/85/70/1123898570.db2.gz MDICQIURRBAQBO-YJBOKZPZSA-N 1 1 357.429 4.223 20 5 FIBDMO C[C@@H]1C[C@@H](N(C)Cc2c(F)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000610003577 1123914289 /nfs/dbraw/zinc/91/42/89/1123914289.db2.gz XERCDIVENPXBQU-AEFFLSMTSA-N 1 1 371.456 4.219 20 5 FIBDMO CC(C)C[C@@H]1CCCCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000610133871 1123949431 /nfs/dbraw/zinc/94/94/31/1123949431.db2.gz BYJRVWJRZHDZSL-INIZCTEOSA-N 1 1 358.442 4.436 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2c(C3CC3)nc3sccn23)C2CC2)cc1 ZINC000179694583 1124032703 /nfs/dbraw/zinc/03/27/03/1124032703.db2.gz ZSWNZGYLGOKUJA-UHFFFAOYSA-N 1 1 368.462 4.346 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2c(C3CC3)nc3sccn23)C2CC2)cc1 ZINC000179694583 1124032708 /nfs/dbraw/zinc/03/27/08/1124032708.db2.gz ZSWNZGYLGOKUJA-UHFFFAOYSA-N 1 1 368.462 4.346 20 5 FIBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000615842167 1124134726 /nfs/dbraw/zinc/13/47/26/1124134726.db2.gz FEGMVQOEJMOUPX-OVHOFWQVSA-N 1 1 358.360 4.041 20 5 FIBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273515506 1124189034 /nfs/dbraw/zinc/18/90/34/1124189034.db2.gz PEBMNOMFBMILEL-CVEARBPZSA-N 1 1 350.415 4.148 20 5 FIBDMO CC[C@@H]([NH2+][C@@H](COC)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000091413296 1124384412 /nfs/dbraw/zinc/38/44/12/1124384412.db2.gz RYTLMUAPEIKKCQ-MSOLQXFVSA-N 1 1 350.365 4.301 20 5 FIBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542853567 1124466423 /nfs/dbraw/zinc/46/64/23/1124466423.db2.gz GCMNJFTXCYWSCT-YWZLYKJASA-N 1 1 354.454 4.007 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2nc(C)cc(C)c2[N+](=O)[O-])cc1 ZINC000542865589 1124523988 /nfs/dbraw/zinc/52/39/88/1124523988.db2.gz NCAHHWPNEWUUMQ-AWEZNQCLSA-N 1 1 351.410 4.274 20 5 FIBDMO CC(C)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000428839616 1124527024 /nfs/dbraw/zinc/52/70/24/1124527024.db2.gz KPKYQHQYAJPBLK-INIZCTEOSA-N 1 1 355.438 4.029 20 5 FIBDMO C[N@H+]1CCC[C@H](CNc2ncc(Cl)cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000153832259 1124573100 /nfs/dbraw/zinc/57/31/00/1124573100.db2.gz VYIZDQRIITWQKY-IAQYHMDHSA-N 1 1 366.874 4.200 20 5 FIBDMO C[C@](N)(CCCC[NH3+])c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001212338048 1124855791 /nfs/dbraw/zinc/85/57/91/1124855791.db2.gz LCJDCAPDWJLVGK-QFIPXVFZSA-N 1 1 360.461 4.346 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542946057 1124945666 /nfs/dbraw/zinc/94/56/66/1124945666.db2.gz CPFASZZGWBOFRK-CHWSQXEVSA-N 1 1 368.359 4.208 20 5 FIBDMO O=[N+]([O-])c1cc(CNC[C@@H]2CCCC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000311135137 1125111587 /nfs/dbraw/zinc/11/15/87/1125111587.db2.gz KFWHQUWOZGQWJV-KRWDZBQOSA-N 1 1 359.495 4.048 20 5 FIBDMO CCn1c(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc2c1cccc2F ZINC000181843764 1125157296 /nfs/dbraw/zinc/15/72/96/1125157296.db2.gz WGSPYUITTLFXOW-ZDUSSCGKSA-N 1 1 356.401 4.263 20 5 FIBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000181921051 1125184660 /nfs/dbraw/zinc/18/46/60/1125184660.db2.gz IXVALTOOLZIFCJ-LLVKDONJSA-N 1 1 365.227 4.217 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312531596 1125400182 /nfs/dbraw/zinc/40/01/82/1125400182.db2.gz PSLQFZKLHDONTL-WFXMLNOXSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312531596 1125400186 /nfs/dbraw/zinc/40/01/86/1125400186.db2.gz PSLQFZKLHDONTL-WFXMLNOXSA-N 1 1 367.493 4.464 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cc(Br)cs2)c1 ZINC000070218118 1125403023 /nfs/dbraw/zinc/40/30/23/1125403023.db2.gz VUOTTXUVLWDOCU-UHFFFAOYSA-N 1 1 361.648 4.362 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H](C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000109093176 209297973 /nfs/dbraw/zinc/29/79/73/209297973.db2.gz TYNKWRGRICJEEK-CQSZACIVSA-N 1 1 359.401 4.064 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000481490455 567987941 /nfs/dbraw/zinc/98/79/41/567987941.db2.gz KEWPPHNUOOZDMP-UHFFFAOYSA-N 1 1 369.465 4.065 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(-c2ccsc2)s1 ZINC000568328384 568024783 /nfs/dbraw/zinc/02/47/83/568024783.db2.gz SCNMOGXGXUPEQS-UHFFFAOYSA-N 1 1 359.476 4.454 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](Oc4cccc(Cl)c4)C3)nc2c1 ZINC000120372936 568068441 /nfs/dbraw/zinc/06/84/41/568068441.db2.gz FASNQCBAGSNKOK-HNNXBMFYSA-N 1 1 373.796 4.043 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](Oc4cccc(Cl)c4)C3)nc2c1 ZINC000120372936 568068442 /nfs/dbraw/zinc/06/84/42/568068442.db2.gz FASNQCBAGSNKOK-HNNXBMFYSA-N 1 1 373.796 4.043 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCCC[C@@H]12 ZINC000603846944 568162787 /nfs/dbraw/zinc/16/27/87/568162787.db2.gz IEGGASJHZOSEGZ-COXVUDFISA-N 1 1 356.426 4.045 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)c1 ZINC000568998101 568265557 /nfs/dbraw/zinc/26/55/57/568265557.db2.gz YGMYVAPFVGRGBP-BLLLJJGKSA-N 1 1 358.360 4.005 20 5 FIBDMO C[C@H]1Cc2ccccc2N1C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000604483264 568300782 /nfs/dbraw/zinc/30/07/82/568300782.db2.gz JZGAXPZLSRPUPB-AWEZNQCLSA-N 1 1 357.479 4.072 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]3[C@H]3CCCOC3)o2)c1 ZINC000517937066 568340266 /nfs/dbraw/zinc/34/02/66/568340266.db2.gz KZIVHBJKZWUOMY-LPHOPBHVSA-N 1 1 356.422 4.246 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000163111562 1125657416 /nfs/dbraw/zinc/65/74/16/1125657416.db2.gz KVYSZXQHQITBEX-DLBZAZTESA-N 1 1 374.485 4.022 20 5 FIBDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154124357 1079996065 /nfs/dbraw/zinc/99/60/65/1079996065.db2.gz BUJZSVZIJZLXHD-YYUOZPCZSA-N 1 1 366.870 4.179 20 5 FIBDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154124357 1079996068 /nfs/dbraw/zinc/99/60/68/1079996068.db2.gz BUJZSVZIJZLXHD-YYUOZPCZSA-N 1 1 366.870 4.179 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000157669325 1080064975 /nfs/dbraw/zinc/06/49/75/1080064975.db2.gz XJQQBRAYNSJCKQ-KRWDZBQOSA-N 1 1 373.497 4.020 20 5 FIBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Br)ccc1F ZINC000127094291 1080190260 /nfs/dbraw/zinc/19/02/60/1080190260.db2.gz MCTRWLYWSMDULF-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000177529336 1081226928 /nfs/dbraw/zinc/22/69/28/1081226928.db2.gz LHXMTJKMHJIUJJ-RDTXWAMCSA-N 1 1 364.405 4.023 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCCC3(CCCCC3)C2)cccc1[N+](=O)[O-] ZINC001167342017 1081492461 /nfs/dbraw/zinc/49/24/61/1081492461.db2.gz OLOBIHOSZDVLGZ-UHFFFAOYSA-N 1 1 359.470 4.278 20 5 FIBDMO C[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000379656994 1081851658 /nfs/dbraw/zinc/85/16/58/1081851658.db2.gz RDPUZLQPCXDZMT-MAUKXSAKSA-N 1 1 373.884 4.391 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC001167433372 1082125400 /nfs/dbraw/zinc/12/54/00/1082125400.db2.gz CEFZBHBXLILICZ-KRWDZBQOSA-N 1 1 358.413 4.067 20 5 FIBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1C[C@H](OCC)C1(C)C ZINC001167446671 1082319278 /nfs/dbraw/zinc/31/92/78/1082319278.db2.gz BZYNZUXGVNVJMS-MSOLQXFVSA-N 1 1 350.459 4.019 20 5 FIBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1C[C@@H](OCC)C1(C)C ZINC001167446672 1082319465 /nfs/dbraw/zinc/31/94/65/1082319465.db2.gz BZYNZUXGVNVJMS-QZTJIDSGSA-N 1 1 350.459 4.019 20 5 FIBDMO Cn1c2ccccc2nc1[C@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000510414752 1082533581 /nfs/dbraw/zinc/53/35/81/1082533581.db2.gz RSUSOQWGFPSASQ-QKWWCAPFSA-N 1 1 362.433 4.332 20 5 FIBDMO Cn1c2ccccc2nc1[C@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000510414752 1082533585 /nfs/dbraw/zinc/53/35/85/1082533585.db2.gz RSUSOQWGFPSASQ-QKWWCAPFSA-N 1 1 362.433 4.332 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132250 1082738295 /nfs/dbraw/zinc/73/82/95/1082738295.db2.gz VEZKWMBZQUUUKT-TZIWHRDSSA-N 1 1 354.450 4.237 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000051283946 1082982526 /nfs/dbraw/zinc/98/25/26/1082982526.db2.gz UUOVZXBBUZQXHE-GOSISDBHSA-N 1 1 356.422 4.258 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]2CCC[C@H]2OCc2ccccc2)c(F)c1 ZINC000510632679 1083213616 /nfs/dbraw/zinc/21/36/16/1083213616.db2.gz WPPPTMGZROTUHY-RBUKOAKNSA-N 1 1 362.376 4.101 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCCO1 ZINC000179393623 1083445606 /nfs/dbraw/zinc/44/56/06/1083445606.db2.gz KTGRPWQCXSXZLB-LBPRGKRZSA-N 1 1 350.802 4.119 20 5 FIBDMO CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H](C)c1ccc(F)cc1 ZINC000053088794 1083670824 /nfs/dbraw/zinc/67/08/24/1083670824.db2.gz WJQYRXMINQEBKK-ZDUSSCGKSA-N 1 1 370.384 4.367 20 5 FIBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H](C)c1ccc(F)cc1 ZINC000053088794 1083670834 /nfs/dbraw/zinc/67/08/34/1083670834.db2.gz WJQYRXMINQEBKK-ZDUSSCGKSA-N 1 1 370.384 4.367 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 ZINC000612578187 1083923416 /nfs/dbraw/zinc/92/34/16/1083923416.db2.gz CVDYKUSSCMJAOA-VXGBXAGGSA-N 1 1 370.293 4.466 20 5 FIBDMO Cn1cc[nH+]c1C[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000610988214 1083929779 /nfs/dbraw/zinc/92/97/79/1083929779.db2.gz ZZQVJCLGEVQRGN-MRXNPFEDSA-N 1 1 358.348 4.002 20 5 FIBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000580279889 1084403757 /nfs/dbraw/zinc/40/37/57/1084403757.db2.gz VERWYBXHCPSLBV-HNNXBMFYSA-N 1 1 366.421 4.016 20 5 FIBDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)C2 ZINC000581970715 1084647250 /nfs/dbraw/zinc/64/72/50/1084647250.db2.gz ODQOUTLGMOVDQX-UHFFFAOYSA-N 1 1 356.422 4.246 20 5 FIBDMO CCOC1CC2(C1)CC[N@@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)C2 ZINC000582149283 1084667040 /nfs/dbraw/zinc/66/70/40/1084667040.db2.gz FFCHRHDKXOBHJM-UHFFFAOYSA-N 1 1 356.422 4.246 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccn(Cc3ccccc3)n1)CCC2 ZINC000551813851 1084722022 /nfs/dbraw/zinc/72/20/22/1084722022.db2.gz SWTMHSIEBYQNKE-OAQYLSRUSA-N 1 1 362.433 4.007 20 5 FIBDMO COc1ccc(C[C@@H]2CCC[N@@H+](Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000582519999 1084726315 /nfs/dbraw/zinc/72/63/15/1084726315.db2.gz UYWIFRIGBWRVTO-KRWDZBQOSA-N 1 1 370.449 4.067 20 5 FIBDMO COc1ccc(C[C@H]2CCC[N@@H+](Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000582520000 1084726549 /nfs/dbraw/zinc/72/65/49/1084726549.db2.gz UYWIFRIGBWRVTO-QGZVFWFLSA-N 1 1 370.449 4.067 20 5 FIBDMO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511088417 1084742453 /nfs/dbraw/zinc/74/24/53/1084742453.db2.gz BRCDBBZTXFHQHR-MRXNPFEDSA-N 1 1 369.465 4.220 20 5 FIBDMO CC(C)c1ccccc1NC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511088417 1084742459 /nfs/dbraw/zinc/74/24/59/1084742459.db2.gz BRCDBBZTXFHQHR-MRXNPFEDSA-N 1 1 369.465 4.220 20 5 FIBDMO Cc1ccc(-c2nc(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])cs2)o1 ZINC000511092083 1084763256 /nfs/dbraw/zinc/76/32/56/1084763256.db2.gz OIYDKJDCOQDAFB-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO Cc1ccc(-c2nc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])cs2)o1 ZINC000511092083 1084763265 /nfs/dbraw/zinc/76/32/65/1084763265.db2.gz OIYDKJDCOQDAFB-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C(F)F)C2)cc1OC ZINC000611668748 1085286364 /nfs/dbraw/zinc/28/63/64/1085286364.db2.gz TXIFBMMHDLJAOL-QWHCGFSZSA-N 1 1 372.412 4.115 20 5 FIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C(F)F)C2)cc1OC ZINC000611668748 1085286374 /nfs/dbraw/zinc/28/63/74/1085286374.db2.gz TXIFBMMHDLJAOL-QWHCGFSZSA-N 1 1 372.412 4.115 20 5 FIBDMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)c1 ZINC000472257835 1085706128 /nfs/dbraw/zinc/70/61/28/1085706128.db2.gz LSCCPPXUBAMCJF-MRXNPFEDSA-N 1 1 368.359 4.037 20 5 FIBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)c1 ZINC000472257835 1085706135 /nfs/dbraw/zinc/70/61/35/1085706135.db2.gz LSCCPPXUBAMCJF-MRXNPFEDSA-N 1 1 368.359 4.037 20 5 FIBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000112731569 1085952216 /nfs/dbraw/zinc/95/22/16/1085952216.db2.gz ZWCWSJIZNCSOJS-LJQANCHMSA-N 1 1 366.421 4.474 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@@H]1c1ccccc1 ZINC000582997783 1086008758 /nfs/dbraw/zinc/00/87/58/1086008758.db2.gz GXUMZYNBMUXUIJ-LJQANCHMSA-N 1 1 353.422 4.069 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000582997783 1086008766 /nfs/dbraw/zinc/00/87/66/1086008766.db2.gz GXUMZYNBMUXUIJ-LJQANCHMSA-N 1 1 353.422 4.069 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC(Cc4ccccc4F)CC3)nc2c1 ZINC001167653894 1086240228 /nfs/dbraw/zinc/24/02/28/1086240228.db2.gz UIAPFUXSYKQFCQ-UHFFFAOYSA-N 1 1 368.412 4.065 20 5 FIBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765592 1086693101 /nfs/dbraw/zinc/69/31/01/1086693101.db2.gz YABLKJRBYTVFDY-INIZCTEOSA-N 1 1 370.478 4.174 20 5 FIBDMO COc1cccc(C[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C[C@@H]2CCCO2)c1 ZINC000512065804 1086727206 /nfs/dbraw/zinc/72/72/06/1086727206.db2.gz BKJZDPZJPHEHIN-FQEVSTJZSA-N 1 1 370.449 4.093 20 5 FIBDMO C[C@@H]1CC[C@@H](c2ccccc2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000512154513 1086847555 /nfs/dbraw/zinc/84/75/55/1086847555.db2.gz YOPSQRSUKHZXML-QRWLVFNGSA-N 1 1 368.433 4.435 20 5 FIBDMO Cc1cc(CNc2ccc3ncccc3c2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000571339169 1086869701 /nfs/dbraw/zinc/86/97/01/1086869701.db2.gz BTHORUGCRONYDM-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000512170080 1086875686 /nfs/dbraw/zinc/87/56/86/1086875686.db2.gz BJNDECONPXXMSS-MRXNPFEDSA-N 1 1 369.465 4.318 20 5 FIBDMO Cc1c(NC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000246101530 1086897154 /nfs/dbraw/zinc/89/71/54/1086897154.db2.gz BWZBKMLQGFNWQL-NVXWUHKLSA-N 1 1 374.485 4.022 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@H](CC(F)(F)F)C3)cs2)c1 ZINC000583673327 1086909775 /nfs/dbraw/zinc/90/97/75/1086909775.db2.gz WECZOEXIWPQDRC-LLVKDONJSA-N 1 1 371.384 4.493 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](CC(F)(F)F)C3)cs2)c1 ZINC000583673327 1086909778 /nfs/dbraw/zinc/90/97/78/1086909778.db2.gz WECZOEXIWPQDRC-LLVKDONJSA-N 1 1 371.384 4.493 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000052803873 1087167351 /nfs/dbraw/zinc/16/73/51/1087167351.db2.gz BDIYNVVCHXKPDQ-SUMWQHHRSA-N 1 1 359.451 4.129 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000052803873 1087167353 /nfs/dbraw/zinc/16/73/53/1087167353.db2.gz BDIYNVVCHXKPDQ-SUMWQHHRSA-N 1 1 359.451 4.129 20 5 FIBDMO C[NH+](C)C[C@H](N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000584223781 1087223366 /nfs/dbraw/zinc/22/33/66/1087223366.db2.gz ZHRUXUTYDCRNQP-PMACEKPBSA-N 1 1 371.456 4.349 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(O)cc(C(F)(F)F)c2)c(Cl)c1 ZINC000584380167 1087311756 /nfs/dbraw/zinc/31/17/56/1087311756.db2.gz OAKFCMOZZLCNIS-UHFFFAOYSA-N 1 1 360.719 4.262 20 5 FIBDMO CC(=O)c1ccc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000142826142 1087480646 /nfs/dbraw/zinc/48/06/46/1087480646.db2.gz RZOWSJCCXVWXNM-HNNXBMFYSA-N 1 1 373.478 4.183 20 5 FIBDMO COc1ccc(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)cc1O ZINC000180389638 1087879158 /nfs/dbraw/zinc/87/91/58/1087879158.db2.gz KLMSNLWAZRNDFP-OAQYLSRUSA-N 1 1 364.401 4.188 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1n1ccnc1 ZINC000180609652 1087980998 /nfs/dbraw/zinc/98/09/98/1087980998.db2.gz UPUHRQYIASSOMS-BEFAXECRSA-N 1 1 366.421 4.134 20 5 FIBDMO Cc1cc(C)c([N+](=O)[O-])c(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)n1 ZINC000541005494 1088187506 /nfs/dbraw/zinc/18/75/06/1088187506.db2.gz MYQWPAYOZVCUSN-YQQQUEKLSA-N 1 1 366.465 4.214 20 5 FIBDMO Cc1ccc(C(C)(C)[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 ZINC000545350608 1088957102 /nfs/dbraw/zinc/95/71/02/1088957102.db2.gz VDLWSUQZJPVPPV-UHFFFAOYSA-N 1 1 368.462 4.447 20 5 FIBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000434892612 1089100001 /nfs/dbraw/zinc/10/00/01/1089100001.db2.gz TUFWBPLJRIEKSB-CJNGLKHVSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000434892612 1089100002 /nfs/dbraw/zinc/10/00/02/1089100002.db2.gz TUFWBPLJRIEKSB-CJNGLKHVSA-N 1 1 373.840 4.065 20 5 FIBDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000505598202 1089254011 /nfs/dbraw/zinc/25/40/11/1089254011.db2.gz YFWQYFLPUIDPEP-AAEUAGOBSA-N 1 1 358.385 4.010 20 5 FIBDMO COCC(C)(C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000430129328 1089372673 /nfs/dbraw/zinc/37/26/73/1089372673.db2.gz RRPCYYOKNYOYDD-UHFFFAOYSA-N 1 1 352.818 4.365 20 5 FIBDMO C[C@@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000514894147 1089569603 /nfs/dbraw/zinc/56/96/03/1089569603.db2.gz OVNRPDPMSIRTQU-CHWSQXEVSA-N 1 1 368.462 4.255 20 5 FIBDMO COc1cc(C)c([C@H](C)[NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])cc1OC ZINC000119661547 1089680500 /nfs/dbraw/zinc/68/05/00/1089680500.db2.gz ROGUZUVAEMBHHF-LBPRGKRZSA-N 1 1 364.829 4.425 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CC[C@@H](c3ccccc3)O2)C2CC2)c1 ZINC001167733821 1090265888 /nfs/dbraw/zinc/26/58/88/1090265888.db2.gz DPRXKLRFLYDXOI-RTWAWAEBSA-N 1 1 352.434 4.480 20 5 FIBDMO C[N@@H+](CC1CC1)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000053183761 1090352685 /nfs/dbraw/zinc/35/26/85/1090352685.db2.gz ORNNZXMWLOBQPP-SFHVURJKSA-N 1 1 373.840 4.270 20 5 FIBDMO Cc1ccc2nc(C[NH2+][C@H]3CCCCc4ccc([N+](=O)[O-])cc43)cn2c1 ZINC000417317339 1090798742 /nfs/dbraw/zinc/79/87/42/1090798742.db2.gz WIVUWCNJJSEGNX-IBGZPJMESA-N 1 1 350.422 4.108 20 5 FIBDMO Cc1ccc2nc(C[NH2+][C@@H]3CCCCc4ccc([N+](=O)[O-])cc43)cn2c1 ZINC000417317340 1090799483 /nfs/dbraw/zinc/79/94/83/1090799483.db2.gz WIVUWCNJJSEGNX-LJQANCHMSA-N 1 1 350.422 4.108 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccn(C3CCCC3)n1)CCCC2 ZINC000417308633 1090800657 /nfs/dbraw/zinc/80/06/57/1090800657.db2.gz HWSDCNWADFGQEC-FQEVSTJZSA-N 1 1 354.454 4.464 20 5 FIBDMO CN(C)Cc1cc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)ccc1F ZINC000417310993 1090804963 /nfs/dbraw/zinc/80/49/63/1090804963.db2.gz LHBBKMBGQBYAKZ-NRFANRHFSA-N 1 1 371.456 4.353 20 5 FIBDMO CC(C)(C)OC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000549470654 1090888178 /nfs/dbraw/zinc/88/81/78/1090888178.db2.gz DBWONWDBKAIMRZ-UHFFFAOYSA-N 1 1 360.376 4.393 20 5 FIBDMO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])o1 ZINC000500098155 1091037217 /nfs/dbraw/zinc/03/72/17/1091037217.db2.gz OOJQGVDENZEYAA-KBXCAEBGSA-N 1 1 371.437 4.298 20 5 FIBDMO COc1cc(NC[C@]2(C)CC[N@@H+](Cc3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000312672167 1091085219 /nfs/dbraw/zinc/08/52/19/1091085219.db2.gz NPCIBZVRBAXWMK-FQEVSTJZSA-N 1 1 373.428 4.067 20 5 FIBDMO O=[N+]([O-])c1ccc(NCC[N@H+]2CCc3sccc3C2)c(C(F)(F)F)c1 ZINC000511679105 1091529695 /nfs/dbraw/zinc/52/96/95/1091529695.db2.gz DCDRXLGWHILVKE-UHFFFAOYSA-N 1 1 371.384 4.145 20 5 FIBDMO COC(=O)c1ccc(Cl)c(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000182119403 1091816380 /nfs/dbraw/zinc/81/63/80/1091816380.db2.gz YFSRDTBLFVMMCO-GFCCVEGCSA-N 1 1 362.813 4.194 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000512215536 1091920872 /nfs/dbraw/zinc/92/08/72/1091920872.db2.gz WVWUWBRYSVHDHX-HNNXBMFYSA-N 1 1 355.221 4.115 20 5 FIBDMO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000073987577 1092233147 /nfs/dbraw/zinc/23/31/47/1092233147.db2.gz FMLXVAXWOZCWIQ-ZDUSSCGKSA-N 1 1 368.389 4.401 20 5 FIBDMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000073987577 1092233162 /nfs/dbraw/zinc/23/31/62/1092233162.db2.gz FMLXVAXWOZCWIQ-ZDUSSCGKSA-N 1 1 368.389 4.401 20 5 FIBDMO Cc1c(C(=O)Nc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)cccc1[N+](=O)[O-] ZINC000500744810 1092483242 /nfs/dbraw/zinc/48/32/42/1092483242.db2.gz FEGWJILVQQUXMF-HNNXBMFYSA-N 1 1 367.449 4.387 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000500771238 1092547764 /nfs/dbraw/zinc/54/77/64/1092547764.db2.gz VDUAATCTZVVGPV-OAHLLOKOSA-N 1 1 353.422 4.079 20 5 FIBDMO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000442887835 1092842674 /nfs/dbraw/zinc/84/26/74/1092842674.db2.gz BRBIUEFHCHKZGW-UHFFFAOYSA-N 1 1 357.385 4.246 20 5 FIBDMO CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000442887835 1092842682 /nfs/dbraw/zinc/84/26/82/1092842682.db2.gz BRBIUEFHCHKZGW-UHFFFAOYSA-N 1 1 357.385 4.246 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433061446 1093169451 /nfs/dbraw/zinc/16/94/51/1093169451.db2.gz PGNLDSMQXYQTTA-GOSISDBHSA-N 1 1 367.449 4.111 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](c4ccccc4)C3)n2)c1 ZINC000433072068 1093195341 /nfs/dbraw/zinc/19/53/41/1093195341.db2.gz MZBZFYVTMBSLSI-KRWDZBQOSA-N 1 1 364.405 4.024 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1OC(F)(F)F ZINC000522268999 1093254978 /nfs/dbraw/zinc/25/49/78/1093254978.db2.gz ILNFQIXVJZKIGQ-UHFFFAOYSA-N 1 1 354.328 4.168 20 5 FIBDMO Cc1ccn2cc(C[NH2+][C@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000433124575 1093271608 /nfs/dbraw/zinc/27/16/08/1093271608.db2.gz DLNPJNJOOAHXSS-SFHVURJKSA-N 1 1 350.422 4.063 20 5 FIBDMO CCc1ccc([C@H](COC)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000433268271 1093512003 /nfs/dbraw/zinc/51/20/03/1093512003.db2.gz CUAMVUBJDTZIRH-ROUUACIJSA-N 1 1 358.438 4.450 20 5 FIBDMO CCn1cc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cn1 ZINC000513039379 1093687598 /nfs/dbraw/zinc/68/75/98/1093687598.db2.gz ADEPILMMBOKYQL-UHFFFAOYSA-N 1 1 360.801 4.014 20 5 FIBDMO CCc1ccc([C@H]([NH2+]CCOC2CCCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544363704 1093715820 /nfs/dbraw/zinc/71/58/20/1093715820.db2.gz VOTOXJSQWVZGGT-HXUWFJFHSA-N 1 1 358.438 4.388 20 5 FIBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473520096 1093970971 /nfs/dbraw/zinc/97/09/71/1093970971.db2.gz IELYFTVCANHDKZ-AWEZNQCLSA-N 1 1 368.462 4.088 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000513256249 1094039152 /nfs/dbraw/zinc/03/91/52/1094039152.db2.gz KQNPVTOAACKDIR-RDTXWAMCSA-N 1 1 364.405 4.228 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000513267016 1094040559 /nfs/dbraw/zinc/04/05/59/1094040559.db2.gz NJFIHXJWOODKLH-QRWLVFNGSA-N 1 1 367.449 4.315 20 5 FIBDMO COc1ccccc1O[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000513367752 1094083438 /nfs/dbraw/zinc/08/34/38/1094083438.db2.gz RLBSUETUUNWFKO-QAPCUYQASA-N 1 1 356.422 4.208 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+](C)Cc3scnc3C)o2)c([N+](=O)[O-])c1 ZINC000513386042 1094098528 /nfs/dbraw/zinc/09/85/28/1094098528.db2.gz FEVMWDTXTPYYAW-UHFFFAOYSA-N 1 1 373.434 4.260 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)Cc3scnc3C)o2)c([N+](=O)[O-])c1 ZINC000513386042 1094098534 /nfs/dbraw/zinc/09/85/34/1094098534.db2.gz FEVMWDTXTPYYAW-UHFFFAOYSA-N 1 1 373.434 4.260 20 5 FIBDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000513665365 1094271990 /nfs/dbraw/zinc/27/19/90/1094271990.db2.gz DVTVGPGWDCOBBH-OAHLLOKOSA-N 1 1 362.433 4.115 20 5 FIBDMO Cc1cc(C)cc([C@@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)c1 ZINC000501014957 1094433495 /nfs/dbraw/zinc/43/34/95/1094433495.db2.gz OMLPTIIUPSUMLO-QGZVFWFLSA-N 1 1 367.449 4.030 20 5 FIBDMO C[C@@H](C[NH+](C)C)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000519550343 1094473252 /nfs/dbraw/zinc/47/32/52/1094473252.db2.gz CWJQCTHUDMFWEP-ZDUSSCGKSA-N 1 1 363.845 4.080 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000501089500 1094489793 /nfs/dbraw/zinc/48/97/93/1094489793.db2.gz KHADGDKHWRMSOG-OAHLLOKOSA-N 1 1 371.437 4.015 20 5 FIBDMO C[C@@H](Nc1nccc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000413252033 1094801593 /nfs/dbraw/zinc/80/15/93/1094801593.db2.gz YLGPJRSFTJMAFD-GDBMZVCRSA-N 1 1 354.454 4.208 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000522535676 1095119040 /nfs/dbraw/zinc/11/90/40/1095119040.db2.gz VUSCPTVCTIAREE-OAHLLOKOSA-N 1 1 366.870 4.491 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000522535676 1095119045 /nfs/dbraw/zinc/11/90/45/1095119045.db2.gz VUSCPTVCTIAREE-OAHLLOKOSA-N 1 1 366.870 4.491 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2cccc(OC(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000513753936 1095792859 /nfs/dbraw/zinc/79/28/59/1095792859.db2.gz HCDXZAXQZHKHLO-UHFFFAOYSA-N 1 1 370.327 4.134 20 5 FIBDMO COc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)ccc1SC ZINC000183802833 1096197160 /nfs/dbraw/zinc/19/71/60/1096197160.db2.gz SGMCXLOLGYQUAL-UHFFFAOYSA-N 1 1 352.843 4.269 20 5 FIBDMO COc1cc(C[NH2+][C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000503369931 1096370441 /nfs/dbraw/zinc/37/04/41/1096370441.db2.gz GNIKPXMWONVGKU-VOJFVSQTSA-N 1 1 364.804 4.421 20 5 FIBDMO COCC[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccco1 ZINC000503921133 1096588042 /nfs/dbraw/zinc/58/80/42/1096588042.db2.gz PIYVPRNILSAKLB-KRWDZBQOSA-N 1 1 356.378 4.315 20 5 FIBDMO CC(C)[N@H+](Cc1cccnc1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425421614 1098573347 /nfs/dbraw/zinc/57/33/47/1098573347.db2.gz NZLHVUMMOXFACM-UHFFFAOYSA-N 1 1 364.243 4.163 20 5 FIBDMO CC(C)[N@@H+](Cc1cccnc1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425421614 1098573361 /nfs/dbraw/zinc/57/33/61/1098573361.db2.gz NZLHVUMMOXFACM-UHFFFAOYSA-N 1 1 364.243 4.163 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c1 ZINC000533100554 1098760504 /nfs/dbraw/zinc/76/05/04/1098760504.db2.gz JPSAWOSONSUWIU-AWEZNQCLSA-N 1 1 355.369 4.255 20 5 FIBDMO Cc1ccc([C@H]2CCC[N@@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1C ZINC000533247058 1098920695 /nfs/dbraw/zinc/92/06/95/1098920695.db2.gz GENIZMMLUZOGBC-GOSISDBHSA-N 1 1 367.449 4.296 20 5 FIBDMO Cc1ccc([C@H]2CCC[N@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1C ZINC000533247058 1098920698 /nfs/dbraw/zinc/92/06/98/1098920698.db2.gz GENIZMMLUZOGBC-GOSISDBHSA-N 1 1 367.449 4.296 20 5 FIBDMO C[C@@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000436330642 1098933944 /nfs/dbraw/zinc/93/39/44/1098933944.db2.gz MCIAMLOULOHRGQ-VXGBXAGGSA-N 1 1 372.391 4.074 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000533435534 1099056088 /nfs/dbraw/zinc/05/60/88/1099056088.db2.gz IAOYKGHLJPDULI-SJLPKXTDSA-N 1 1 367.449 4.110 20 5 FIBDMO CCCCOc1ncccc1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000516906700 1099915856 /nfs/dbraw/zinc/91/58/56/1099915856.db2.gz MOBWVXVMSPNCPZ-LJQANCHMSA-N 1 1 355.438 4.336 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1)C(C)C ZINC000508778674 1100061706 /nfs/dbraw/zinc/06/17/06/1100061706.db2.gz NLJLXIOBYAJKTC-UHFFFAOYSA-N 1 1 371.437 4.086 20 5 FIBDMO CCN(Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000517124073 1100092624 /nfs/dbraw/zinc/09/26/24/1100092624.db2.gz MAIRGSJOPZZJPG-UTKZUKDTSA-N 1 1 353.466 4.252 20 5 FIBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000536658446 1100113613 /nfs/dbraw/zinc/11/36/13/1100113613.db2.gz AFJUUUKJYSLQQI-BEFAXECRSA-N 1 1 357.454 4.017 20 5 FIBDMO CCN1CC[C@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000536658446 1100113671 /nfs/dbraw/zinc/11/36/71/1100113671.db2.gz AFJUUUKJYSLQQI-BEFAXECRSA-N 1 1 357.454 4.017 20 5 FIBDMO 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ZQLCWKXOLAVBEB-UAGQMJEPSA-N 1 1 372.387 4.129 20 5 FIBDMO Cc1ccccc1NC(=O)CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451542826 1107161469 /nfs/dbraw/zinc/16/14/69/1107161469.db2.gz AJJDXQHVGXYMRM-GOSISDBHSA-N 1 1 367.449 4.111 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000451856729 1107345465 /nfs/dbraw/zinc/34/54/65/1107345465.db2.gz PVRAGHJMBZJKIY-LJQANCHMSA-N 1 1 369.421 4.052 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2[C@@H]3CC[C@@H](C3)[C@@]2(C)C1 ZINC000452044519 1107441647 /nfs/dbraw/zinc/44/16/47/1107441647.db2.gz JCAXLKYKWSTQGN-BEHZHLIESA-N 1 1 368.437 4.074 20 5 FIBDMO COc1cccc(NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000475503495 1107590407 /nfs/dbraw/zinc/59/04/07/1107590407.db2.gz NIDRHIQKNWILHX-GUYCJALGSA-N 1 1 361.467 4.160 20 5 FIBDMO COc1cccc(NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000475503493 1107591558 /nfs/dbraw/zinc/59/15/58/1107591558.db2.gz NIDRHIQKNWILHX-CXAGYDPISA-N 1 1 361.467 4.160 20 5 FIBDMO COC[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccc(F)cc1 ZINC000531206911 1107647635 /nfs/dbraw/zinc/64/76/35/1107647635.db2.gz QCHIIVVOUYCEFR-SFHVURJKSA-N 1 1 370.380 4.471 20 5 FIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cc2cccc(F)c2o1 ZINC000444693769 1108097031 /nfs/dbraw/zinc/09/70/31/1108097031.db2.gz PFIJLINCQDIWOB-JTQLQIEISA-N 1 1 354.341 4.207 20 5 FIBDMO CC(C)(O)C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C1CC1 ZINC000428407217 1108833302 /nfs/dbraw/zinc/83/33/02/1108833302.db2.gz WCOQXWORMSLNEF-UHFFFAOYSA-N 1 1 374.412 4.262 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccccc1)C(C)(C)CO ZINC000429726111 1109607133 /nfs/dbraw/zinc/60/71/33/1109607133.db2.gz QHUFVYMLEKXJLT-HXUWFJFHSA-N 1 1 372.465 4.231 20 5 FIBDMO CC(C)(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000152300176 1109609635 /nfs/dbraw/zinc/60/96/35/1109609635.db2.gz MHHYHCUBXJOWCJ-UHFFFAOYSA-N 1 1 366.421 4.446 20 5 FIBDMO COC[C@@]1(C)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000449394686 1110050655 /nfs/dbraw/zinc/05/06/55/1110050655.db2.gz OLJVFESELRNBSY-SFHVURJKSA-N 1 1 364.829 4.367 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3C[C@H](C4CC4)[C@@H]3C3CC3)cs2)c1 ZINC000449536454 1110103470 /nfs/dbraw/zinc/10/34/70/1110103470.db2.gz IOFDSMRBSCGGIP-MSOLQXFVSA-N 1 1 355.463 4.339 20 5 FIBDMO Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000449731591 1110155164 /nfs/dbraw/zinc/15/51/64/1110155164.db2.gz JJZIAGCRBDIZNM-LJQANCHMSA-N 1 1 372.396 4.246 20 5 FIBDMO Cc1cc(F)ccc1[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000449731591 1110155166 /nfs/dbraw/zinc/15/51/66/1110155166.db2.gz JJZIAGCRBDIZNM-LJQANCHMSA-N 1 1 372.396 4.246 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1cnn(C)c1 ZINC000538418031 1111125241 /nfs/dbraw/zinc/12/52/41/1111125241.db2.gz SOOLZWJLWSBPMJ-NSHDSACASA-N 1 1 360.801 4.093 20 5 FIBDMO C[C@H]1OCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@H]1C ZINC000538726311 1111276532 /nfs/dbraw/zinc/27/65/32/1111276532.db2.gz JVAMTAUTECJELC-NWDGAFQWSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@H]1OCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@H]1C ZINC000538726311 1111276533 /nfs/dbraw/zinc/27/65/33/1111276533.db2.gz JVAMTAUTECJELC-NWDGAFQWSA-N 1 1 350.802 4.117 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC3(C2)CCOCC3)s1 ZINC000538763599 1111290841 /nfs/dbraw/zinc/29/08/41/1111290841.db2.gz MIGWMTJUVJZIKQ-UHFFFAOYSA-N 1 1 358.463 4.326 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1Cl ZINC000478049260 1111665602 /nfs/dbraw/zinc/66/56/02/1111665602.db2.gz YVAQNNJQSFKUHW-UHFFFAOYSA-N 1 1 368.220 4.216 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC)CCC2 ZINC000478051524 1111666803 /nfs/dbraw/zinc/66/68/03/1111666803.db2.gz CZNMUYOHTNNKQD-HNNXBMFYSA-N 1 1 361.467 4.132 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC)CCC2 ZINC000478051524 1111666805 /nfs/dbraw/zinc/66/68/05/1111666805.db2.gz CZNMUYOHTNNKQD-HNNXBMFYSA-N 1 1 361.467 4.132 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]C2CCN(CCc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000552925783 1111851122 /nfs/dbraw/zinc/85/11/22/1111851122.db2.gz JMHSNRJWHVHBRU-GOSISDBHSA-N 1 1 367.493 4.261 20 5 FIBDMO CC(=O)c1cc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000553294669 1111942462 /nfs/dbraw/zinc/94/24/62/1111942462.db2.gz HRUFUHCUWWGDQN-UHFFFAOYSA-N 1 1 371.412 4.013 20 5 FIBDMO C[C@@H](NCc1ccccc1C[NH+]1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000480435747 1112425065 /nfs/dbraw/zinc/42/50/65/1112425065.db2.gz GZJDFLMWEAQBAC-QGZVFWFLSA-N 1 1 353.466 4.432 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(OC(F)(F)F)cc1 ZINC000480466889 1112435229 /nfs/dbraw/zinc/43/52/29/1112435229.db2.gz ZOBKFLDJRBZVCI-JTQLQIEISA-N 1 1 358.291 4.483 20 5 FIBDMO CC(C)n1cc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)cn1 ZINC000555424575 1112833653 /nfs/dbraw/zinc/83/36/53/1112833653.db2.gz LDOYTHHCHTZCQO-NSHDSACASA-N 1 1 356.348 4.242 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4C[C@@H]4C3)o2)c(Br)c1 ZINC000600190108 1112916490 /nfs/dbraw/zinc/91/64/90/1112916490.db2.gz GNQHQMSANUORSY-PHIMTYICSA-N 1 1 363.211 4.069 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482420491 1113246884 /nfs/dbraw/zinc/24/68/84/1113246884.db2.gz AICVZRKWCBIGLV-CTTRRDQISA-N 1 1 350.418 4.130 20 5 FIBDMO Cc1cccc(CC2(O)CC[NH+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2)c1 ZINC000482954206 1113406394 /nfs/dbraw/zinc/40/63/94/1113406394.db2.gz XASHEFGIYBHQDL-UHFFFAOYSA-N 1 1 374.868 4.126 20 5 FIBDMO C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486551912 1113593337 /nfs/dbraw/zinc/59/33/37/1113593337.db2.gz UJUGEQLAUDSFOO-MQEUPEBQSA-N 1 1 365.477 4.108 20 5 FIBDMO C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486551912 1113593341 /nfs/dbraw/zinc/59/33/41/1113593341.db2.gz UJUGEQLAUDSFOO-MQEUPEBQSA-N 1 1 365.477 4.108 20 5 FIBDMO CC(C)[N@H+]1CCC[C@@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000491035726 1114364615 /nfs/dbraw/zinc/36/46/15/1114364615.db2.gz JZWOKVIHYALPEA-PGRDOPGGSA-N 1 1 367.493 4.394 20 5 FIBDMO Cc1ccc(-c2nnc([C@H](C)[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000571703738 1114493089 /nfs/dbraw/zinc/49/30/89/1114493089.db2.gz CUSMFRVNNYOOQJ-HNNXBMFYSA-N 1 1 366.421 4.189 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000164405110 1114494153 /nfs/dbraw/zinc/49/41/53/1114494153.db2.gz NZVJSDOJPGOINU-IBGZPJMESA-N 1 1 371.412 4.208 20 5 FIBDMO Cc1c[nH+]cn1C1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000588037889 1114517129 /nfs/dbraw/zinc/51/71/29/1114517129.db2.gz ZEEBKCQXYGSZKX-UHFFFAOYSA-N 1 1 355.225 4.248 20 5 FIBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccc2ccccc2c1 ZINC000045799640 1115067113 /nfs/dbraw/zinc/06/71/13/1115067113.db2.gz NLQKINONWNNIMH-UHFFFAOYSA-N 1 1 363.417 4.209 20 5 FIBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cc(Br)ccc2Cl)c1 ZINC000225267318 1115115669 /nfs/dbraw/zinc/11/56/69/1115115669.db2.gz AIDUXNHAAGDCJP-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCCc1ccsc1)[C@H]1CC[C@H](O)CC1 ZINC000592133626 1115203307 /nfs/dbraw/zinc/20/33/07/1115203307.db2.gz ZDALPOLUWPPCQE-WGSAOQKQSA-N 1 1 374.506 4.395 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cc1 ZINC000592130765 1115204838 /nfs/dbraw/zinc/20/48/38/1115204838.db2.gz NDPTVNVLBIVFIP-MXVIHJGJSA-N 1 1 354.450 4.209 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C2(c3cccc(Cl)c3)CCC2)c1 ZINC000593034865 1115280838 /nfs/dbraw/zinc/28/08/38/1115280838.db2.gz KNDKTRMXPOXTKA-UHFFFAOYSA-N 1 1 374.824 4.204 20 5 FIBDMO COc1ccc(-c2ccc(C[NH+]3CC(C)(CC(F)F)C3)o2)c([N+](=O)[O-])c1 ZINC000592523710 1115340947 /nfs/dbraw/zinc/34/09/47/1115340947.db2.gz RPKLCAHNHDJPEG-UHFFFAOYSA-N 1 1 366.364 4.341 20 5 FIBDMO C[C@H]1CC2(C[N@H+]1Cc1ccc(-c3cccc([N+](=O)[O-])c3)o1)CCOCC2 ZINC000592526020 1115341568 /nfs/dbraw/zinc/34/15/68/1115341568.db2.gz FMFXGBZXACKUIF-HNNXBMFYSA-N 1 1 356.422 4.246 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(COc3cc[nH+]c4c3CCCC4)co2)cc1 ZINC000594493833 1115450136 /nfs/dbraw/zinc/45/01/36/1115450136.db2.gz SLLTXGJZQKYBSJ-UHFFFAOYSA-N 1 1 351.362 4.103 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)cc1[N+](=O)[O-] ZINC000594934561 1115500661 /nfs/dbraw/zinc/50/06/61/1115500661.db2.gz CIZVMWSJWOJOFF-LLVKDONJSA-N 1 1 354.328 4.495 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000595016963 1115504075 /nfs/dbraw/zinc/50/40/75/1115504075.db2.gz SQNWXVNGTBOIID-CYFNAFFESA-N 1 1 374.412 4.313 20 5 FIBDMO CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014420 1115504109 /nfs/dbraw/zinc/50/41/09/1115504109.db2.gz PIYLDONDXDWIMQ-FZKQIMNGSA-N 1 1 356.422 4.340 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccc(OC2CC2)c1F ZINC000595068307 1115509190 /nfs/dbraw/zinc/50/91/90/1115509190.db2.gz JHXBVSYAIHVTFL-GFCCVEGCSA-N 1 1 360.385 4.135 20 5 FIBDMO CCOc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)CCO2 ZINC000595031679 1115510046 /nfs/dbraw/zinc/51/00/46/1115510046.db2.gz BJMFZCOWVMYHFG-UGSOOPFHSA-N 1 1 372.421 4.177 20 5 FIBDMO COc1ccc(-c2cc(C[NH2+][C@@H]3CCc4c3cccc4[N+](=O)[O-])on2)cc1 ZINC000595076264 1115517082 /nfs/dbraw/zinc/51/70/82/1115517082.db2.gz GOJVLIYXDKJHFB-GOSISDBHSA-N 1 1 365.389 4.036 20 5 FIBDMO CCOc1cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)ccc1OC(F)F ZINC000046776953 1115528314 /nfs/dbraw/zinc/52/83/14/1115528314.db2.gz HJZJVIXHYGVZLR-UHFFFAOYSA-N 1 1 366.364 4.227 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000595484015 1115536662 /nfs/dbraw/zinc/53/66/62/1115536662.db2.gz OSVRWHBNDJVXSR-HNNXBMFYSA-N 1 1 373.211 4.254 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC=C(c2cn(C(C)C)nn2)CC1 ZINC000595528440 1115540506 /nfs/dbraw/zinc/54/05/06/1115540506.db2.gz YCGJLFAJFIJGLA-MRXNPFEDSA-N 1 1 369.469 4.316 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H]([C@H]3CCCCO3)C2)c1 ZINC000595785782 1115563502 /nfs/dbraw/zinc/56/35/02/1115563502.db2.gz GOEDNUXTPJCPJZ-SUMWQHHRSA-N 1 1 372.387 4.395 20 5 FIBDMO CC[C@H](c1ccccc1)[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C(C)C ZINC000595857596 1115564608 /nfs/dbraw/zinc/56/46/08/1115564608.db2.gz OUROTSOXJANODB-GOSISDBHSA-N 1 1 355.438 4.055 20 5 FIBDMO Cc1cc(CNc2ccc(C(F)F)cc2[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000596238928 1115580197 /nfs/dbraw/zinc/58/01/97/1115580197.db2.gz RYXSZAHJJXMXFY-UHFFFAOYSA-N 1 1 362.380 4.448 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](N(C)c2ccc(C)cc2)C1 ZINC001168413871 1115752515 /nfs/dbraw/zinc/75/25/15/1115752515.db2.gz LMYCQLDVBODHJK-FQEVSTJZSA-N 1 1 369.465 4.013 20 5 FIBDMO Cc1nn(C[N@@H+]2CCS[C@H](c3ccccc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761292269 1115765434 /nfs/dbraw/zinc/76/54/34/1115765434.db2.gz QOSWLPVDYNEMDW-IBGZPJMESA-N 1 1 368.462 4.001 20 5 FIBDMO Cc1nn(C[N@H+]2CCS[C@H](c3ccccc3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761292269 1115765437 /nfs/dbraw/zinc/76/54/37/1115765437.db2.gz QOSWLPVDYNEMDW-IBGZPJMESA-N 1 1 368.462 4.001 20 5 FIBDMO C[C@@H](Nc1ccc2cnccc2c1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000599066958 1115786740 /nfs/dbraw/zinc/78/67/40/1115786740.db2.gz VJVNNASEMWZBHB-ZBFHGGJFSA-N 1 1 354.454 4.208 20 5 FIBDMO CCc1ccc([C@H](NC[C@@H]2CCCC[N@@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599072033 1115786917 /nfs/dbraw/zinc/78/69/17/1115786917.db2.gz WZELYUUUCZYSPF-HRAATJIYSA-N 1 1 371.481 4.161 20 5 FIBDMO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c(OC)c1 ZINC000599071909 1115787138 /nfs/dbraw/zinc/78/71/38/1115787138.db2.gz BNGLNXDZICAHCF-OLZOCXBDSA-N 1 1 360.410 4.032 20 5 FIBDMO CC(C)(C)OC(=O)[C@@H]1C[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)c2ccccc21 ZINC000593691725 1115797265 /nfs/dbraw/zinc/79/72/65/1115797265.db2.gz SAWMCIVKPFGWCJ-HZPDHXFCSA-N 1 1 374.462 4.316 20 5 FIBDMO O=[N+]([O-])c1cc(CNCC[NH+]2CCCCC2)ccc1Oc1ccc(F)cc1 ZINC000603633601 1115801318 /nfs/dbraw/zinc/80/13/18/1115801318.db2.gz VGCUEBXAMPQLSK-UHFFFAOYSA-N 1 1 373.428 4.102 20 5 FIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(C(F)(F)F)cc1 ZINC000603838747 1115818415 /nfs/dbraw/zinc/81/84/15/1115818415.db2.gz GKASXRWLPCGKRU-UHFFFAOYSA-N 1 1 354.328 4.124 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](CCO)c1cc(Cl)cc(Cl)c1 ZINC000599680215 1115837794 /nfs/dbraw/zinc/83/77/94/1115837794.db2.gz LJLADISTQVGKQW-HNNXBMFYSA-N 1 1 373.211 4.254 20 5 FIBDMO C[C@@H]1Cc2ccccc2N1C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000604483265 1115866405 /nfs/dbraw/zinc/86/64/05/1115866405.db2.gz JZGAXPZLSRPUPB-CQSZACIVSA-N 1 1 357.479 4.072 20 5 FIBDMO CCN(Cc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000608788722 1116130067 /nfs/dbraw/zinc/13/00/67/1116130067.db2.gz QSCZSXQUDNSWHA-UTKZUKDTSA-N 1 1 353.466 4.252 20 5 FIBDMO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089907700 1116347011 /nfs/dbraw/zinc/34/70/11/1116347011.db2.gz DYBRWUOBVRUDRK-IBGZPJMESA-N 1 1 366.421 4.316 20 5 FIBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089907700 1116347013 /nfs/dbraw/zinc/34/70/13/1116347013.db2.gz DYBRWUOBVRUDRK-IBGZPJMESA-N 1 1 366.421 4.316 20 5 FIBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC1CCN(c2ccccn2)CC1 ZINC000076108900 1116396578 /nfs/dbraw/zinc/39/65/78/1116396578.db2.gz XSTHXZAUKGEJPU-UHFFFAOYSA-N 1 1 368.481 4.037 20 5 FIBDMO Cc1[nH+]cn(-c2ccc(NC(=O)c3cc([N+](=O)[O-])c(C)s3)cc2)c1C ZINC000462762318 1117754057 /nfs/dbraw/zinc/75/40/57/1117754057.db2.gz LTKAMSOKHCYLHA-UHFFFAOYSA-N 1 1 356.407 4.020 20 5 FIBDMO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000540323784 1117991961 /nfs/dbraw/zinc/99/19/61/1117991961.db2.gz CEORGEJSQSTCPJ-AWEZNQCLSA-N 1 1 372.421 4.099 20 5 FIBDMO CC(C)COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000540475559 1118077752 /nfs/dbraw/zinc/07/77/52/1118077752.db2.gz OWGKTGXTWVGGEL-QGZVFWFLSA-N 1 1 374.485 4.240 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Oc3ccccc3)nn2)cc1[N+](=O)[O-] ZINC000540476740 1118078579 /nfs/dbraw/zinc/07/85/79/1118078579.db2.gz DJEMPEHXRAOAQT-HNNXBMFYSA-N 1 1 364.405 4.336 20 5 FIBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)n1 ZINC000541007203 1118343154 /nfs/dbraw/zinc/34/31/54/1118343154.db2.gz REVAIYSJRSZSMM-PBHICJAKSA-N 1 1 360.483 4.163 20 5 FIBDMO O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1cc2ccccc2c2cccnc12 ZINC000464332915 1118530284 /nfs/dbraw/zinc/53/02/84/1118530284.db2.gz IXOGJSHIHIYQRT-LJQANCHMSA-N 1 1 373.500 4.382 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@H](C)c3cccnc3)o2)c([N+](=O)[O-])c1 ZINC000541759980 1118633499 /nfs/dbraw/zinc/63/34/99/1118633499.db2.gz BKMNYSKGGROSOO-CQSZACIVSA-N 1 1 367.405 4.451 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000541773009 1118645559 /nfs/dbraw/zinc/64/55/59/1118645559.db2.gz NHNMKYRMYNBZBQ-SFHVURJKSA-N 1 1 354.406 4.012 20 5 FIBDMO C[C@H](c1c(F)cccc1F)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000464770646 1118681085 /nfs/dbraw/zinc/68/10/85/1118681085.db2.gz BZFWTNYWWOIUEX-CYBMUJFWSA-N 1 1 362.376 4.477 20 5 FIBDMO C[C@@H](c1cc(F)ccc1F)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000464781680 1118692739 /nfs/dbraw/zinc/69/27/39/1118692739.db2.gz ZXWAOTYQEQOQKW-ZDUSSCGKSA-N 1 1 362.376 4.477 20 5 FIBDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000465273273 1118909248 /nfs/dbraw/zinc/90/92/48/1118909248.db2.gz QEMHYCSHSNPNOV-KRWDZBQOSA-N 1 1 361.489 4.096 20 5 FIBDMO CCC[C@@H]([NH2+][C@@H](C)c1cn(-c2ccccc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000090449817 1119161860 /nfs/dbraw/zinc/16/18/60/1119161860.db2.gz OUGAISAXUXDYHG-HNAYVOBHSA-N 1 1 365.437 4.368 20 5 FIBDMO CCOc1cc(C[N@@H+](CCOC)[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000492718782 1119172266 /nfs/dbraw/zinc/17/22/66/1119172266.db2.gz BVJWJDRXARGYFG-INIZCTEOSA-N 1 1 358.438 4.203 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000493177688 1119327688 /nfs/dbraw/zinc/32/76/88/1119327688.db2.gz CSMXNGMQVIPVLM-UHFFFAOYSA-N 1 1 368.824 4.414 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000493177688 1119327693 /nfs/dbraw/zinc/32/76/93/1119327693.db2.gz CSMXNGMQVIPVLM-UHFFFAOYSA-N 1 1 368.824 4.414 20 5 FIBDMO C[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC000761524528 1119411890 /nfs/dbraw/zinc/41/18/90/1119411890.db2.gz FKDVVUXMIIPQJG-MAUKXSAKSA-N 1 1 373.884 4.391 20 5 FIBDMO C[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCN1Cc1ccccc1 ZINC000761524528 1119411895 /nfs/dbraw/zinc/41/18/95/1119411895.db2.gz FKDVVUXMIIPQJG-MAUKXSAKSA-N 1 1 373.884 4.391 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000494293252 1119821584 /nfs/dbraw/zinc/82/15/84/1119821584.db2.gz NMISTDQWOVUAQA-UVTDQMKNSA-N 1 1 373.840 4.222 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000494293252 1119821589 /nfs/dbraw/zinc/82/15/89/1119821589.db2.gz NMISTDQWOVUAQA-UVTDQMKNSA-N 1 1 373.840 4.222 20 5 FIBDMO COc1ccc([C@@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)cc1 ZINC000609194225 1119842066 /nfs/dbraw/zinc/84/20/66/1119842066.db2.gz GNQMVTYCVLKZBJ-QGZVFWFLSA-N 1 1 370.449 4.380 20 5 FIBDMO COc1ccccc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494513941 1119884294 /nfs/dbraw/zinc/88/42/94/1119884294.db2.gz MODMBGPPHKAZQS-LLVKDONJSA-N 1 1 354.328 4.473 20 5 FIBDMO C[C@@H]([NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)c1ccccc1 ZINC001168473742 1120371581 /nfs/dbraw/zinc/37/15/81/1120371581.db2.gz GFYLKHRTKIXAPL-LLVKDONJSA-N 1 1 358.785 4.149 20 5 FIBDMO CCOc1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1F ZINC000494963508 1120404929 /nfs/dbraw/zinc/40/49/29/1120404929.db2.gz YRZWRZZLYCWTBJ-UHFFFAOYSA-N 1 1 374.412 4.176 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CC3CCCCC3)C3CC3)o2)cc1 ZINC000076781424 1121108452 /nfs/dbraw/zinc/10/84/52/1121108452.db2.gz SUUMOOQMAVPUSW-UHFFFAOYSA-N 1 1 356.426 4.190 20 5 FIBDMO O=C(CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)Nc1ccccc1Cl ZINC000153329886 1121113534 /nfs/dbraw/zinc/11/35/34/1121113534.db2.gz HONREZZAYDJAIZ-UHFFFAOYSA-N 1 1 373.840 4.241 20 5 FIBDMO CC[C@@H]([NH2+]Cc1ccn(-c2ccc(F)cc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000090944514 1121207769 /nfs/dbraw/zinc/20/77/69/1121207769.db2.gz LZXKVDHUSCDWSV-LJQANCHMSA-N 1 1 354.385 4.161 20 5 FIBDMO CC[C@H](c1ccncc1)[N@H+](CC)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000131498552 1121701102 /nfs/dbraw/zinc/70/11/02/1121701102.db2.gz JRUCTNONDSRPPI-HXUWFJFHSA-N 1 1 365.437 4.284 20 5 FIBDMO CC[C@H](c1ccncc1)[N@@H+](CC)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000131498552 1121701107 /nfs/dbraw/zinc/70/11/07/1121701107.db2.gz JRUCTNONDSRPPI-HXUWFJFHSA-N 1 1 365.437 4.284 20 5 FIBDMO COc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000301520571 1122199353 /nfs/dbraw/zinc/19/93/53/1122199353.db2.gz FIYQJCWRHSELJA-CRAIPNDOSA-N 1 1 355.438 4.068 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])cc2)C1 ZINC000154329177 1122234359 /nfs/dbraw/zinc/23/43/59/1122234359.db2.gz GJQMSIYZHJXOFL-AWEZNQCLSA-N 1 1 371.412 4.218 20 5 FIBDMO O=[N+]([O-])c1ncccc1C[NH2+][C@@H](COCc1ccccc1)c1ccccc1 ZINC001168633918 1122243669 /nfs/dbraw/zinc/24/36/69/1122243669.db2.gz VMCRMRMDQLOJQX-FQEVSTJZSA-N 1 1 363.417 4.038 20 5 FIBDMO CCC[N@H+]1CC[C@H](CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000919722947 1123109958 /nfs/dbraw/zinc/10/99/58/1123109958.db2.gz UWWQMJGDNRFMNW-SNVBAGLBSA-N 1 1 365.783 4.411 20 5 FIBDMO COc1cc(C[N@H+]2CCCC[C@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000609766972 1123825746 /nfs/dbraw/zinc/82/57/46/1123825746.db2.gz AEFMABHVXIFSNC-ZDUSSCGKSA-N 1 1 358.385 4.215 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H](C)C2CC2)cc1 ZINC000064641532 1123889602 /nfs/dbraw/zinc/88/96/02/1123889602.db2.gz ONSPCZULSRJRSJ-HNNXBMFYSA-N 1 1 370.449 4.413 20 5 FIBDMO Cn1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c(-c2ccccc2)n1 ZINC000179695588 1124032487 /nfs/dbraw/zinc/03/24/87/1124032487.db2.gz XFMNUWODROIVIX-UHFFFAOYSA-N 1 1 362.433 4.160 20 5 FIBDMO Cn1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c(-c2ccccc2)n1 ZINC000179695588 1124032492 /nfs/dbraw/zinc/03/24/92/1124032492.db2.gz XFMNUWODROIVIX-UHFFFAOYSA-N 1 1 362.433 4.160 20 5 FIBDMO COc1ccc(C[N@@H+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)cc1OC ZINC000615833449 1124127815 /nfs/dbraw/zinc/12/78/15/1124127815.db2.gz HJDMWMGESXGNGC-XNTDXEJSSA-N 1 1 356.422 4.147 20 5 FIBDMO CCc1ccc(C(C)(C)[NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000180101633 1124221378 /nfs/dbraw/zinc/22/13/78/1124221378.db2.gz NGBFNPHTJZGUJA-UHFFFAOYSA-N 1 1 366.421 4.232 20 5 FIBDMO COC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1cccc(Cl)c1F ZINC000554095463 1124273941 /nfs/dbraw/zinc/27/39/41/1124273941.db2.gz PDLRBZAUUMVZDY-OAHLLOKOSA-N 1 1 352.793 4.173 20 5 FIBDMO CC[C@H]([NH2+][C@@H](COC)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000091413295 1124384858 /nfs/dbraw/zinc/38/48/58/1124384858.db2.gz RYTLMUAPEIKKCQ-ROUUACIJSA-N 1 1 350.365 4.301 20 5 FIBDMO C[C@H](O)[C@H]1CCC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000542820453 1124390443 /nfs/dbraw/zinc/39/04/43/1124390443.db2.gz ZLENPFJIWVCIMF-HOCLYGCPSA-N 1 1 374.412 4.119 20 5 FIBDMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000616994123 1124423824 /nfs/dbraw/zinc/42/38/24/1124423824.db2.gz UYUQLDAGRIVYAP-MRXNPFEDSA-N 1 1 361.489 4.238 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000181568120 1125019175 /nfs/dbraw/zinc/01/91/75/1125019175.db2.gz BGVLKFDWLRQUFG-CYBMUJFWSA-N 1 1 374.412 4.382 20 5 FIBDMO COCc1ccccc1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113317641 1125149504 /nfs/dbraw/zinc/14/95/04/1125149504.db2.gz OFJIWNKQVQOZIU-UHFFFAOYSA-N 1 1 369.446 4.155 20 5 FIBDMO C[C@H](N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000311850866 1125232583 /nfs/dbraw/zinc/23/25/83/1125232583.db2.gz SJRSXTIWISVEFY-JENIJYKNSA-N 1 1 353.466 4.156 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000301776032 1125264212 /nfs/dbraw/zinc/26/42/12/1125264212.db2.gz LHHOMUROKYFGNW-DOMZBBRYSA-N 1 1 369.387 4.067 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481701800 568092123 /nfs/dbraw/zinc/09/21/23/568092123.db2.gz FYBZIHHRESFMHF-LJQANCHMSA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481701800 568092124 /nfs/dbraw/zinc/09/21/24/568092124.db2.gz FYBZIHHRESFMHF-LJQANCHMSA-N 1 1 358.825 4.270 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481715106 568093829 /nfs/dbraw/zinc/09/38/29/568093829.db2.gz WRFMFPATUWFOEK-HRAATJIYSA-N 1 1 352.434 4.486 20 5 FIBDMO CC[C@@H](C[N@@H+](CC)CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000481747655 568108355 /nfs/dbraw/zinc/10/83/55/568108355.db2.gz HXSIWKHAWRBACC-KRWDZBQOSA-N 1 1 369.465 4.357 20 5 FIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc2c(c1)CCCC2 ZINC000181929475 568211874 /nfs/dbraw/zinc/21/18/74/568211874.db2.gz GBKLTDMPIUESDB-ZDUSSCGKSA-N 1 1 351.406 4.466 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1c(F)cccc1OC(F)F ZINC000569116488 568280468 /nfs/dbraw/zinc/28/04/68/568280468.db2.gz HJVRRCYZGIMHLB-AWEZNQCLSA-N 1 1 352.312 4.112 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccccc1C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000078491663 1125541735 /nfs/dbraw/zinc/54/17/35/1125541735.db2.gz VQWWXYYLQVDPSJ-MRXNPFEDSA-N 1 1 355.438 4.315 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000078491663 1125541742 /nfs/dbraw/zinc/54/17/42/1125541742.db2.gz VQWWXYYLQVDPSJ-MRXNPFEDSA-N 1 1 355.438 4.315 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2ccsc2)c([N+](=O)[O-])cc1OC(F)F ZINC000619782690 1125695174 /nfs/dbraw/zinc/69/51/74/1125695174.db2.gz JMCXLACNMAVEJM-VIFPVBQESA-N 1 1 358.366 4.117 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)o2)c1 ZINC000535808670 1079792405 /nfs/dbraw/zinc/79/24/05/1079792405.db2.gz QYXFMRVFTSDHBS-DLBZAZTESA-N 1 1 356.422 4.103 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1F ZINC000126943833 1080035447 /nfs/dbraw/zinc/03/54/47/1080035447.db2.gz SSSINPIODQAUNB-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(Br)ccc1F ZINC000127094566 1080190775 /nfs/dbraw/zinc/19/07/75/1080190775.db2.gz MCTRWLYWSMDULF-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO O=C(CC[N@@H+](CC1CCCCC1)C1CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC001167094280 1080329903 /nfs/dbraw/zinc/32/99/03/1080329903.db2.gz KGYQPXDCFHCMHX-UHFFFAOYSA-N 1 1 363.433 4.107 20 5 FIBDMO CC(C)[N@@H+](CCc1ccccc1)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001167219149 1080860391 /nfs/dbraw/zinc/86/03/91/1080860391.db2.gz XKEABSBQUFPBRK-UHFFFAOYSA-N 1 1 366.421 4.098 20 5 FIBDMO COc1ccc(C[NH2+][C@@H]2COc3c2ccc(Cl)c3Cl)cc1[N+](=O)[O-] ZINC000610271622 1080999702 /nfs/dbraw/zinc/99/97/02/1080999702.db2.gz CMRWWQYDYSHTOA-GFCCVEGCSA-N 1 1 369.204 4.134 20 5 FIBDMO C[N@@H+](Cc1ccco1)Cc1ccccc1CNc1ccsc1[N+](=O)[O-] ZINC000610279468 1081169366 /nfs/dbraw/zinc/16/93/66/1081169366.db2.gz ACEFIXRBUISVHG-UHFFFAOYSA-N 1 1 357.435 4.493 20 5 FIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)c1cccc(OC)c1 ZINC000083175664 1081284422 /nfs/dbraw/zinc/28/44/22/1081284422.db2.gz GYKRUGVOEBPKAU-CYBMUJFWSA-N 1 1 355.394 4.328 20 5 FIBDMO C[C@H]1C[C@@H](N(C)Cc2c(F)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000610003580 1081371152 /nfs/dbraw/zinc/37/11/52/1081371152.db2.gz XERCDIVENPXBQU-WMZOPIPTSA-N 1 1 371.456 4.219 20 5 FIBDMO C[C@@H](CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)CC(C)(C)C ZINC000560548216 1081428098 /nfs/dbraw/zinc/42/80/98/1081428098.db2.gz DGOPJVFHJMCWKN-YJBOKZPZSA-N 1 1 358.486 4.470 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)c1 ZINC000175847595 1081454907 /nfs/dbraw/zinc/45/49/07/1081454907.db2.gz LKWLIPZZDBMRQP-CJNGLKHVSA-N 1 1 366.870 4.398 20 5 FIBDMO C[C@@H]([NH2+][C@H](CN1CCCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610420442 1081835049 /nfs/dbraw/zinc/83/50/49/1081835049.db2.gz IAWPQWRURWCKGM-DYESRHJHSA-N 1 1 353.466 4.473 20 5 FIBDMO COc1cccc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000379664034 1081851629 /nfs/dbraw/zinc/85/16/29/1081851629.db2.gz NNBVNBWUAUQHGQ-WBVHZDCISA-N 1 1 355.438 4.068 20 5 FIBDMO C[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000379656995 1081852098 /nfs/dbraw/zinc/85/20/98/1081852098.db2.gz RDPUZLQPCXDZMT-QAPCUYQASA-N 1 1 373.884 4.391 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)s1 ZINC000610469433 1082232282 /nfs/dbraw/zinc/23/22/82/1082232282.db2.gz OXIMRYGIQXLSSF-IBGZPJMESA-N 1 1 357.479 4.149 20 5 FIBDMO Cc1ccc(C[NH+]2CCC(Oc3ccc(F)cc3F)CC2)cc1[N+](=O)[O-] ZINC000510515954 1083131405 /nfs/dbraw/zinc/13/14/05/1083131405.db2.gz AXWPLCQQTFLQHI-UHFFFAOYSA-N 1 1 362.376 4.225 20 5 FIBDMO COc1ccc(C2([NH2+]Cc3nc4cc([N+](=O)[O-])ccc4o3)CCCC2)cc1 ZINC000610581426 1083210462 /nfs/dbraw/zinc/21/04/62/1083210462.db2.gz BQHPZYFNTKMBOF-UHFFFAOYSA-N 1 1 367.405 4.304 20 5 FIBDMO C[C@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582146 1083211394 /nfs/dbraw/zinc/21/13/94/1083211394.db2.gz AJKATRUEAUKZAE-GFCCVEGCSA-N 1 1 359.813 4.452 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCS[C@@H]4CCCC[C@H]43)o2)c1 ZINC000610619588 1083265703 /nfs/dbraw/zinc/26/57/03/1083265703.db2.gz HHJYRIRJLXNVRP-SJLPKXTDSA-N 1 1 373.478 4.152 20 5 FIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccc(OC(F)F)c1 ZINC000179585704 1083569498 /nfs/dbraw/zinc/56/94/98/1083569498.db2.gz HKKNSRJXFCMJIO-SNVBAGLBSA-N 1 1 363.320 4.188 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@H](Cn3cnc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000614235843 1083579269 /nfs/dbraw/zinc/57/92/69/1083579269.db2.gz KJYQAZKABGOJAI-KRWDZBQOSA-N 1 1 364.449 4.165 20 5 FIBDMO Cn1cc(C[N@@H+](C)[C@H]2CCc3ccccc32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179905921 1083868759 /nfs/dbraw/zinc/86/87/59/1083868759.db2.gz FRDDNKKHNMYOGK-FQEVSTJZSA-N 1 1 362.433 4.115 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccc(Br)cc3)CC2)cs1 ZINC000236681033 1083912773 /nfs/dbraw/zinc/91/27/73/1083912773.db2.gz ZDLHPKQLGXCJAA-UHFFFAOYSA-N 1 1 353.241 4.198 20 5 FIBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)c1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000579983901 1084302743 /nfs/dbraw/zinc/30/27/43/1084302743.db2.gz BJVRKQWJLAGFIR-KRWDZBQOSA-N 1 1 370.478 4.047 20 5 FIBDMO Cc1oc(-c2ccccc2)nc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511059592 1084517263 /nfs/dbraw/zinc/51/72/63/1084517263.db2.gz NIMZXZQILZXMCK-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511059592 1084517271 /nfs/dbraw/zinc/51/72/71/1084517271.db2.gz NIMZXZQILZXMCK-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO Cc1ccc(-c2cc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])on2)cc1 ZINC000511072868 1084599499 /nfs/dbraw/zinc/59/94/99/1084599499.db2.gz MVYORPLYQQOHRZ-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511073422 1084626519 /nfs/dbraw/zinc/62/65/19/1084626519.db2.gz POYOBPZTDHKFOR-ZDUSSCGKSA-N 1 1 350.365 4.432 20 5 FIBDMO C[NH+](C)C[C@@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000563249733 1084633447 /nfs/dbraw/zinc/63/34/47/1084633447.db2.gz KIPHOGYGOSUOCL-LZCIBIBXSA-N 1 1 359.857 4.154 20 5 FIBDMO COc1cc(C[NH2+]Cc2ccc(C)cc2OC(C)(C)C)c([N+](=O)[O-])cc1O ZINC000084958720 1084657676 /nfs/dbraw/zinc/65/76/76/1084657676.db2.gz BEYUPZOOLQLVMW-UHFFFAOYSA-N 1 1 374.437 4.085 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000414156194 1084707802 /nfs/dbraw/zinc/70/78/02/1084707802.db2.gz OXZGYKCPDBHWSV-RYUDHWBXSA-N 1 1 361.467 4.351 20 5 FIBDMO Cc1cccc(C)c1NC(=O)CCC[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511083365 1084712224 /nfs/dbraw/zinc/71/22/24/1084712224.db2.gz YMECFGISLDCWRA-UHFFFAOYSA-N 1 1 369.465 4.105 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccccc1Oc1cccnc1 ZINC000511108756 1084936988 /nfs/dbraw/zinc/93/69/88/1084936988.db2.gz RMLOCZRNYFNWLU-UHFFFAOYSA-N 1 1 363.417 4.457 20 5 FIBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])c2C1 ZINC000158371849 1085056261 /nfs/dbraw/zinc/05/62/61/1085056261.db2.gz VXKVHCWTMVPXME-UHFFFAOYSA-N 1 1 373.840 4.472 20 5 FIBDMO CC(C)([NH2+]Cc1cc(O)ccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000127768092 1085081363 /nfs/dbraw/zinc/08/13/63/1085081363.db2.gz NMFWFLQKVQMTDW-UHFFFAOYSA-N 1 1 365.227 4.088 20 5 FIBDMO CCC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCCO1 ZINC000106866086 1085234528 /nfs/dbraw/zinc/23/45/28/1085234528.db2.gz RBBWMVBKAQVQSW-GOSISDBHSA-N 1 1 373.453 4.073 20 5 FIBDMO CCC[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000181778384 1085557998 /nfs/dbraw/zinc/55/79/98/1085557998.db2.gz QDYKMKJQUVCLFM-KRWDZBQOSA-N 1 1 352.394 4.276 20 5 FIBDMO Cc1c(C[NH2+][C@@H](CN2CCCCC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000611938132 1085694852 /nfs/dbraw/zinc/69/48/52/1085694852.db2.gz KJPREJIXPXLJAK-FQEVSTJZSA-N 1 1 353.466 4.220 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2cc(F)ccc2F)CC1 ZINC001167631633 1085848735 /nfs/dbraw/zinc/84/87/35/1085848735.db2.gz WLMLPZZWZZVUGA-CQSZACIVSA-N 1 1 361.392 4.065 20 5 FIBDMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@@H]1c1ccccc1 ZINC000582878288 1085869296 /nfs/dbraw/zinc/86/92/96/1085869296.db2.gz OTKHWMIMVJSMJG-JXFKEZNVSA-N 1 1 367.449 4.049 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000178728724 1085966379 /nfs/dbraw/zinc/96/63/79/1085966379.db2.gz DTVGWLQVMRQXGI-VIFPVBQESA-N 1 1 371.256 4.278 20 5 FIBDMO CC[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(OC)cc1 ZINC000181832016 1086055612 /nfs/dbraw/zinc/05/56/12/1086055612.db2.gz CIBZXTCPMFFUEL-IBGZPJMESA-N 1 1 367.405 4.499 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCc2ccc3cn[nH]c3c2)o1 ZINC000585743410 1086682340 /nfs/dbraw/zinc/68/23/40/1086682340.db2.gz GRLSKTWQHYTRTK-UHFFFAOYSA-N 1 1 362.389 4.063 20 5 FIBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)c1ccccc1 ZINC000585754474 1086687789 /nfs/dbraw/zinc/68/77/89/1086687789.db2.gz PHNDUGHHCRKMOY-UHFFFAOYSA-N 1 1 352.394 4.012 20 5 FIBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)c1ccccc1 ZINC000585754474 1086687796 /nfs/dbraw/zinc/68/77/96/1086687796.db2.gz PHNDUGHHCRKMOY-UHFFFAOYSA-N 1 1 352.394 4.012 20 5 FIBDMO CC1(C)C[C@H]([NH2+]CCc2ccc3cn[nH]c3c2)c2cc([N+](=O)[O-])ccc21 ZINC000585765407 1086691848 /nfs/dbraw/zinc/69/18/48/1086691848.db2.gz BEYDPYXMLKKQNL-IBGZPJMESA-N 1 1 350.422 4.026 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000246214187 1086908265 /nfs/dbraw/zinc/90/82/65/1086908265.db2.gz YKEIOUDSYVNRMJ-IAGOWNOFSA-N 1 1 374.485 4.022 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2sccc2Br)c(Cl)c1 ZINC000148179685 1086997047 /nfs/dbraw/zinc/99/70/47/1086997047.db2.gz MMVNFIRGVGFTCB-UHFFFAOYSA-N 1 1 361.648 4.362 20 5 FIBDMO Cc1cc(NCCc2cn3c([nH+]2)CCCC3)c([N+](=O)[O-])cc1C(F)(F)F ZINC000583947337 1087054109 /nfs/dbraw/zinc/05/41/09/1087054109.db2.gz JZBUMEGYLPJZCO-UHFFFAOYSA-N 1 1 368.359 4.109 20 5 FIBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000480410269 1087441168 /nfs/dbraw/zinc/44/11/68/1087441168.db2.gz ZPRAFICGMAHQLM-NVXWUHKLSA-N 1 1 362.433 4.390 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000188050420 1087693121 /nfs/dbraw/zinc/69/31/21/1087693121.db2.gz VTIKELMSDGVWLZ-WBMJQRKESA-N 1 1 360.385 4.307 20 5 FIBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000177553591 1088354877 /nfs/dbraw/zinc/35/48/77/1088354877.db2.gz WEYBDJZPNIWVDQ-KSSFIOAISA-N 1 1 364.405 4.023 20 5 FIBDMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cc2ccccc2c2cccnc12 ZINC000434422129 1088612233 /nfs/dbraw/zinc/61/22/33/1088612233.db2.gz PAHMLRILYVNODF-GOSISDBHSA-N 1 1 359.473 4.135 20 5 FIBDMO Cc1ccc2c(C[N@@H+](Cc3ccccc3[N+](=O)[O-])C3CC3)ccc(O)c2n1 ZINC000514076281 1088702855 /nfs/dbraw/zinc/70/28/55/1088702855.db2.gz VWRSSXUTBJWRKV-UHFFFAOYSA-N 1 1 363.417 4.322 20 5 FIBDMO Cc1ccc(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000414539797 1088817804 /nfs/dbraw/zinc/81/78/04/1088817804.db2.gz BJBCMFZBQLPJGL-HXUWFJFHSA-N 1 1 352.434 4.257 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000414566727 1088835473 /nfs/dbraw/zinc/83/54/73/1088835473.db2.gz XHVQIDRUEOOYBR-ISPXXFMDSA-N 1 1 364.445 4.462 20 5 FIBDMO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000434615076 1088857191 /nfs/dbraw/zinc/85/71/91/1088857191.db2.gz LVEACTDSWBJEJJ-HXUWFJFHSA-N 1 1 373.428 4.026 20 5 FIBDMO C[C@H](c1ccc(OC(F)F)cc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549168468 1089094057 /nfs/dbraw/zinc/09/40/57/1089094057.db2.gz LILFZKKOLGHKCC-CYBMUJFWSA-N 1 1 350.365 4.432 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000435056115 1089246160 /nfs/dbraw/zinc/24/61/60/1089246160.db2.gz LQFPXQCFBUCPMO-HUUCEWRRSA-N 1 1 351.406 4.422 20 5 FIBDMO COc1cc(C[NH+]2CCC(F)(c3ccccc3)CC2)c([N+](=O)[O-])cc1OC ZINC000435059479 1089247707 /nfs/dbraw/zinc/24/77/07/1089247707.db2.gz PPHASWAACXYTBA-UHFFFAOYSA-N 1 1 374.412 4.073 20 5 FIBDMO Cc1cc(CNc2ccc([N+](=O)[O-])c3cnccc23)cc(N2CCCC2)[nH+]1 ZINC000514654853 1089314590 /nfs/dbraw/zinc/31/45/90/1089314590.db2.gz CDHUGCDGVFUHCZ-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO CCC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000072553561 1089358388 /nfs/dbraw/zinc/35/83/88/1089358388.db2.gz UZVYFVZUMGMDFK-UHFFFAOYSA-N 1 1 352.394 4.057 20 5 FIBDMO CCC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000072553561 1089358408 /nfs/dbraw/zinc/35/84/08/1089358408.db2.gz UZVYFVZUMGMDFK-UHFFFAOYSA-N 1 1 352.394 4.057 20 5 FIBDMO CCCCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)C1(C)C ZINC001167958326 1089402028 /nfs/dbraw/zinc/40/20/28/1089402028.db2.gz HCOOGEMNSXWMDO-ROUUACIJSA-N 1 1 350.459 4.019 20 5 FIBDMO Cc1cc(C[C@@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)n[nH]1 ZINC000136793977 1089548763 /nfs/dbraw/zinc/54/87/63/1089548763.db2.gz AJRXOQKNWNBIPY-LLVKDONJSA-N 1 1 374.828 4.261 20 5 FIBDMO C[C@@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000514894149 1089569007 /nfs/dbraw/zinc/56/90/07/1089569007.db2.gz OVNRPDPMSIRTQU-OLZOCXBDSA-N 1 1 368.462 4.255 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000514898164 1089585597 /nfs/dbraw/zinc/58/55/97/1089585597.db2.gz ZEMMWFAUIYETNX-UHFFFAOYSA-N 1 1 363.820 4.100 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1ccccc1C(F)(F)F ZINC000514990246 1089695823 /nfs/dbraw/zinc/69/58/23/1089695823.db2.gz UGAHZRWWSCWARJ-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1ccccc1C(F)(F)F ZINC000514990246 1089695830 /nfs/dbraw/zinc/69/58/30/1089695830.db2.gz UGAHZRWWSCWARJ-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000515245679 1089921643 /nfs/dbraw/zinc/92/16/43/1089921643.db2.gz MTTDGHLJPATHQH-HNNXBMFYSA-N 1 1 353.422 4.222 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000515245681 1089921874 /nfs/dbraw/zinc/92/18/74/1089921874.db2.gz MTTDGHLJPATHQH-OAHLLOKOSA-N 1 1 353.422 4.222 20 5 FIBDMO C[C@@H](NC[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015174 1090024806 /nfs/dbraw/zinc/02/48/06/1090024806.db2.gz SWSULRIABIVZIX-IEBWSBKVSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015174 1090024814 /nfs/dbraw/zinc/02/48/14/1090024814.db2.gz SWSULRIABIVZIX-IEBWSBKVSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015174 1090024822 /nfs/dbraw/zinc/02/48/22/1090024822.db2.gz SWSULRIABIVZIX-IEBWSBKVSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000512197140 1091891975 /nfs/dbraw/zinc/89/19/75/1091891975.db2.gz SKDWRPUEZAHDHB-OFIWPEFUSA-N 1 1 357.498 4.194 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]([C@H](C)c2ccccc2)C2CC2)cccc1[N+](=O)[O-] ZINC000512257197 1091972536 /nfs/dbraw/zinc/97/25/36/1091972536.db2.gz BKKFMMHQUHUHCO-MRXNPFEDSA-N 1 1 367.449 4.457 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512262129 1091976038 /nfs/dbraw/zinc/97/60/38/1091976038.db2.gz RUOQLTCUSUTJFN-OAHLLOKOSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512262129 1091976040 /nfs/dbraw/zinc/97/60/40/1091976040.db2.gz RUOQLTCUSUTJFN-OAHLLOKOSA-N 1 1 353.422 4.067 20 5 FIBDMO C[C@H]1C[C@]1([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(Cl)cc1 ZINC000500463128 1092103865 /nfs/dbraw/zinc/10/38/65/1092103865.db2.gz NWTCPZXFBUMPBK-HXPMCKFVSA-N 1 1 374.824 4.140 20 5 FIBDMO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000520879822 1092325679 /nfs/dbraw/zinc/32/56/79/1092325679.db2.gz TYUUECRFABXOQN-ZUOKHONESA-N 1 1 350.374 4.467 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000051429033 1092416684 /nfs/dbraw/zinc/41/66/84/1092416684.db2.gz FCWIPWMFCKEYOW-INIZCTEOSA-N 1 1 369.446 4.420 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1nc2ccccc2s1 ZINC000051429033 1092416687 /nfs/dbraw/zinc/41/66/87/1092416687.db2.gz FCWIPWMFCKEYOW-INIZCTEOSA-N 1 1 369.446 4.420 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000549808365 1092813097 /nfs/dbraw/zinc/81/30/97/1092813097.db2.gz NILQZTGPFDJMFE-UHFFFAOYSA-N 1 1 370.840 4.313 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)c2C1 ZINC000573494017 1092929525 /nfs/dbraw/zinc/92/95/25/1092929525.db2.gz FSEMVGLXIJWMMW-UHFFFAOYSA-N 1 1 364.405 4.054 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)c2C1 ZINC000573494017 1092929526 /nfs/dbraw/zinc/92/95/26/1092929526.db2.gz FSEMVGLXIJWMMW-UHFFFAOYSA-N 1 1 364.405 4.054 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(Cc2ccc(F)cc2)CC1 ZINC000433278242 1093520003 /nfs/dbraw/zinc/52/00/03/1093520003.db2.gz GFAMHZLABDDFFA-MRXNPFEDSA-N 1 1 357.429 4.003 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000433278242 1093520012 /nfs/dbraw/zinc/52/00/12/1093520012.db2.gz GFAMHZLABDDFFA-MRXNPFEDSA-N 1 1 357.429 4.003 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000433278242 1093520019 /nfs/dbraw/zinc/52/00/19/1093520019.db2.gz GFAMHZLABDDFFA-MRXNPFEDSA-N 1 1 357.429 4.003 20 5 FIBDMO Cc1ccnc(NCc2ccccc2C[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000522417892 1093552596 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BDQIUUXRZFAOJF-CYBMUJFWSA-N 1 1 368.462 4.063 20 5 FIBDMO CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000501034569 1094459144 /nfs/dbraw/zinc/45/91/44/1094459144.db2.gz CDGDOYDVCOIYLK-QGZVFWFLSA-N 1 1 367.449 4.049 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C2CCCC2)C1 ZINC000420959456 1095202148 /nfs/dbraw/zinc/20/21/48/1095202148.db2.gz DZJFBIIEDPQCMH-XJKSGUPXSA-N 1 1 356.426 4.218 20 5 FIBDMO Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)cn2cc[nH+]c12 ZINC000502761329 1095780646 /nfs/dbraw/zinc/78/06/46/1095780646.db2.gz RZXJUEWNNQFJHC-UHFFFAOYSA-N 1 1 370.434 4.304 20 5 FIBDMO C[C@H]1C[C@]1([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Cl)cc1 ZINC000503369199 1096370295 /nfs/dbraw/zinc/37/02/95/1096370295.db2.gz OOUXRDPYISUACN-BBATYDOGSA-N 1 1 356.813 4.149 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532977190 1098647636 /nfs/dbraw/zinc/64/76/36/1098647636.db2.gz TZIIQEASTHKTPE-HIFRSBDPSA-N 1 1 373.840 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Cc1cc(C)c(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)c1 ZINC000064350521 1099345137 /nfs/dbraw/zinc/34/51/37/1099345137.db2.gz QLOCCWHKUDPERD-UHFFFAOYSA-N 1 1 369.465 4.369 20 5 FIBDMO Cc1cc(C)c(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)c1 ZINC000064350521 1099345151 /nfs/dbraw/zinc/34/51/51/1099345151.db2.gz QLOCCWHKUDPERD-UHFFFAOYSA-N 1 1 369.465 4.369 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC2(CCCC2)C1 ZINC000615000785 1099500119 /nfs/dbraw/zinc/50/01/19/1099500119.db2.gz UHLVZIKJVMXTGL-CQSZACIVSA-N 1 1 356.426 4.362 20 5 FIBDMO C[C@@H](N[C@H]1CC[N@H+](Cc2ccccc2)C2(CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516926247 1099936734 /nfs/dbraw/zinc/93/67/34/1099936734.db2.gz HJNOEFSJHGLYNP-XLIONFOSSA-N 1 1 365.477 4.443 20 5 FIBDMO C[C@@H](N[C@H]1CC[N@@H+](Cc2ccccc2)C2(CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000516926247 1099936737 /nfs/dbraw/zinc/93/67/37/1099936737.db2.gz HJNOEFSJHGLYNP-XLIONFOSSA-N 1 1 365.477 4.443 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccccc1OC)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000508770635 1100046912 /nfs/dbraw/zinc/04/69/12/1100046912.db2.gz AANODHZKTMWTTF-HNNXBMFYSA-N 1 1 371.437 4.015 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1ccccc1OC)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000508770635 1100046920 /nfs/dbraw/zinc/04/69/20/1100046920.db2.gz AANODHZKTMWTTF-HNNXBMFYSA-N 1 1 371.437 4.015 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC(C(F)F)CC3)cs2)c1 ZINC000536681105 1100146731 /nfs/dbraw/zinc/14/67/31/1100146731.db2.gz MQSGFNXTOUBJFX-UHFFFAOYSA-N 1 1 353.394 4.195 20 5 FIBDMO C[C@@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC12CCC2 ZINC000536692954 1100190946 /nfs/dbraw/zinc/19/09/46/1100190946.db2.gz ISLKVEHKAISVKT-OAHLLOKOSA-N 1 1 355.438 4.304 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](C)C2(CCC2)C1 ZINC000536703804 1100210881 /nfs/dbraw/zinc/21/08/81/1100210881.db2.gz ZNINXKKZJTYCPH-STQMWFEESA-N 1 1 365.861 4.087 20 5 FIBDMO 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O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc(Br)cc3)CC2)c(F)c1 ZINC000537077280 1101443826 /nfs/dbraw/zinc/44/38/26/1101443826.db2.gz LSJXHWCWPVPVIK-UHFFFAOYSA-N 1 1 365.202 4.275 20 5 FIBDMO CC(C)C[N@@H+](CCc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000519056311 1101878499 /nfs/dbraw/zinc/87/84/99/1101878499.db2.gz SCAXKCYHSJHMHF-UHFFFAOYSA-N 1 1 370.449 4.162 20 5 FIBDMO CC(C)[N@@H+](CCO)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000506761499 1102034296 /nfs/dbraw/zinc/03/42/96/1102034296.db2.gz YLWLMUUGCCMVPL-UHFFFAOYSA-N 1 1 364.829 4.243 20 5 FIBDMO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000171133882 1102409951 /nfs/dbraw/zinc/40/99/51/1102409951.db2.gz RNEFJHPLXMVLQA-GOSISDBHSA-N 1 1 372.421 4.101 20 5 FIBDMO Cc1ccccc1C[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000532486469 1102426984 /nfs/dbraw/zinc/42/69/84/1102426984.db2.gz YCZLBLXSFVWTKK-UHFFFAOYSA-N 1 1 367.449 4.205 20 5 FIBDMO CCC[N@@H+](C)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000532513484 1102447950 /nfs/dbraw/zinc/44/79/50/1102447950.db2.gz KNWPOMXPWARCMS-QGZVFWFLSA-N 1 1 361.829 4.270 20 5 FIBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(Br)c(F)c1 ZINC000507136019 1103152649 /nfs/dbraw/zinc/15/26/49/1103152649.db2.gz WUHXMIJQJZVYCO-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(Br)c(F)c1 ZINC000507136019 1103152653 /nfs/dbraw/zinc/15/26/53/1103152653.db2.gz WUHXMIJQJZVYCO-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1-c1ccnn1C ZINC000507251244 1103242036 /nfs/dbraw/zinc/24/20/36/1103242036.db2.gz GKABUHNNHFOVPJ-UHFFFAOYSA-N 1 1 364.449 4.406 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2ccccc2C)c([N+](=O)[O-])c1 ZINC000441231188 1104218008 /nfs/dbraw/zinc/21/80/08/1104218008.db2.gz KHLQAPYEFOXXRM-SFHVURJKSA-N 1 1 356.422 4.128 20 5 FIBDMO COc1ccc(OCC[N@H+]2C[C@H](C)C[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000441338164 1104281750 /nfs/dbraw/zinc/28/17/50/1104281750.db2.gz SHXVDYDTCUTSQQ-KDOFPFPSSA-N 1 1 374.412 4.204 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2ccc(C)s2)c([N+](=O)[O-])c1 ZINC000441394357 1104328513 /nfs/dbraw/zinc/32/85/13/1104328513.db2.gz ONBHCXCBWKVFRT-OAHLLOKOSA-N 1 1 362.451 4.189 20 5 FIBDMO Cc1ccc(C)c([C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)[C@@H](C)CO2)c1 ZINC000441448597 1104740515 /nfs/dbraw/zinc/74/05/15/1104740515.db2.gz LEQZFFCOXSUFMX-LAUBAEHRSA-N 1 1 354.450 4.216 20 5 FIBDMO COc1cccc([C@@H](C)[NH+]2CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000441480052 1104861418 /nfs/dbraw/zinc/86/14/18/1104861418.db2.gz JFLFNZMDNKMCGH-IAGOWNOFSA-N 1 1 369.465 4.043 20 5 FIBDMO C[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000248753954 1107376683 /nfs/dbraw/zinc/37/66/83/1107376683.db2.gz CJPTVENTAJLCDW-LRGNLBRXSA-N 1 1 365.477 4.441 20 5 FIBDMO NC(=O)c1ccc(C[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000444808153 1108182947 /nfs/dbraw/zinc/18/29/47/1108182947.db2.gz ZJRGJEKQMVGMQK-QGZVFWFLSA-N 1 1 373.840 4.074 20 5 FIBDMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000444808153 1108182951 /nfs/dbraw/zinc/18/29/51/1108182951.db2.gz ZJRGJEKQMVGMQK-QGZVFWFLSA-N 1 1 373.840 4.074 20 5 FIBDMO COc1cc(C[N@@H+](CC2CCC2)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000444784600 1108185939 /nfs/dbraw/zinc/18/59/39/1108185939.db2.gz OSKIWTMXEDRVPW-UHFFFAOYSA-N 1 1 358.385 4.215 20 5 FIBDMO C[C@@H](c1cccc(Nc2c(F)cc([N+](=O)[O-])cc2F)c1)[NH+]1CCOCC1 ZINC000440587347 1108287189 /nfs/dbraw/zinc/28/71/89/1108287189.db2.gz FINIIGRSMCLXOF-LBPRGKRZSA-N 1 1 363.364 4.010 20 5 FIBDMO CC(C)(O)C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC1 ZINC000428401526 1108690756 /nfs/dbraw/zinc/69/07/56/1108690756.db2.gz PKLGSCHYHFXDGU-UHFFFAOYSA-N 1 1 364.829 4.244 20 5 FIBDMO CC[C@@H](Cc1ccccc1)[N@@H+](CC)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532351471 1108774430 /nfs/dbraw/zinc/77/44/30/1108774430.db2.gz IHTQFVNAESQLRJ-IBGZPJMESA-N 1 1 370.449 4.305 20 5 FIBDMO CC[N@@H+](Cc1ccc(-c2nc(-c3ccc([N+](=O)[O-])s3)no2)cc1)C1CC1 ZINC000445485621 1108805228 /nfs/dbraw/zinc/80/52/28/1108805228.db2.gz BDTKYGFYRYYCFC-UHFFFAOYSA-N 1 1 370.434 4.358 20 5 FIBDMO Cc1ccc(C(C)(C)C[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000524754888 1109144086 /nfs/dbraw/zinc/14/40/86/1109144086.db2.gz PMBHQEGEJJUIDC-UHFFFAOYSA-N 1 1 370.449 4.179 20 5 FIBDMO CC(C)C[C@H]1CCCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000525407908 1109375460 /nfs/dbraw/zinc/37/54/60/1109375460.db2.gz KAYILKRKBYMASY-QGZVFWFLSA-N 1 1 358.442 4.436 20 5 FIBDMO Cc1c(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000447597150 1109591495 /nfs/dbraw/zinc/59/14/95/1109591495.db2.gz FKOQPUFRTJTJQO-MZADTFQBSA-N 1 1 365.477 4.188 20 5 FIBDMO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nc(C2CCCCC2)no1 ZINC000449277191 1110014200 /nfs/dbraw/zinc/01/42/00/1110014200.db2.gz FFRMGEAUYOLWAE-KBPBESRZSA-N 1 1 358.442 4.307 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnc([C@H]4CCCO4)s3)C2)cc1 ZINC000449495734 1110092919 /nfs/dbraw/zinc/09/29/19/1110092919.db2.gz DWPQQYQWCAGIOY-CRAIPNDOSA-N 1 1 373.478 4.282 20 5 FIBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)c2nccn21 ZINC000449569272 1110113451 /nfs/dbraw/zinc/11/34/51/1110113451.db2.gz GNNXHZRTGHUVSK-IUODEOHRSA-N 1 1 354.435 4.315 20 5 FIBDMO Cc1ccc(C[NH2+][C@@](C)(CO)c2cc(Cl)cc(Cl)c2)cc1[N+](=O)[O-] ZINC000449672434 1110142220 /nfs/dbraw/zinc/14/22/20/1110142220.db2.gz WEXWGGNZCGQCEB-KRWDZBQOSA-N 1 1 369.248 4.207 20 5 FIBDMO Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000449731590 1110155486 /nfs/dbraw/zinc/15/54/86/1110155486.db2.gz JJZIAGCRBDIZNM-IBGZPJMESA-N 1 1 372.396 4.246 20 5 FIBDMO Cc1cc(F)ccc1[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000449731590 1110155488 /nfs/dbraw/zinc/15/54/88/1110155488.db2.gz JJZIAGCRBDIZNM-IBGZPJMESA-N 1 1 372.396 4.246 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](C4CCOCC4)C3)o2)cc1 ZINC000538752959 1111283156 /nfs/dbraw/zinc/28/31/56/1111283156.db2.gz YUSCTGQFMQHHKC-KRWDZBQOSA-N 1 1 356.422 4.103 20 5 FIBDMO Cc1cc(N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461965188 1111443469 /nfs/dbraw/zinc/44/34/69/1111443469.db2.gz LYBNAJYEOGQDIA-CQSZACIVSA-N 1 1 371.403 4.090 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)C(=O)N1CCC[C@H]1c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000539327726 1111522882 /nfs/dbraw/zinc/52/28/82/1111522882.db2.gz BJCVCSIUKNLBIT-KEYYUXOJSA-N 1 1 373.478 4.059 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)N1CCC[C@H]1c1cccs1 ZINC000539327727 1111523265 /nfs/dbraw/zinc/52/32/65/1111523265.db2.gz BJCVCSIUKNLBIT-ZQIUZPCESA-N 1 1 373.478 4.059 20 5 FIBDMO C[C@@H](c1cccs1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000478426343 1111778981 /nfs/dbraw/zinc/77/89/81/1111778981.db2.gz JQLOXPMYAXWKAA-HNNXBMFYSA-N 1 1 356.451 4.116 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC000479593125 1112087120 /nfs/dbraw/zinc/08/71/20/1112087120.db2.gz KKWUCGABLKGBJZ-UHFFFAOYSA-N 1 1 350.422 4.050 20 5 FIBDMO Cc1ccc([C@@H](C)NCCC[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000480227672 1112339667 /nfs/dbraw/zinc/33/96/67/1112339667.db2.gz IXGRWFDKYXKKTE-QGZVFWFLSA-N 1 1 353.466 4.002 20 5 FIBDMO COc1ccccc1O[C@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000554873668 1112539716 /nfs/dbraw/zinc/53/97/16/1112539716.db2.gz PDEDTLRHGODNGH-KKMIYCERSA-N 1 1 368.433 4.160 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nc3cccc(Cl)c3n2C)cc1[N+](=O)[O-] ZINC000480695222 1112558703 /nfs/dbraw/zinc/55/87/03/1112558703.db2.gz QUVYRUUMMLVUAG-GFCCVEGCSA-N 1 1 358.829 4.294 20 5 FIBDMO CC[C@H](NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482435455 1113253682 /nfs/dbraw/zinc/25/36/82/1113253682.db2.gz HQUPOFQNFDMJRS-UGKGYDQZSA-N 1 1 367.493 4.200 20 5 FIBDMO CC[C@H](NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482435455 1113253685 /nfs/dbraw/zinc/25/36/85/1113253685.db2.gz HQUPOFQNFDMJRS-UGKGYDQZSA-N 1 1 367.493 4.200 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482697811 1113334828 /nfs/dbraw/zinc/33/48/28/1113334828.db2.gz WJYGMSIRVVESSF-CABCVRRESA-N 1 1 350.422 4.158 20 5 FIBDMO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000486801498 1113652887 /nfs/dbraw/zinc/65/28/87/1113652887.db2.gz UMPLOFNGPYDKLE-RWCYGVJQSA-N 1 1 357.357 4.434 20 5 FIBDMO C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000486801496 1113652943 /nfs/dbraw/zinc/65/29/43/1113652943.db2.gz UMPLOFNGPYDKLE-DFVUYQKZSA-N 1 1 357.357 4.434 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000488044516 1113846263 /nfs/dbraw/zinc/84/62/63/1113846263.db2.gz PWQVIAGKIKJFPO-JKSUJKDBSA-N 1 1 353.422 4.007 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCc2ccc(F)cc21 ZINC000911595582 1114001397 /nfs/dbraw/zinc/00/13/97/1114001397.db2.gz INDKFXCHXAXHQY-GFCCVEGCSA-N 1 1 355.369 4.037 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000490029415 1114204653 /nfs/dbraw/zinc/20/46/53/1114204653.db2.gz JWNJZOWXUYFNEI-UYAOXDASSA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000490029415 1114204669 /nfs/dbraw/zinc/20/46/69/1114204669.db2.gz JWNJZOWXUYFNEI-UYAOXDASSA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000490029415 1114204671 /nfs/dbraw/zinc/20/46/71/1114204671.db2.gz JWNJZOWXUYFNEI-UYAOXDASSA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1cc(Br)cn1C ZINC000490085210 1114216465 /nfs/dbraw/zinc/21/64/65/1114216465.db2.gz DNTIFUFGAJMIOQ-LBPRGKRZSA-N 1 1 366.259 4.197 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1cc(Br)cn1C ZINC000490085210 1114216467 /nfs/dbraw/zinc/21/64/67/1114216467.db2.gz DNTIFUFGAJMIOQ-LBPRGKRZSA-N 1 1 366.259 4.197 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c(F)c1 ZINC000490400976 1114287853 /nfs/dbraw/zinc/28/78/53/1114287853.db2.gz NMMRPCKGGXBPRF-CYBMUJFWSA-N 1 1 373.359 4.394 20 5 FIBDMO CC(=O)c1cc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000587528790 1114446933 /nfs/dbraw/zinc/44/69/33/1114446933.db2.gz TWGMJWOZJXSHAS-SFHVURJKSA-N 1 1 367.449 4.122 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c1 ZINC000590170153 1114907310 /nfs/dbraw/zinc/90/73/10/1114907310.db2.gz AZPZYVKIFGTACT-KGLIPLIRSA-N 1 1 372.387 4.252 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC000591282880 1115054846 /nfs/dbraw/zinc/05/48/46/1115054846.db2.gz XBUBHJDBIMGNDA-AWEZNQCLSA-N 1 1 357.479 4.088 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](C/C=C/c1ccccc1)[C@H]1CC[C@H](O)CC1 ZINC000592131239 1115205328 /nfs/dbraw/zinc/20/53/28/1115205328.db2.gz UQZNFNLLMHDAEZ-ZJQVQRCTSA-N 1 1 366.461 4.414 20 5 FIBDMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000157894096 1115379543 /nfs/dbraw/zinc/37/95/43/1115379543.db2.gz XRPKJNNWFNSMML-AWEZNQCLSA-N 1 1 374.485 4.493 20 5 FIBDMO Cc1nn(-c2ccccc2F)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000594521544 1115459425 /nfs/dbraw/zinc/45/94/25/1115459425.db2.gz SPGBUQGPNCTCQO-UHFFFAOYSA-N 1 1 368.412 4.253 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2OC(F)F)cc1[N+](=O)[O-] ZINC000594934562 1115500498 /nfs/dbraw/zinc/50/04/98/1115500498.db2.gz CIZVMWSJWOJOFF-NSHDSACASA-N 1 1 354.328 4.495 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cc(F)ccc1SC ZINC000595011823 1115503382 /nfs/dbraw/zinc/50/33/82/1115503382.db2.gz ITDGPIRHKYBKIX-NSHDSACASA-N 1 1 350.415 4.315 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000595016964 1115504203 /nfs/dbraw/zinc/50/42/03/1115504203.db2.gz SQNWXVNGTBOIID-GMVOTWDCSA-N 1 1 374.412 4.313 20 5 FIBDMO O=[N+]([O-])c1cc(CNC[C@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)cs1 ZINC000595001186 1115507006 /nfs/dbraw/zinc/50/70/06/1115507006.db2.gz RNXNSNLBOAMBQD-SFHVURJKSA-N 1 1 371.506 4.048 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCCOc2cc(F)ccc21 ZINC000595026727 1115509747 /nfs/dbraw/zinc/50/97/47/1115509747.db2.gz IGIVSDSXPABTLV-PXAZEXFGSA-N 1 1 360.385 4.307 20 5 FIBDMO COC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1cccc(Cl)c1 ZINC000595046555 1115511465 /nfs/dbraw/zinc/51/14/65/1115511465.db2.gz AMCQALMTENTDBJ-PXAZEXFGSA-N 1 1 364.829 4.295 20 5 FIBDMO COC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1cccc(Cl)c1 ZINC000595046557 1115511684 /nfs/dbraw/zinc/51/16/84/1115511684.db2.gz AMCQALMTENTDBJ-SJCJKPOMSA-N 1 1 364.829 4.295 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cc(F)ccc1OC(F)F ZINC000595092926 1115517721 /nfs/dbraw/zinc/51/77/21/1115517721.db2.gz BCTYPLTWUYJNEH-SNVBAGLBSA-N 1 1 370.327 4.195 20 5 FIBDMO CCOc1cc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)ccc1OC(F)F ZINC000046776949 1115528265 /nfs/dbraw/zinc/52/82/65/1115528265.db2.gz JPOWZZUGSUNKIU-UHFFFAOYSA-N 1 1 366.364 4.227 20 5 FIBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000595431743 1115535992 /nfs/dbraw/zinc/53/59/92/1115535992.db2.gz GYZRKJKGQZNMHA-HKUYNNGSSA-N 1 1 362.376 4.225 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000593021362 1115539408 /nfs/dbraw/zinc/53/94/08/1115539408.db2.gz WGCJOLQTUNOEJM-AWEZNQCLSA-N 1 1 372.421 4.019 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(c2ccc3cccnc3n2)CC1 ZINC000595561907 1115542519 /nfs/dbraw/zinc/54/25/19/1115542519.db2.gz QEVQPOLAYYIICA-UHFFFAOYSA-N 1 1 366.396 4.057 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)CC1=CCCOC1 ZINC000597205003 1115649740 /nfs/dbraw/zinc/64/97/40/1115649740.db2.gz BWEDRJVLPQOCHR-UHFFFAOYSA-N 1 1 362.813 4.287 20 5 FIBDMO CC(C)([NH2+]Cc1ccsc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000598966660 1115771523 /nfs/dbraw/zinc/77/15/23/1115771523.db2.gz ZJYFMCXCFKWPPQ-UHFFFAOYSA-N 1 1 355.257 4.444 20 5 FIBDMO COc1ccc(C[NH2+]C(C)(C)c2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000598986032 1115773530 /nfs/dbraw/zinc/77/35/30/1115773530.db2.gz DUWUOZYJYLJWIU-UHFFFAOYSA-N 1 1 357.435 4.238 20 5 FIBDMO CC[N@@H+](CCC1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1)CC(C)C ZINC001168414860 1115797597 /nfs/dbraw/zinc/79/75/97/1115797597.db2.gz UTVHRUZRFVBJCJ-UHFFFAOYSA-N 1 1 365.493 4.314 20 5 FIBDMO O=[N+]([O-])c1c(NCCC[N@H+]2CCc3ccccc3C2)ccc2ncccc21 ZINC000603848811 1115821166 /nfs/dbraw/zinc/82/11/66/1115821166.db2.gz PLFSLAGHXUADBM-UHFFFAOYSA-N 1 1 362.433 4.003 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000599573920 1115827249 /nfs/dbraw/zinc/82/72/49/1115827249.db2.gz KVHFLVUFHUUVOJ-FQEVSTJZSA-N 1 1 355.438 4.408 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576810 1115828112 /nfs/dbraw/zinc/82/81/12/1115828112.db2.gz USDZGCCHMGCOOF-VFNWGFHPSA-N 1 1 366.417 4.156 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576810 1115828115 /nfs/dbraw/zinc/82/81/15/1115828115.db2.gz USDZGCCHMGCOOF-VFNWGFHPSA-N 1 1 366.417 4.156 20 5 FIBDMO CCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](CC)c1ccccc1 ZINC000604492851 1115867713 /nfs/dbraw/zinc/86/77/13/1115867713.db2.gz INPJBEVBFZVJKJ-GOSISDBHSA-N 1 1 355.438 4.057 20 5 FIBDMO Cc1ccnc([C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)c1 ZINC000594007729 1115958703 /nfs/dbraw/zinc/95/87/03/1115958703.db2.gz FGFJVZVTJKHOOH-INIZCTEOSA-N 1 1 355.438 4.075 20 5 FIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1C ZINC000063619359 1116088316 /nfs/dbraw/zinc/08/83/16/1116088316.db2.gz GENIZMMLUZOGBC-SFHVURJKSA-N 1 1 367.449 4.296 20 5 FIBDMO Cc1ccc([C@@H]2CCC[N@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1C ZINC000063619359 1116088317 /nfs/dbraw/zinc/08/83/17/1116088317.db2.gz GENIZMMLUZOGBC-SFHVURJKSA-N 1 1 367.449 4.296 20 5 FIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000063619605 1116088338 /nfs/dbraw/zinc/08/83/38/1116088338.db2.gz NSUOOCONGFVWTP-FQEVSTJZSA-N 1 1 367.449 4.012 20 5 FIBDMO CC(C)(C)[N@H+]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000063722406 1116100445 /nfs/dbraw/zinc/10/04/45/1116100445.db2.gz AFFYSXKFTBIFFK-UHFFFAOYSA-N 1 1 361.489 4.334 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CNCCC[NH+]3CCCCC3)s2)cc1 ZINC000608835876 1116131227 /nfs/dbraw/zinc/13/12/27/1116131227.db2.gz SUZPEQPNIDEHQB-UHFFFAOYSA-N 1 1 359.495 4.289 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CCOCC1 ZINC000534345499 1116186953 /nfs/dbraw/zinc/18/69/53/1116186953.db2.gz VJDHYPOGDUWUTR-UHFFFAOYSA-N 1 1 350.802 4.119 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000029825537 1116308926 /nfs/dbraw/zinc/30/89/26/1116308926.db2.gz GMZCHTMWTQYOSX-AWEZNQCLSA-N 1 1 367.405 4.124 20 5 FIBDMO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc[nH+]c(N(C)C)c1 ZINC000539643542 1116358052 /nfs/dbraw/zinc/35/80/52/1116358052.db2.gz JIUSICMBDAJQEX-UHFFFAOYSA-N 1 1 374.466 4.200 20 5 FIBDMO CC(C)c1ccc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000539899595 1117740943 /nfs/dbraw/zinc/74/09/43/1117740943.db2.gz GXFLGOZHHPMGPQ-PXNSSMCTSA-N 1 1 357.498 4.167 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cc(F)ccc1OC(F)F ZINC000595094551 1117741302 /nfs/dbraw/zinc/74/13/02/1117741302.db2.gz XTZVPWKHPLQPCP-AWEZNQCLSA-N 1 1 352.312 4.112 20 5 FIBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000539928294 1117752742 /nfs/dbraw/zinc/75/27/42/1117752742.db2.gz WSIZUKLVOWMWAX-OJXHRBAXSA-N 1 1 360.454 4.052 20 5 FIBDMO COc1ccc(F)cc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000462912625 1117858078 /nfs/dbraw/zinc/85/80/78/1117858078.db2.gz RFHISCJXSZCJJW-UHFFFAOYSA-N 1 1 358.291 4.051 20 5 FIBDMO CCc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000540146502 1117897567 /nfs/dbraw/zinc/89/75/67/1117897567.db2.gz ZVENMMTYSXQJCB-NWDGAFQWSA-N 1 1 371.466 4.416 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cncc(C(F)(F)F)c2)C2CC2)cc1 ZINC000463156798 1117995663 /nfs/dbraw/zinc/99/56/63/1117995663.db2.gz VPICCUBCSWLIMT-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cncc(C(F)(F)F)c2)C2CC2)cc1 ZINC000463156798 1117995665 /nfs/dbraw/zinc/99/56/65/1117995665.db2.gz VPICCUBCSWLIMT-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000463189542 1118006380 /nfs/dbraw/zinc/00/63/80/1118006380.db2.gz ATIASSCSAWWBQR-WQOWLQHVSA-N 1 1 368.424 4.025 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@](CO)(Cc2ccccc2)C1 ZINC000463435582 1118155107 /nfs/dbraw/zinc/15/51/07/1118155107.db2.gz UBWMKVIMZJEZHQ-HXUWFJFHSA-N 1 1 374.868 4.065 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@](CO)(Cc2ccccc2)C1 ZINC000463435582 1118155109 /nfs/dbraw/zinc/15/51/09/1118155109.db2.gz UBWMKVIMZJEZHQ-HXUWFJFHSA-N 1 1 374.868 4.065 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@](CO)(Cc2ccccc2)C1 ZINC000463436122 1118155249 /nfs/dbraw/zinc/15/52/49/1118155249.db2.gz XDHYEFMACHNITN-HXUWFJFHSA-N 1 1 374.868 4.065 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@@](CO)(Cc2ccccc2)C1 ZINC000463436122 1118155251 /nfs/dbraw/zinc/15/52/51/1118155251.db2.gz XDHYEFMACHNITN-HXUWFJFHSA-N 1 1 374.868 4.065 20 5 FIBDMO Cc1noc(C[NH+]2CCC(c3ccc(C(F)(F)F)cc3)CC2)c1[N+](=O)[O-] ZINC000595421018 1118228105 /nfs/dbraw/zinc/22/81/05/1118228105.db2.gz KAXABYIZRVOLHL-UHFFFAOYSA-N 1 1 369.343 4.290 20 5 FIBDMO C[C@@H](Nc1cccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1)c1cccc([N+](=O)[O-])c1 ZINC000540789392 1118248413 /nfs/dbraw/zinc/24/84/13/1118248413.db2.gz PMIJMPCSZBSSJT-IXDOHACOSA-N 1 1 369.465 4.377 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]CCc2c(C)noc2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541546048 1118550480 /nfs/dbraw/zinc/55/04/80/1118550480.db2.gz NOIGUONHBAYCFT-FQEVSTJZSA-N 1 1 369.421 4.277 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCCOc2ccccc2)C2CCOCC2)c1 ZINC000464578286 1118609290 /nfs/dbraw/zinc/60/92/90/1118609290.db2.gz XVBBALPKTDKGFQ-UHFFFAOYSA-N 1 1 370.449 4.045 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCCOc1ccccc1)C1CCOCC1 ZINC000464593587 1118619738 /nfs/dbraw/zinc/61/97/38/1118619738.db2.gz DJQDZWVXZASAFO-UHFFFAOYSA-N 1 1 370.449 4.045 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1nc2ccccc2n1C ZINC000541772266 1118644791 /nfs/dbraw/zinc/64/47/91/1118644791.db2.gz YGCFZUYZRUTQSB-LJQANCHMSA-N 1 1 350.422 4.127 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1nc2ccccc2n1C ZINC000541772266 1118644792 /nfs/dbraw/zinc/64/47/92/1118644792.db2.gz YGCFZUYZRUTQSB-LJQANCHMSA-N 1 1 350.422 4.127 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000464862013 1118727810 /nfs/dbraw/zinc/72/78/10/1118727810.db2.gz WGMHJGHFCSXNCJ-RDTXWAMCSA-N 1 1 371.437 4.298 20 5 FIBDMO Cc1cccc(C(C)C)c1NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271800619 1118902871 /nfs/dbraw/zinc/90/28/71/1118902871.db2.gz WNOITTBNGMCMQN-HNNXBMFYSA-N 1 1 355.438 4.316 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2cccc(OC)c2)ccc1[N+](=O)[O-] ZINC000492462307 1119097735 /nfs/dbraw/zinc/09/77/35/1119097735.db2.gz MTGIDDKZRYZTNQ-GOSISDBHSA-N 1 1 356.422 4.339 20 5 FIBDMO CC(C)([NH2+]Cc1cnn(-c2ccc(Cl)cc2)c1)c1ccccc1[N+](=O)[O-] ZINC000492465296 1119098672 /nfs/dbraw/zinc/09/86/72/1119098672.db2.gz VQLOZMDJGYMJAD-UHFFFAOYSA-N 1 1 370.840 4.459 20 5 FIBDMO CCOc1cc(C[N@H+](C)[C@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000492516610 1119113843 /nfs/dbraw/zinc/11/38/43/1119113843.db2.gz VQNPEVXRWTYJSJ-GFCCVEGCSA-N 1 1 350.365 4.465 20 5 FIBDMO CCOc1cc(C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000492516610 1119113845 /nfs/dbraw/zinc/11/38/45/1119113845.db2.gz VQNPEVXRWTYJSJ-GFCCVEGCSA-N 1 1 350.365 4.465 20 5 FIBDMO CCOc1cc(C[N@H+](Cc2cccc(O)c2)CC2CC2)ccc1[N+](=O)[O-] ZINC000492777360 1119186640 /nfs/dbraw/zinc/18/66/40/1119186640.db2.gz XQJNZGMZPBOPMR-UHFFFAOYSA-N 1 1 356.422 4.111 20 5 FIBDMO CC(=O)c1ccc2c(c1)CC[N@@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000492804083 1119190755 /nfs/dbraw/zinc/19/07/55/1119190755.db2.gz CEKVTBCPEAJSSI-HNNXBMFYSA-N 1 1 352.434 4.268 20 5 FIBDMO CN(Cc1c(Cl)cccc1[N+](=O)[O-])C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000493210855 1119345351 /nfs/dbraw/zinc/34/53/51/1119345351.db2.gz NLKFEOPJROFGPW-QGZVFWFLSA-N 1 1 373.884 4.202 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761507057 1119402867 /nfs/dbraw/zinc/40/28/67/1119402867.db2.gz SPEVNLIDPAOMRD-LZWOXQAQSA-N 1 1 351.878 4.085 20 5 FIBDMO CCCC[N@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761507025 1119403175 /nfs/dbraw/zinc/40/31/75/1119403175.db2.gz RDFYDSVXFSTEQL-UHFFFAOYSA-N 1 1 353.894 4.192 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761507025 1119403177 /nfs/dbraw/zinc/40/31/77/1119403177.db2.gz RDFYDSVXFSTEQL-UHFFFAOYSA-N 1 1 353.894 4.192 20 5 FIBDMO CCC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000493240669 1119431410 /nfs/dbraw/zinc/43/14/10/1119431410.db2.gz WLXFCBWRYBZCJN-JLZZUVOBSA-N 1 1 352.862 4.274 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(n2c(=O)[nH]c3ccccc32)CC1 ZINC000487734907 1119524802 /nfs/dbraw/zinc/52/48/02/1119524802.db2.gz UOXQNZMVMCKQDX-AWEZNQCLSA-N 1 1 366.421 4.048 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000494294113 1119822128 /nfs/dbraw/zinc/82/21/28/1119822128.db2.gz WLOKGRNXNCVAMZ-QINSGFPZSA-N 1 1 364.405 4.180 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000494294113 1119822132 /nfs/dbraw/zinc/82/21/32/1119822132.db2.gz WLOKGRNXNCVAMZ-QINSGFPZSA-N 1 1 364.405 4.180 20 5 FIBDMO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)c(F)c1 ZINC000301057795 1120818841 /nfs/dbraw/zinc/81/88/41/1120818841.db2.gz CAFFRZOVOPRTSE-UHFFFAOYSA-N 1 1 365.355 4.089 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000193386691 1120845051 /nfs/dbraw/zinc/84/50/51/1120845051.db2.gz QKIJSASHRGAASE-HNNXBMFYSA-N 1 1 367.449 4.387 20 5 FIBDMO C[N@@H+](CCCNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000915307698 1120918524 /nfs/dbraw/zinc/91/85/24/1120918524.db2.gz PSPVFRLTHGUTOC-UHFFFAOYSA-N 1 1 368.865 4.024 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c(Cl)c1 ZINC000487998882 1121013545 /nfs/dbraw/zinc/01/35/45/1121013545.db2.gz YMBRBGMSNGPGIZ-MRXNPFEDSA-N 1 1 359.857 4.225 20 5 FIBDMO COc1ccc(C[C@H](C)C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000090620630 1121073593 /nfs/dbraw/zinc/07/35/93/1121073593.db2.gz LXJFQEFHLIAWEN-AWEZNQCLSA-N 1 1 369.421 4.055 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c(Cl)c1 ZINC000326406443 1121160693 /nfs/dbraw/zinc/16/06/93/1121160693.db2.gz IXTSMUQFNVYLAJ-JQHSSLGASA-N 1 1 352.862 4.154 20 5 FIBDMO CC(=O)c1c(NCc2ccc(-n3cc[nH+]c3C)c(F)c2)cccc1[N+](=O)[O-] ZINC000763204602 1121272914 /nfs/dbraw/zinc/27/29/14/1121272914.db2.gz VJIQLKWCZNAJQS-UHFFFAOYSA-N 1 1 368.368 4.043 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000301143488 1121470075 /nfs/dbraw/zinc/47/00/75/1121470075.db2.gz DLEKBYLYMMNUIB-VIFPVBQESA-N 1 1 374.750 4.374 20 5 FIBDMO COc1cc(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301450347 1121961919 /nfs/dbraw/zinc/96/19/19/1121961919.db2.gz XDUICTQNRPQRJF-ACJLOTCBSA-N 1 1 361.467 4.160 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)cc1[N+](=O)[O-] ZINC000765818934 1122148767 /nfs/dbraw/zinc/14/87/67/1122148767.db2.gz GVSPZXFJJQHWMZ-WMLDXEAASA-N 1 1 372.469 4.499 20 5 FIBDMO C[N@@H+](CCc1ccncc1)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000542692383 1122288457 /nfs/dbraw/zinc/28/84/57/1122288457.db2.gz KXKYWSAMRFDGBR-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO C[C@@H](CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000556872366 1123155373 /nfs/dbraw/zinc/15/53/73/1123155373.db2.gz XJRHPMUGTNQSKG-OXJNMPFZSA-N 1 1 364.449 4.201 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCc2sccc2C1 ZINC000609322828 1123548328 /nfs/dbraw/zinc/54/83/28/1123548328.db2.gz MUDQGKVVDLFCDS-GFCCVEGCSA-N 1 1 370.434 4.216 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCc2sccc2C1 ZINC000609322828 1123548332 /nfs/dbraw/zinc/54/83/32/1123548332.db2.gz MUDQGKVVDLFCDS-GFCCVEGCSA-N 1 1 370.434 4.216 20 5 FIBDMO CSc1cccc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000064350499 1123706098 /nfs/dbraw/zinc/70/60/98/1123706098.db2.gz AUCPHRJSKFWERW-UHFFFAOYSA-N 1 1 373.478 4.166 20 5 FIBDMO CSc1cccc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000064350499 1123706101 /nfs/dbraw/zinc/70/61/01/1123706101.db2.gz AUCPHRJSKFWERW-UHFFFAOYSA-N 1 1 373.478 4.166 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000609540698 1123748546 /nfs/dbraw/zinc/74/85/46/1123748546.db2.gz JYGXVWZUAUNROL-UHFFFAOYSA-N 1 1 358.413 4.163 20 5 FIBDMO CCc1ccc(C[NH+]2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000610003300 1123914910 /nfs/dbraw/zinc/91/49/10/1123914910.db2.gz JFFLUVRPIGEJLX-HNNXBMFYSA-N 1 1 359.495 4.098 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000615834327 1124127620 /nfs/dbraw/zinc/12/76/20/1124127620.db2.gz AOAOUWYRCXSSAW-RYEVTAHJSA-N 1 1 352.434 4.462 20 5 FIBDMO COC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1cccc(Cl)c1F ZINC000554095462 1124274256 /nfs/dbraw/zinc/27/42/56/1124274256.db2.gz PDLRBZAUUMVZDY-HNNXBMFYSA-N 1 1 352.793 4.173 20 5 FIBDMO COC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000091414008 1124384348 /nfs/dbraw/zinc/38/43/48/1124384348.db2.gz UEONOKWEUNLJMW-YVEFUNNKSA-N 1 1 350.365 4.220 20 5 FIBDMO COc1ccc(NC(=O)C[N@@H+](C(C)C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000428839529 1124526836 /nfs/dbraw/zinc/52/68/36/1124526836.db2.gz KHOXAMFSPHAIDC-HNNXBMFYSA-N 1 1 371.437 4.014 20 5 FIBDMO C[NH+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000554877827 1124582529 /nfs/dbraw/zinc/58/25/29/1124582529.db2.gz SJFCWYDSUWKDNE-XYPWUTKMSA-N 1 1 371.506 4.380 20 5 FIBDMO C[NH+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000554877827 1124582542 /nfs/dbraw/zinc/58/25/42/1124582542.db2.gz SJFCWYDSUWKDNE-XYPWUTKMSA-N 1 1 371.506 4.380 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c(Cl)c1 ZINC000542930465 1124888278 /nfs/dbraw/zinc/88/82/78/1124888278.db2.gz QFBJYRXGAGPJMG-UHFFFAOYSA-N 1 1 368.824 4.414 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)c(Cl)c1 ZINC000542930465 1124888286 /nfs/dbraw/zinc/88/82/86/1124888286.db2.gz QFBJYRXGAGPJMG-UHFFFAOYSA-N 1 1 368.824 4.414 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000542929388 1124889210 /nfs/dbraw/zinc/88/92/10/1124889210.db2.gz XXMRHQDFCSIWCI-USXIJHARSA-N 1 1 352.862 4.274 20 5 FIBDMO C[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(O)c1 ZINC000113336418 1125154643 /nfs/dbraw/zinc/15/46/43/1125154643.db2.gz OTNMICYVCXRMHC-LBPRGKRZSA-N 1 1 355.419 4.275 20 5 FIBDMO CC(C)[N@@H+](CCc1nc(-c2ccccc2)no1)Cc1ccc([N+](=O)[O-])cc1 ZINC000077269772 1125162986 /nfs/dbraw/zinc/16/29/86/1125162986.db2.gz FNNYGSAXUPFBAA-UHFFFAOYSA-N 1 1 366.421 4.098 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(C(F)(F)F)c1 ZINC000301750038 1125196463 /nfs/dbraw/zinc/19/64/63/1125196463.db2.gz ALAZXKDLNQEAJQ-BLLLJJGKSA-N 1 1 369.387 4.067 20 5 FIBDMO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1Cl ZINC000008121901 568197737 /nfs/dbraw/zinc/19/77/37/568197737.db2.gz QYQRBYUWMWCSGO-JTQLQIEISA-N 1 1 368.220 4.191 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000568933741 568253532 /nfs/dbraw/zinc/25/35/32/568253532.db2.gz RJUIENSMWASPLR-LVVHEOIOSA-N 1 1 364.445 4.113 20 5 FIBDMO C[C@@H]([NH3+])C1CCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000563129482 568261397 /nfs/dbraw/zinc/26/13/97/568261397.db2.gz CELOUXHGOLPPBZ-CQSZACIVSA-N 1 1 373.428 4.085 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000570607354 568490762 /nfs/dbraw/zinc/49/07/62/568490762.db2.gz RFCSOCWLWUUFKN-APWZRJJASA-N 1 1 351.450 4.101 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000570607357 568490784 /nfs/dbraw/zinc/49/07/84/568490784.db2.gz RFCSOCWLWUUFKN-VQIMIIECSA-N 1 1 351.450 4.101 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccccc1C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000078491661 1125541558 /nfs/dbraw/zinc/54/15/58/1125541558.db2.gz VQWWXYYLQVDPSJ-INIZCTEOSA-N 1 1 355.438 4.315 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000078491661 1125541563 /nfs/dbraw/zinc/54/15/63/1125541563.db2.gz VQWWXYYLQVDPSJ-INIZCTEOSA-N 1 1 355.438 4.315 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccc([N+](=O)[O-])cc1OC)CCC2 ZINC000430199658 1079904618 /nfs/dbraw/zinc/90/46/18/1079904618.db2.gz DBPCNBQRCWWRNP-HNNXBMFYSA-N 1 1 361.467 4.132 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC)CCC2 ZINC000430199658 1079904624 /nfs/dbraw/zinc/90/46/24/1079904624.db2.gz DBPCNBQRCWWRNP-HNNXBMFYSA-N 1 1 361.467 4.132 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)cc1 ZINC000134460929 1080233395 /nfs/dbraw/zinc/23/33/95/1080233395.db2.gz KHUBHSHWBRDGAA-LBPRGKRZSA-N 1 1 371.384 4.450 20 5 FIBDMO Cc1ccc(C(=O)C2CC[NH+](Cc3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000510157757 1080446498 /nfs/dbraw/zinc/44/64/98/1080446498.db2.gz ALTOZSURUKPBFF-UHFFFAOYSA-N 1 1 352.434 4.307 20 5 FIBDMO Cc1c([C@H](C)NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000165314349 1080473569 /nfs/dbraw/zinc/47/35/69/1080473569.db2.gz CHRYZXVKITVJDU-ICSRJNTNSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1c([C@H](C)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000165314349 1080473579 /nfs/dbraw/zinc/47/35/79/1080473579.db2.gz CHRYZXVKITVJDU-ICSRJNTNSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cc(F)c(C(F)(F)F)cc1F ZINC000579884294 1080518704 /nfs/dbraw/zinc/51/87/04/1080518704.db2.gz UVMBGYLDHSEGTI-UHFFFAOYSA-N 1 1 360.282 4.490 20 5 FIBDMO CCOc1cc(NCc2ccccc2C[N@@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000471260347 1080625852 /nfs/dbraw/zinc/62/58/52/1080625852.db2.gz ZRAUCHTTWNGGKG-UHFFFAOYSA-N 1 1 357.454 4.446 20 5 FIBDMO Cc1c(C[NH2+][C@@H](C)c2nc3ccccc3n2C(F)F)cccc1[N+](=O)[O-] ZINC000275471643 1080931049 /nfs/dbraw/zinc/93/10/49/1080931049.db2.gz OVSQQGROXSFOFS-LBPRGKRZSA-N 1 1 360.364 4.499 20 5 FIBDMO COc1ccc(OC(F)F)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000118976691 1081831380 /nfs/dbraw/zinc/83/13/80/1081831380.db2.gz OKQSRLDYTZGYJL-NSHDSACASA-N 1 1 352.337 4.056 20 5 FIBDMO C[C@@H]([NH2+][C@@H](CN1CCCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610420444 1081835760 /nfs/dbraw/zinc/83/57/60/1081835760.db2.gz IAWPQWRURWCKGM-UTKZUKDTSA-N 1 1 353.466 4.473 20 5 FIBDMO C[C@H]([NH2+][C@H](CN1CCCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610420443 1081835850 /nfs/dbraw/zinc/83/58/50/1081835850.db2.gz IAWPQWRURWCKGM-LAUBAEHRSA-N 1 1 353.466 4.473 20 5 FIBDMO Cc1c(CN[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000379652725 1081842742 /nfs/dbraw/zinc/84/27/42/1081842742.db2.gz XUNUPXPIQXZDGJ-JXFKEZNVSA-N 1 1 353.466 4.046 20 5 FIBDMO COc1cccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000379664031 1081851847 /nfs/dbraw/zinc/85/18/47/1081851847.db2.gz NNBVNBWUAUQHGQ-DOTOQJQBSA-N 1 1 355.438 4.068 20 5 FIBDMO CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000580518081 1081990582 /nfs/dbraw/zinc/99/05/82/1081990582.db2.gz HNYPHGDCSWWIKT-ZDUSSCGKSA-N 1 1 354.410 4.109 20 5 FIBDMO CC(C)c1nc2n(n1)CCC[C@@H]2[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433305510 1082185580 /nfs/dbraw/zinc/18/55/80/1082185580.db2.gz PRUAPRTWVFIBGB-DLBZAZTESA-N 1 1 369.469 4.157 20 5 FIBDMO Cc1c([C@H](C)NC2CC[NH+](CCc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000177969320 1082441111 /nfs/dbraw/zinc/44/11/11/1082441111.db2.gz PMDWTBURZMEONY-SFHVURJKSA-N 1 1 367.493 4.261 20 5 FIBDMO Cc1cccc([C@H]2CCCCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC001167457556 1082518075 /nfs/dbraw/zinc/51/80/75/1082518075.db2.gz FBAGQJHCPLBNNB-LJQANCHMSA-N 1 1 367.449 4.459 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](c4ncc[nH]4)C3)s2)cc1 ZINC000510536678 1083147143 /nfs/dbraw/zinc/14/71/43/1083147143.db2.gz YNCPGORYDFOJGE-OAHLLOKOSA-N 1 1 368.462 4.426 20 5 FIBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610580903 1083207752 /nfs/dbraw/zinc/20/77/52/1083207752.db2.gz WTKPPIZCELHIJO-QGZVFWFLSA-N 1 1 353.378 4.082 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610580903 1083207756 /nfs/dbraw/zinc/20/77/56/1083207756.db2.gz WTKPPIZCELHIJO-QGZVFWFLSA-N 1 1 353.378 4.082 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[NH2+]C3(c4ccc(F)cc4)CCCC3)nc2c1 ZINC000610581612 1083209631 /nfs/dbraw/zinc/20/96/31/1083209631.db2.gz BXWHBHBDNVFNKR-UHFFFAOYSA-N 1 1 355.369 4.434 20 5 FIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582730 1083220160 /nfs/dbraw/zinc/22/01/60/1083220160.db2.gz SRQSQOBFBCATPL-PXAZEXFGSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582730 1083220164 /nfs/dbraw/zinc/22/01/64/1083220164.db2.gz SRQSQOBFBCATPL-PXAZEXFGSA-N 1 1 355.369 4.458 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(N2CCCC2)nc1 ZINC000179320284 1083371201 /nfs/dbraw/zinc/37/12/01/1083371201.db2.gz NPHKTEPPZRQWDJ-UHFFFAOYSA-N 1 1 354.454 4.001 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ccc(F)cn3)o2)c(Cl)c1 ZINC000610787809 1083510801 /nfs/dbraw/zinc/51/08/01/1083510801.db2.gz TVAXACKQDBCETJ-UHFFFAOYSA-N 1 1 361.760 4.332 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000177159860 1083688928 /nfs/dbraw/zinc/68/89/28/1083688928.db2.gz ZJQXLGMSFTVWBJ-IBGZPJMESA-N 1 1 370.380 4.063 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](Cc1ccccc1)C[C@H](O)c1ccco1 ZINC000177159860 1083688933 /nfs/dbraw/zinc/68/89/33/1083688933.db2.gz ZJQXLGMSFTVWBJ-IBGZPJMESA-N 1 1 370.380 4.063 20 5 FIBDMO C[C@H]([NH2+][C@@H](CN1CCCCC1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610809710 1083719627 /nfs/dbraw/zinc/71/96/27/1083719627.db2.gz PVVYUSJOUKHGOU-UWJYYQICSA-N 1 1 353.466 4.473 20 5 FIBDMO C[C@H](c1ccc2ccccc2c1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000472440356 1083908344 /nfs/dbraw/zinc/90/83/44/1083908344.db2.gz SHRGTXQONRULCC-OAHLLOKOSA-N 1 1 350.422 4.170 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000612578185 1083923851 /nfs/dbraw/zinc/92/38/51/1083923851.db2.gz CVDYKUSSCMJAOA-TXEJJXNPSA-N 1 1 370.293 4.466 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000612578185 1083923853 /nfs/dbraw/zinc/92/38/53/1083923853.db2.gz CVDYKUSSCMJAOA-TXEJJXNPSA-N 1 1 370.293 4.466 20 5 FIBDMO C[NH+](C)C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000563249737 1084633297 /nfs/dbraw/zinc/63/32/97/1084633297.db2.gz KIPHOGYGOSUOCL-YEODSOHDSA-N 1 1 359.857 4.154 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2nc3c(s2)CCC3)cc1[N+](=O)[O-] ZINC000414156193 1084707901 /nfs/dbraw/zinc/70/79/01/1084707901.db2.gz OXZGYKCPDBHWSV-NWDGAFQWSA-N 1 1 361.467 4.351 20 5 FIBDMO Cc1ccccc1-c1noc([C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000511092481 1084767917 /nfs/dbraw/zinc/76/79/17/1084767917.db2.gz ABHUVVCKEMUAQL-HNNXBMFYSA-N 1 1 366.421 4.189 20 5 FIBDMO Cc1ccccc1-c1noc([C@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000511092481 1084767926 /nfs/dbraw/zinc/76/79/26/1084767926.db2.gz ABHUVVCKEMUAQL-HNNXBMFYSA-N 1 1 366.421 4.189 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccc1F ZINC000170905655 1084978507 /nfs/dbraw/zinc/97/85/07/1084978507.db2.gz QKRHDSFXABEXOZ-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO Cc1nc(C(F)(F)F)c(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000511121972 1084985496 /nfs/dbraw/zinc/98/54/96/1084985496.db2.gz GVSFNBOALXIONI-UHFFFAOYSA-N 1 1 359.373 4.053 20 5 FIBDMO CC(C)C[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)c2C1 ZINC000158295411 1084992665 /nfs/dbraw/zinc/99/26/65/1084992665.db2.gz RBQUITMFMIZKRX-UHFFFAOYSA-N 1 1 373.840 4.472 20 5 FIBDMO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001167582217 1085102977 /nfs/dbraw/zinc/10/29/77/1085102977.db2.gz MKGYPJMCARBFRH-LLVKDONJSA-N 1 1 369.284 4.482 20 5 FIBDMO CC[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccc(C)cc1 ZINC000181698535 1085210274 /nfs/dbraw/zinc/21/02/74/1085210274.db2.gz WTODUDKSAIXODV-KRWDZBQOSA-N 1 1 352.394 4.194 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@H](c4ccccc4)[C@@H]4CCC[C@@H]43)nc2c1 ZINC000511878139 1085276120 /nfs/dbraw/zinc/27/61/20/1085276120.db2.gz WTBNMVWHEBAPLZ-QKLQHJQFSA-N 1 1 362.433 4.239 20 5 FIBDMO CCC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000480080054 1085414666 /nfs/dbraw/zinc/41/46/66/1085414666.db2.gz FWOPIMWLZYSZQU-XLIONFOSSA-N 1 1 353.422 4.045 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ncnc3ccc([N+](=O)[O-])cc32)cc1 ZINC000611709929 1085428098 /nfs/dbraw/zinc/42/80/98/1085428098.db2.gz VUZGMBOCIMWDTH-ZDUSSCGKSA-N 1 1 374.404 4.205 20 5 FIBDMO Cn1ccnc1[C@@H]([NH2+]CCCCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000611560400 1085484943 /nfs/dbraw/zinc/48/49/43/1085484943.db2.gz UTBRKCCFDNPTDU-FQEVSTJZSA-N 1 1 364.449 4.030 20 5 FIBDMO C[C@H](C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1nccs1 ZINC000549545465 1085529639 /nfs/dbraw/zinc/52/96/39/1085529639.db2.gz VDRPMKKEGUVDHP-SNVBAGLBSA-N 1 1 359.373 4.306 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc(F)cc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000178649041 1085563025 /nfs/dbraw/zinc/56/30/25/1085563025.db2.gz QUGQAQKSVSJTPS-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO CC[C@@H]([NH2+][C@H](C(=O)N(CC)CC)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000178676055 1085784713 /nfs/dbraw/zinc/78/47/13/1085784713.db2.gz RCHDVLAWAFCTCW-UXHICEINSA-N 1 1 369.465 4.245 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1cc2ccccc2o1 ZINC000472269200 1085823380 /nfs/dbraw/zinc/82/33/80/1085823380.db2.gz UHKGHLFTHITRNY-UHFFFAOYSA-N 1 1 367.405 4.110 20 5 FIBDMO Cc1c(C[NH2+]Cc2c(F)cccc2Br)cccc1[N+](=O)[O-] ZINC000394691732 1086309600 /nfs/dbraw/zinc/30/96/00/1086309600.db2.gz BLZHQJOZKURTMM-UHFFFAOYSA-N 1 1 353.191 4.095 20 5 FIBDMO CCC[NH+]1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000236795050 1086467371 /nfs/dbraw/zinc/46/73/71/1086467371.db2.gz LSSLAKZWZZIZKQ-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO CCCN1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000236795050 1086467373 /nfs/dbraw/zinc/46/73/73/1086467373.db2.gz LSSLAKZWZZIZKQ-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO Cc1ccc2c(c1)[nH+]c(C)cc2OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000468308965 1086627683 /nfs/dbraw/zinc/62/76/83/1086627683.db2.gz PZDLLJUPVOTTAN-UHFFFAOYSA-N 1 1 366.373 4.205 20 5 FIBDMO C[C@H]1Cc2ccccc2N1C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC001167834040 1086678151 /nfs/dbraw/zinc/67/81/51/1086678151.db2.gz CDBNYMJVDVTSCX-HNNXBMFYSA-N 1 1 369.440 4.150 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@H]3CCCO3)o2)c([N+](=O)[O-])c1 ZINC000585767819 1086693882 /nfs/dbraw/zinc/69/38/82/1086693882.db2.gz DZPKAGTWVINIFZ-YLJYHZDGSA-N 1 1 372.421 4.007 20 5 FIBDMO CCn1c(=O)c2cc3ccccc3cc2nc1SCC[C@@H]1CCC[N@H+]1C ZINC000536089991 1086874202 /nfs/dbraw/zinc/87/42/02/1086874202.db2.gz CWGQAAANBWPMEW-KRWDZBQOSA-N 1 1 367.518 4.146 20 5 FIBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc(C(C)C)s1 ZINC000504899655 1087970230 /nfs/dbraw/zinc/97/02/30/1087970230.db2.gz JSGVYORGGXKOQW-LBPRGKRZSA-N 1 1 366.512 4.230 20 5 FIBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)n1 ZINC000541007204 1088204527 /nfs/dbraw/zinc/20/45/27/1088204527.db2.gz REVAIYSJRSZSMM-RHSMWYFYSA-N 1 1 360.483 4.163 20 5 FIBDMO CC1(C)CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000434710675 1088956061 /nfs/dbraw/zinc/95/60/61/1088956061.db2.gz JVFBXWQHRFRHHU-UHFFFAOYSA-N 1 1 361.467 4.010 20 5 FIBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1ccc(F)cc1 ZINC000434790731 1089043035 /nfs/dbraw/zinc/04/30/35/1089043035.db2.gz YBNNLIJCSMOOAJ-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1ccc(F)cc1 ZINC000434790731 1089043044 /nfs/dbraw/zinc/04/30/44/1089043044.db2.gz YBNNLIJCSMOOAJ-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO COCC[N@@H+](C)CC[C@@H](Nc1ccc([N+](=O)[O-])c(C)c1)c1ccccc1 ZINC000505559823 1089110213 /nfs/dbraw/zinc/11/02/13/1089110213.db2.gz NKRLOUNMXQJYKS-LJQANCHMSA-N 1 1 357.454 4.025 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000434898009 1089115965 /nfs/dbraw/zinc/11/59/65/1089115965.db2.gz SYFVQDUVCIFVQR-LPHOPBHVSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2Cn2cnc3ccccc32)c(Cl)c1 ZINC000541118847 1089239757 /nfs/dbraw/zinc/23/97/57/1089239757.db2.gz XZPJIRSYLJDJLB-MRXNPFEDSA-N 1 1 370.840 4.263 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cncc(Br)c1 ZINC000515339535 1089973141 /nfs/dbraw/zinc/97/31/41/1089973141.db2.gz KQLGHCIXPLXQGC-MNOVXSKESA-N 1 1 350.216 4.164 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@H](c4ccccc4)C3)o2)c1 ZINC000104679690 1090294709 /nfs/dbraw/zinc/29/47/09/1090294709.db2.gz KYIGMAWSYNDHKK-GOSISDBHSA-N 1 1 363.417 4.282 20 5 FIBDMO Cc1ccn2cc(C[NH2+][C@H]3CCCCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000417306752 1090793315 /nfs/dbraw/zinc/79/33/15/1090793315.db2.gz GKSIRFYQBKWPHU-IBGZPJMESA-N 1 1 350.422 4.108 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(OCc2ccccc2F)CC1 ZINC000091867781 1090914720 /nfs/dbraw/zinc/91/47/20/1090914720.db2.gz OROMVVWVAYVAGS-UHFFFAOYSA-N 1 1 362.376 4.054 20 5 FIBDMO Cc1ccc([C@H]2CCCCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])o1 ZINC000500074788 1091024183 /nfs/dbraw/zinc/02/41/83/1091024183.db2.gz NCNQOOIWYDXSPI-GOSISDBHSA-N 1 1 371.437 4.442 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500130059 1091055983 /nfs/dbraw/zinc/05/59/83/1091055983.db2.gz CMLYENKFXLYARU-AUUYWEPGSA-N 1 1 371.412 4.146 20 5 FIBDMO COc1cccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000549748715 1092751711 /nfs/dbraw/zinc/75/17/11/1092751711.db2.gz LVGGUWDVUCAZMB-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO COc1cccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)c1 ZINC000549748715 1092751716 /nfs/dbraw/zinc/75/17/16/1092751716.db2.gz LVGGUWDVUCAZMB-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1 ZINC001167911066 1092859183 /nfs/dbraw/zinc/85/91/83/1092859183.db2.gz AIZZDNMLFOMLGL-QGZVFWFLSA-N 1 1 365.433 4.335 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C(C)(C)c1cccc(Cl)c1F ZINC000473452869 1092900795 /nfs/dbraw/zinc/90/07/95/1092900795.db2.gz FRHVQRGFDMMHPW-UHFFFAOYSA-N 1 1 352.793 4.421 20 5 FIBDMO CC(C)c1ncc(C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000443061762 1092924281 /nfs/dbraw/zinc/92/42/81/1092924281.db2.gz JYUPPKUZDNUTAJ-UHFFFAOYSA-N 1 1 366.421 4.400 20 5 FIBDMO CC(C)c1ncc(C[N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000443061762 1092924287 /nfs/dbraw/zinc/92/42/87/1092924287.db2.gz JYUPPKUZDNUTAJ-UHFFFAOYSA-N 1 1 366.421 4.400 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(Cc2ccc(F)cc2)CC1 ZINC000433278241 1093520312 /nfs/dbraw/zinc/52/03/12/1093520312.db2.gz GFAMHZLABDDFFA-INIZCTEOSA-N 1 1 357.429 4.003 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000433278241 1093520317 /nfs/dbraw/zinc/52/03/17/1093520317.db2.gz GFAMHZLABDDFFA-INIZCTEOSA-N 1 1 357.429 4.003 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000433278241 1093520324 /nfs/dbraw/zinc/52/03/24/1093520324.db2.gz GFAMHZLABDDFFA-INIZCTEOSA-N 1 1 357.429 4.003 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](c4cccc(Cl)c4)C3)nc2c1 ZINC000433299020 1093554414 /nfs/dbraw/zinc/55/44/14/1093554414.db2.gz AUCCDZXFYJLALC-CYBMUJFWSA-N 1 1 357.797 4.379 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4cccc(Cl)c4)C3)nc2c1 ZINC000433299020 1093554417 /nfs/dbraw/zinc/55/44/17/1093554417.db2.gz AUCCDZXFYJLALC-CYBMUJFWSA-N 1 1 357.797 4.379 20 5 FIBDMO CC1(C)C[C@@H]([NH2+]Cc2ccn(C3CCCC3)n2)c2cc([N+](=O)[O-])ccc21 ZINC000433296294 1093562892 /nfs/dbraw/zinc/56/28/92/1093562892.db2.gz RXSYAAIBTKBIIW-LJQANCHMSA-N 1 1 354.454 4.419 20 5 FIBDMO O=C(CC[N@H+]1CC[C@@H](c2cccc(Cl)c2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000433308186 1093574153 /nfs/dbraw/zinc/57/41/53/1093574153.db2.gz XRFTWRGYMXNZQG-OAHLLOKOSA-N 1 1 373.840 4.066 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000474227754 1093599193 /nfs/dbraw/zinc/59/91/93/1093599193.db2.gz GGVBSHBJJMBHMK-KRWDZBQOSA-N 1 1 367.405 4.342 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCCC[C@H]1c1nc2ccccc2o1 ZINC000474227754 1093599200 /nfs/dbraw/zinc/59/92/00/1093599200.db2.gz GGVBSHBJJMBHMK-KRWDZBQOSA-N 1 1 367.405 4.342 20 5 FIBDMO COc1cccc(OC(F)(F)F)c1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000512994388 1093644433 /nfs/dbraw/zinc/64/44/33/1093644433.db2.gz ZSNCXPNJRAKZCC-UHFFFAOYSA-N 1 1 370.327 4.100 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccccc1)C(C)(C)C ZINC000474283306 1093645512 /nfs/dbraw/zinc/64/55/12/1093645512.db2.gz MREOGOJEGRQCLO-UHFFFAOYSA-N 1 1 355.438 4.142 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000398026249 1093809359 /nfs/dbraw/zinc/80/93/59/1093809359.db2.gz CHTUPVPDYBMGJV-XGHQBKJUSA-N 1 1 353.466 4.156 20 5 FIBDMO CCC[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000182329633 1093882546 /nfs/dbraw/zinc/88/25/46/1093882546.db2.gz CSXIBMQAKMKWSP-KRWDZBQOSA-N 1 1 352.394 4.276 20 5 FIBDMO C[C@@H]([NH2+]Cc1cccc(F)c1Br)c1cccc([N+](=O)[O-])c1 ZINC000382766448 1093888782 /nfs/dbraw/zinc/88/87/82/1093888782.db2.gz TTWUHTUKKGBQOF-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO CC[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(C)cc1 ZINC000182535260 1094131390 /nfs/dbraw/zinc/13/13/90/1094131390.db2.gz CZIAKZJNADAFCP-KRWDZBQOSA-N 1 1 352.394 4.194 20 5 FIBDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000513665364 1094271698 /nfs/dbraw/zinc/27/16/98/1094271698.db2.gz DVTVGPGWDCOBBH-HNNXBMFYSA-N 1 1 362.433 4.115 20 5 FIBDMO Cc1[nH+]ccn1CCCCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000502104864 1095122219 /nfs/dbraw/zinc/12/22/19/1095122219.db2.gz DVKBZCDYAZWGTF-UHFFFAOYSA-N 1 1 370.272 4.435 20 5 FIBDMO CC[C@H]1C[C@]1([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1cccc(C)c1 ZINC000502555372 1095587233 /nfs/dbraw/zinc/58/72/33/1095587233.db2.gz YGMHYQFQCIPBPT-MGPUTAFESA-N 1 1 358.413 4.466 20 5 FIBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000016587648 1095990029 /nfs/dbraw/zinc/99/00/29/1095990029.db2.gz OEJTZKUTXWOBNW-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000016587648 1095990031 /nfs/dbraw/zinc/99/00/31/1095990031.db2.gz OEJTZKUTXWOBNW-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO CC[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000425431592 1098596311 /nfs/dbraw/zinc/59/63/11/1098596311.db2.gz IPQXUQMGOAHHRX-ZDUSSCGKSA-N 1 1 368.231 4.203 20 5 FIBDMO CC[C@H](C)[C@H](C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000532966466 1098635141 /nfs/dbraw/zinc/63/51/41/1098635141.db2.gz JHGWGKNAFOMNCU-RYUDHWBXSA-N 1 1 353.850 4.086 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000533438754 1099042951 /nfs/dbraw/zinc/04/29/51/1099042951.db2.gz OYDKAOHLGOBCOR-IAGOWNOFSA-N 1 1 367.449 4.028 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000505845041 1099110848 /nfs/dbraw/zinc/11/08/48/1099110848.db2.gz JWCDSAVNYNXWQY-ANGAQGJPSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000505845041 1099110856 /nfs/dbraw/zinc/11/08/56/1099110856.db2.gz JWCDSAVNYNXWQY-ANGAQGJPSA-N 1 1 365.433 4.020 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)c2c(c1)COCO2 ZINC000505880410 1099308141 /nfs/dbraw/zinc/30/81/41/1099308141.db2.gz TYBTXSCPYSUKED-CSHXORCISA-N 1 1 366.417 4.139 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2/C=C/c2ccccc2)c2c(c1)COCO2 ZINC000505880410 1099308156 /nfs/dbraw/zinc/30/81/56/1099308156.db2.gz TYBTXSCPYSUKED-CSHXORCISA-N 1 1 366.417 4.139 20 5 FIBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1[C@H]1CCCO1 ZINC000516357248 1099407514 /nfs/dbraw/zinc/40/75/14/1099407514.db2.gz TZNNOCNOJBFYSX-RTBURBONSA-N 1 1 356.422 4.244 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC2(CCCC2)C1 ZINC000615000783 1099500741 /nfs/dbraw/zinc/50/07/41/1099500741.db2.gz UHLVZIKJVMXTGL-AWEZNQCLSA-N 1 1 356.426 4.362 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1c[nH]nc1-c1ccsc1)C1CC1 ZINC000437573484 1099995109 /nfs/dbraw/zinc/99/51/09/1099995109.db2.gz BRDVETNICMDMNL-UHFFFAOYSA-N 1 1 354.435 4.211 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1c[nH]nc1-c1ccsc1)C1CC1 ZINC000437573484 1099995111 /nfs/dbraw/zinc/99/51/11/1099995111.db2.gz BRDVETNICMDMNL-UHFFFAOYSA-N 1 1 354.435 4.211 20 5 FIBDMO CCN(Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000517124074 1100092673 /nfs/dbraw/zinc/09/26/73/1100092673.db2.gz MAIRGSJOPZZJPG-UWJYYQICSA-N 1 1 353.466 4.252 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H](CCO)c1ccccc1 ZINC000536669658 1100154297 /nfs/dbraw/zinc/15/42/97/1100154297.db2.gz XOPFRXHPIUIWFL-FQEVSTJZSA-N 1 1 366.417 4.410 20 5 FIBDMO COc1ccc(C[N@H+]2CCC[C@@H]2C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000536674197 1100161859 /nfs/dbraw/zinc/16/18/59/1100161859.db2.gz PGEHWOVNKTVYIK-HNNXBMFYSA-N 1 1 356.422 4.167 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c1 ZINC000536695334 1100196881 /nfs/dbraw/zinc/19/68/81/1100196881.db2.gz AQKPVKTUSOLARW-UKRRQHHQSA-N 1 1 358.410 4.056 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)c1 ZINC000536695334 1100196885 /nfs/dbraw/zinc/19/68/85/1100196885.db2.gz AQKPVKTUSOLARW-UKRRQHHQSA-N 1 1 358.410 4.056 20 5 FIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C[C@H]1CCCO1 ZINC000506425092 1100997606 /nfs/dbraw/zinc/99/76/06/1100997606.db2.gz ZVWNXQAYQIPUKC-CYBMUJFWSA-N 1 1 350.802 4.119 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccc(F)cc1)C1CCOCC1 ZINC000426404792 1101511937 /nfs/dbraw/zinc/51/19/37/1101511937.db2.gz OKARBDOHMZZDSL-UHFFFAOYSA-N 1 1 358.413 4.224 20 5 FIBDMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000543893274 1101667486 /nfs/dbraw/zinc/66/74/86/1101667486.db2.gz KTSNMTHMNIHVTC-UHFFFAOYSA-N 1 1 358.825 4.052 20 5 FIBDMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000543893274 1101667494 /nfs/dbraw/zinc/66/74/94/1101667494.db2.gz KTSNMTHMNIHVTC-UHFFFAOYSA-N 1 1 358.825 4.052 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1cccc(Cl)c1 ZINC000026226310 1101948857 /nfs/dbraw/zinc/94/88/57/1101948857.db2.gz PSQASYXYVNZMRK-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO Cc1ccc(C)c([C@@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1 ZINC000532398750 1101949543 /nfs/dbraw/zinc/94/95/43/1101949543.db2.gz UWCJAMALHOJMBG-FQEVSTJZSA-N 1 1 368.433 4.415 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1ccc(Cl)s1 ZINC000026250767 1102303872 /nfs/dbraw/zinc/30/38/72/1102303872.db2.gz CBJKFRKXPRKLCH-UHFFFAOYSA-N 1 1 367.858 4.079 20 5 FIBDMO CC[N@H+](Cc1cccs1)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171124482 1102407064 /nfs/dbraw/zinc/40/70/64/1102407064.db2.gz CVWJVOQLRGGDJQ-GFCCVEGCSA-N 1 1 358.423 4.289 20 5 FIBDMO CC[N@@H+](Cc1cccs1)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171124482 1102407073 /nfs/dbraw/zinc/40/70/73/1102407073.db2.gz CVWJVOQLRGGDJQ-GFCCVEGCSA-N 1 1 358.423 4.289 20 5 FIBDMO O=C(C[N@H+]1CCCCC[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000532490493 1102423840 /nfs/dbraw/zinc/42/38/40/1102423840.db2.gz ZQDACNBLLFAKAS-GOSISDBHSA-N 1 1 353.422 4.151 20 5 FIBDMO COc1ccccc1CC[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000729464409 1102674447 /nfs/dbraw/zinc/67/44/47/1102674447.db2.gz VEGIGKMYURMDMY-UHFFFAOYSA-N 1 1 373.434 4.013 20 5 FIBDMO COc1ccccc1CC[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000729464409 1102674451 /nfs/dbraw/zinc/67/44/51/1102674451.db2.gz VEGIGKMYURMDMY-UHFFFAOYSA-N 1 1 373.434 4.013 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000537651175 1102713655 /nfs/dbraw/zinc/71/36/55/1102713655.db2.gz ZJGWZLNDHCEWHC-IUYMFKLXSA-N 1 1 352.434 4.147 20 5 FIBDMO CC[C@@H]([NH2+]Cc1nccn1CCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000164291352 1102782037 /nfs/dbraw/zinc/78/20/37/1102782037.db2.gz FJMUEJKWQIFPFL-HXUWFJFHSA-N 1 1 364.449 4.275 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000537660107 1102783780 /nfs/dbraw/zinc/78/37/80/1102783780.db2.gz ZDQHOGMJNKSCNM-YCRPNKLZSA-N 1 1 362.433 4.188 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](CCc1ccccn1)Cc1ccc(F)cc1 ZINC000532687473 1102941261 /nfs/dbraw/zinc/94/12/61/1102941261.db2.gz SKGWXBBRQBPDBQ-UHFFFAOYSA-N 1 1 365.408 4.374 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1ccccn1)Cc1ccc(F)cc1 ZINC000532687473 1102941267 /nfs/dbraw/zinc/94/12/67/1102941267.db2.gz SKGWXBBRQBPDBQ-UHFFFAOYSA-N 1 1 365.408 4.374 20 5 FIBDMO COc1cc(C[N@H+](Cc2cccs2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000506996133 1103022796 /nfs/dbraw/zinc/02/27/96/1103022796.db2.gz ZXUSGPOJLRUMQA-UHFFFAOYSA-N 1 1 350.440 4.084 20 5 FIBDMO COc1cc(C[N@@H+](Cc2cccs2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000506996133 1103022811 /nfs/dbraw/zinc/02/28/11/1103022811.db2.gz ZXUSGPOJLRUMQA-UHFFFAOYSA-N 1 1 350.440 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(C(F)(F)F)cn2)C2CC2)cc1 ZINC000551393281 1103162844 /nfs/dbraw/zinc/16/28/44/1103162844.db2.gz DMKLEZCLECHWDY-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(C(F)(F)F)cn2)C2CC2)cc1 ZINC000551393281 1103162853 /nfs/dbraw/zinc/16/28/53/1103162853.db2.gz DMKLEZCLECHWDY-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c1OCCCO2 ZINC000507151580 1103168979 /nfs/dbraw/zinc/16/89/79/1103168979.db2.gz HYVQDSIHGRKALM-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CCN(CC)c1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000507151825 1103169861 /nfs/dbraw/zinc/16/98/61/1103169861.db2.gz LGEYNJJWRAPWQD-UHFFFAOYSA-N 1 1 362.499 4.308 20 5 FIBDMO CCN(CC)c1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000507151825 1103169871 /nfs/dbraw/zinc/16/98/71/1103169871.db2.gz LGEYNJJWRAPWQD-UHFFFAOYSA-N 1 1 362.499 4.308 20 5 FIBDMO Cc1nn(-c2ccccc2)cc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507153741 1103171281 /nfs/dbraw/zinc/17/12/81/1103171281.db2.gz FCQANRWPSSOSFC-UHFFFAOYSA-N 1 1 362.433 4.254 20 5 FIBDMO Cc1nn(-c2ccccc2)cc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507153741 1103171286 /nfs/dbraw/zinc/17/12/86/1103171286.db2.gz FCQANRWPSSOSFC-UHFFFAOYSA-N 1 1 362.433 4.254 20 5 FIBDMO Cc1cccc(-c2n[nH]cc2C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000507155629 1103173868 /nfs/dbraw/zinc/17/38/68/1103173868.db2.gz PNXOCXSSGPSJKW-UHFFFAOYSA-N 1 1 362.433 4.458 20 5 FIBDMO CCOc1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1OC ZINC000507154445 1103174512 /nfs/dbraw/zinc/17/45/12/1103174512.db2.gz JVWVCNWJPIECHR-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CCOc1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1OC ZINC000507154445 1103174522 /nfs/dbraw/zinc/17/45/22/1103174522.db2.gz JVWVCNWJPIECHR-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)CCc1ccc([N+](=O)[O-])cc1 ZINC000507614468 1103549016 /nfs/dbraw/zinc/54/90/16/1103549016.db2.gz DBFKNGJWQMNAIN-UHFFFAOYSA-N 1 1 364.449 4.092 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC000507661235 1103599901 /nfs/dbraw/zinc/59/99/01/1103599901.db2.gz SMXDFMMOKVJWDV-UHFFFAOYSA-N 1 1 350.422 4.050 20 5 FIBDMO CC[C@H](C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccccc1 ZINC000507703721 1103631559 /nfs/dbraw/zinc/63/15/59/1103631559.db2.gz CTTKQUQXDRLSCR-HNNXBMFYSA-N 1 1 366.421 4.446 20 5 FIBDMO CC[C@@H](C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccccc1 ZINC000507703723 1103632281 /nfs/dbraw/zinc/63/22/81/1103632281.db2.gz CTTKQUQXDRLSCR-OAHLLOKOSA-N 1 1 366.421 4.446 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000129396400 1103693643 /nfs/dbraw/zinc/69/36/43/1103693643.db2.gz QSRJPCRATAIONX-SFHVURJKSA-N 1 1 367.449 4.062 20 5 FIBDMO Cc1[nH+]cn(-c2ccc(NC(=O)Nc3cccc([N+](=O)[O-])c3)cc2)c1C ZINC000461114740 1104111510 /nfs/dbraw/zinc/11/15/10/1104111510.db2.gz CBPQIJAJHHSXGT-UHFFFAOYSA-N 1 1 351.366 4.041 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000441386124 1104322290 /nfs/dbraw/zinc/32/22/90/1104322290.db2.gz WDMGXVYLMUOUOB-MRXNPFEDSA-N 1 1 360.841 4.287 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000441445860 1104732103 /nfs/dbraw/zinc/73/21/03/1104732103.db2.gz WWVHKACIFVOBEH-LJQANCHMSA-N 1 1 362.470 4.306 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@]3(CCSC3)C2)c1Br ZINC000839616278 1105138690 /nfs/dbraw/zinc/13/86/90/1105138690.db2.gz SBPNARMZIDPUOG-OAHLLOKOSA-N 1 1 371.300 4.076 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@]3(CCSC3)C2)c1Br ZINC000839616278 1105138695 /nfs/dbraw/zinc/13/86/95/1105138695.db2.gz SBPNARMZIDPUOG-OAHLLOKOSA-N 1 1 371.300 4.076 20 5 FIBDMO O=[N+]([O-])c1cccc(CN2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000536489025 1105168818 /nfs/dbraw/zinc/16/88/18/1105168818.db2.gz YKICQCHQZLDOPE-UHFFFAOYSA-N 1 1 365.477 4.083 20 5 FIBDMO O=[N+]([O-])c1cccc(CN2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)c1 ZINC000536489025 1105168820 /nfs/dbraw/zinc/16/88/20/1105168820.db2.gz YKICQCHQZLDOPE-UHFFFAOYSA-N 1 1 365.477 4.083 20 5 FIBDMO CC(C)(O)[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000428074370 1105364578 /nfs/dbraw/zinc/36/45/78/1105364578.db2.gz HPASKIOMKRWYKW-KRWDZBQOSA-N 1 1 364.829 4.244 20 5 FIBDMO CC(C)(O)[C@H]1CCC[N@H+]1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000428079063 1105365532 /nfs/dbraw/zinc/36/55/32/1105365532.db2.gz OWXWWUOQTDCFMB-LJQANCHMSA-N 1 1 374.412 4.262 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC=C(c3cccnc3)C2)c1 ZINC000451025858 1106903922 /nfs/dbraw/zinc/90/39/22/1106903922.db2.gz LJMZDGVZJGVTKI-UHFFFAOYSA-N 1 1 363.339 4.298 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC=C(c3cccnc3)C2)c1 ZINC000451025858 1106903929 /nfs/dbraw/zinc/90/39/29/1106903929.db2.gz LJMZDGVZJGVTKI-UHFFFAOYSA-N 1 1 363.339 4.298 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cc(-c4ccco4)on3)C2)cc1 ZINC000451579114 1107191128 /nfs/dbraw/zinc/19/11/28/1107191128.db2.gz YENJDBAXFWIRNO-OAHLLOKOSA-N 1 1 353.378 4.222 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cc(-c4ccco4)on3)C2)cc1 ZINC000451579114 1107191141 /nfs/dbraw/zinc/19/11/41/1107191141.db2.gz YENJDBAXFWIRNO-OAHLLOKOSA-N 1 1 353.378 4.222 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000451620595 1107208999 /nfs/dbraw/zinc/20/89/99/1107208999.db2.gz PGRWLZVTVSRZNQ-MOPGFXCFSA-N 1 1 374.481 4.163 20 5 FIBDMO CCOc1ccccc1[C@H](CC)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444680884 1108081286 /nfs/dbraw/zinc/08/12/86/1108081286.db2.gz RJEYNRXFGBLPST-HNNXBMFYSA-N 1 1 354.410 4.111 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@@H](OCC4CC4)C3)cs2)c1 ZINC000428376253 1108155335 /nfs/dbraw/zinc/15/53/35/1108155335.db2.gz QKXIMECNAIAVLE-GOSISDBHSA-N 1 1 373.478 4.109 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H](OCC4CC4)C3)cs2)c1 ZINC000428376253 1108155340 /nfs/dbraw/zinc/15/53/40/1108155340.db2.gz QKXIMECNAIAVLE-GOSISDBHSA-N 1 1 373.478 4.109 20 5 FIBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000519920674 1108297228 /nfs/dbraw/zinc/29/72/28/1108297228.db2.gz VIAGLXAUDRAACM-GOSISDBHSA-N 1 1 367.449 4.062 20 5 FIBDMO Cc1cc(C[C@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)n[nH]1 ZINC000532015741 1108549536 /nfs/dbraw/zinc/54/95/36/1108549536.db2.gz WBLRZCXDGYLNHQ-LBPRGKRZSA-N 1 1 356.451 4.076 20 5 FIBDMO Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446835868 1109356100 /nfs/dbraw/zinc/35/61/00/1109356100.db2.gz NPPVIOCMSDSLEE-UHFFFAOYSA-N 1 1 364.327 4.088 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@@H]1c1ccccc1 ZINC000525639666 1109464961 /nfs/dbraw/zinc/46/49/61/1109464961.db2.gz VWXGQLQMRITJBT-QRWLVFNGSA-N 1 1 368.433 4.087 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cccnc1OC1CCCC1)CCC2 ZINC000447533689 1109569465 /nfs/dbraw/zinc/56/94/65/1109569465.db2.gz YHEXRZSJKKMDQT-HXUWFJFHSA-N 1 1 367.449 4.478 20 5 FIBDMO CC[NH+](CC)Cc1nc(-c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000527197797 1109717780 /nfs/dbraw/zinc/71/77/80/1109717780.db2.gz ZOESPBMSEPSQCY-UHFFFAOYSA-N 1 1 368.393 4.279 20 5 FIBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000449227626 1110002657 /nfs/dbraw/zinc/00/26/57/1110002657.db2.gz PUSNKFVVKWAZFU-LQWHRVPQSA-N 1 1 367.493 4.026 20 5 FIBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000449227625 1110002803 /nfs/dbraw/zinc/00/28/03/1110002803.db2.gz PUSNKFVVKWAZFU-DBXWQHBBSA-N 1 1 367.493 4.026 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2nc(C(F)(F)F)cs2)CC1 ZINC000449439188 1110079432 /nfs/dbraw/zinc/07/94/32/1110079432.db2.gz UDNMORKZWDASEG-UHFFFAOYSA-N 1 1 371.384 4.450 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450265047 1110272873 /nfs/dbraw/zinc/27/28/73/1110272873.db2.gz HXMPQQZSKHDRHR-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO C[C@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450433748 1110297000 /nfs/dbraw/zinc/29/70/00/1110297000.db2.gz LLHLLSGIKOVXPX-LSDHHAIUSA-N 1 1 354.454 4.208 20 5 FIBDMO CC[C@@H]([NH2+]Cc1ccn(CCc2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000450677875 1110332157 /nfs/dbraw/zinc/33/21/57/1110332157.db2.gz HBNADMSLACAIEL-OAQYLSRUSA-N 1 1 364.449 4.275 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](CO)CC2)ccc1Oc1ccc(F)cc1 ZINC000552422881 1111708087 /nfs/dbraw/zinc/70/80/87/1111708087.db2.gz HCVCAMWBTHURID-HNNXBMFYSA-N 1 1 374.412 4.121 20 5 FIBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccco1 ZINC000552531850 1111740679 /nfs/dbraw/zinc/74/06/79/1111740679.db2.gz VMSCXCQTZPOZIM-UHFFFAOYSA-N 1 1 355.394 4.296 20 5 FIBDMO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C[C@H]1CCCCO1 ZINC000553079962 1111903873 /nfs/dbraw/zinc/90/38/73/1111903873.db2.gz MZHKMFUTBAQXMF-GOSISDBHSA-N 1 1 350.459 4.163 20 5 FIBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000479364469 1112007191 /nfs/dbraw/zinc/00/71/91/1112007191.db2.gz IQILOEOITUWHEM-HNNXBMFYSA-N 1 1 371.485 4.106 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])c(C)c1OC ZINC000553957307 1112145054 /nfs/dbraw/zinc/14/50/54/1112145054.db2.gz MBHYVBMPKWKREL-LBPRGKRZSA-N 1 1 364.829 4.425 20 5 FIBDMO CCC(=O)c1ccc(NC[C@@H](C)[N@@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC000479929863 1112202014 /nfs/dbraw/zinc/20/20/14/1112202014.db2.gz LWHXLTOKQCYDME-CYBMUJFWSA-N 1 1 373.478 4.108 20 5 FIBDMO CCC(=O)c1ccc(NC[C@@H](C)[N@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC000479929863 1112202017 /nfs/dbraw/zinc/20/20/17/1112202017.db2.gz LWHXLTOKQCYDME-CYBMUJFWSA-N 1 1 373.478 4.108 20 5 FIBDMO COc1ccc(C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)cc1[N+](=O)[O-] ZINC000480394795 1112411512 /nfs/dbraw/zinc/41/15/12/1112411512.db2.gz PKPKXOUUCWODCV-UHFFFAOYSA-N 1 1 374.343 4.431 20 5 FIBDMO CCC(=O)c1ccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000480495400 1112447747 /nfs/dbraw/zinc/44/77/47/1112447747.db2.gz IEJIVJLOBLHKOM-KRWDZBQOSA-N 1 1 367.449 4.122 20 5 FIBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000554873667 1112539963 /nfs/dbraw/zinc/53/99/63/1112539963.db2.gz PDEDTLRHGODNGH-AHKGRUIUSA-N 1 1 368.433 4.160 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2C2CCOCC2)c1 ZINC000555422399 1112828810 /nfs/dbraw/zinc/82/88/10/1112828810.db2.gz YOUDTCLUXSZFDS-MRXNPFEDSA-N 1 1 358.360 4.005 20 5 FIBDMO C[C@@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555524412 1112910633 /nfs/dbraw/zinc/91/06/33/1112910633.db2.gz KSXOGQYHBLWEMN-OCCSQVGLSA-N 1 1 360.376 4.129 20 5 FIBDMO C[C@H](O)C[C@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555524408 1112910757 /nfs/dbraw/zinc/91/07/57/1112910757.db2.gz KSXOGQYHBLWEMN-GXTWGEPZSA-N 1 1 360.376 4.129 20 5 FIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(Cn2cc[nH+]c2C2CC2)cc1OC ZINC000600612248 1113103987 /nfs/dbraw/zinc/10/39/87/1113103987.db2.gz ZVBFKNVQFGIXSS-ZDUSSCGKSA-N 1 1 359.426 4.151 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](CSc4ccccc4)C3)nc2c1 ZINC000482699333 1113335606 /nfs/dbraw/zinc/33/56/06/1113335606.db2.gz TZQHIBZWOBPIJO-AWEZNQCLSA-N 1 1 368.462 4.085 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](CSc4ccccc4)C3)nc2c1 ZINC000482699333 1113335610 /nfs/dbraw/zinc/33/56/10/1113335610.db2.gz TZQHIBZWOBPIJO-AWEZNQCLSA-N 1 1 368.462 4.085 20 5 FIBDMO CC[N@H+](Cc1cccc(Cl)c1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488556566 1113951662 /nfs/dbraw/zinc/95/16/62/1113951662.db2.gz RPLOLRHUTROAFO-ZDUSSCGKSA-N 1 1 361.829 4.097 20 5 FIBDMO CC[N@@H+](Cc1cccc(Cl)c1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488556566 1113951664 /nfs/dbraw/zinc/95/16/64/1113951664.db2.gz RPLOLRHUTROAFO-ZDUSSCGKSA-N 1 1 361.829 4.097 20 5 FIBDMO CCOc1cc(C[NH2+][C@H](COC)c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000488688214 1113973427 /nfs/dbraw/zinc/97/34/27/1113973427.db2.gz HNODICKZDYXODP-MRXNPFEDSA-N 1 1 364.829 4.124 20 5 FIBDMO Cc1ccccc1[C@@H](C(C)C)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000488693560 1113977196 /nfs/dbraw/zinc/97/71/96/1113977196.db2.gz GKIZJDKMMSDLTJ-OAQYLSRUSA-N 1 1 369.465 4.479 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1csc(-c3ccco3)n1)CCC2 ZINC000192965141 1113988050 /nfs/dbraw/zinc/98/80/50/1113988050.db2.gz HPTOGYLHGDYXGX-INIZCTEOSA-N 1 1 355.419 4.479 20 5 FIBDMO CC1(C)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCc2ccccc21 ZINC000911595257 1114001906 /nfs/dbraw/zinc/00/19/06/1114001906.db2.gz BEQRUIIMWDSVJU-UHFFFAOYSA-N 1 1 351.406 4.072 20 5 FIBDMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000490039212 1114206578 /nfs/dbraw/zinc/20/65/78/1114206578.db2.gz JBTIZPKKAHKUIU-SJLPKXTDSA-N 1 1 367.449 4.028 20 5 FIBDMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)cc1 ZINC000490083928 1114216367 /nfs/dbraw/zinc/21/63/67/1114216367.db2.gz VECSPTUTRZSQDP-NVXWUHKLSA-N 1 1 368.433 4.148 20 5 FIBDMO COc1cc(C[N@H+](C)[C@H](C)c2cccs2)c([N+](=O)[O-])cc1OC(F)F ZINC000029594619 1114332988 /nfs/dbraw/zinc/33/29/88/1114332988.db2.gz SIEKJOIBJHRWNV-SNVBAGLBSA-N 1 1 372.393 4.459 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cccs2)c([N+](=O)[O-])cc1OC(F)F ZINC000029594619 1114332993 /nfs/dbraw/zinc/33/29/93/1114332993.db2.gz SIEKJOIBJHRWNV-SNVBAGLBSA-N 1 1 372.393 4.459 20 5 FIBDMO CCN(CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000249718937 1114658968 /nfs/dbraw/zinc/65/89/68/1114658968.db2.gz YBBUMHJIRJZELJ-XMSQKQJNSA-N 1 1 367.493 4.295 20 5 FIBDMO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000249718937 1114658969 /nfs/dbraw/zinc/65/89/69/1114658969.db2.gz YBBUMHJIRJZELJ-XMSQKQJNSA-N 1 1 367.493 4.295 20 5 FIBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000249718937 1114658971 /nfs/dbraw/zinc/65/89/71/1114658971.db2.gz YBBUMHJIRJZELJ-XMSQKQJNSA-N 1 1 367.493 4.295 20 5 FIBDMO COCc1ccccc1/C=C(\C)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000590353965 1114924375 /nfs/dbraw/zinc/92/43/75/1114924375.db2.gz VGIFPCYCNWFWJF-FOWTUZBSSA-N 1 1 352.434 4.203 20 5 FIBDMO COCc1ccccc1/C=C(\C)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000590353965 1114924376 /nfs/dbraw/zinc/92/43/76/1114924376.db2.gz VGIFPCYCNWFWJF-FOWTUZBSSA-N 1 1 352.434 4.203 20 5 FIBDMO Cc1ccc(CNc2nccc3c2cccc3[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000590696492 1114965118 /nfs/dbraw/zinc/96/51/18/1114965118.db2.gz PRYFPUPDCJCAPW-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO Cc1ccccc1C1([NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000592140037 1115207248 /nfs/dbraw/zinc/20/72/48/1115207248.db2.gz VCDTZSFCCJEEMI-UHFFFAOYSA-N 1 1 361.239 4.445 20 5 FIBDMO Cc1ccccc1C1([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCC1 ZINC000593040794 1115281915 /nfs/dbraw/zinc/28/19/15/1115281915.db2.gz VDLGMVPYAMTNGL-UHFFFAOYSA-N 1 1 364.405 4.122 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cccnc1OC1CCCC1 ZINC000594494632 1115450112 /nfs/dbraw/zinc/45/01/12/1115450112.db2.gz ONAAOEYXMRQBEZ-SFHVURJKSA-N 1 1 353.422 4.088 20 5 FIBDMO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594499626 1115450793 /nfs/dbraw/zinc/45/07/93/1115450793.db2.gz OJQFAIYMTRFTLO-XJKSGUPXSA-N 1 1 350.422 4.303 20 5 FIBDMO CCc1ccc(-c2nc(CCCCn3c[nH+]c(C)c3C)no2)cc1[N+](=O)[O-] ZINC000594534102 1115461258 /nfs/dbraw/zinc/46/12/58/1115461258.db2.gz IFMHHNBPMYYAPA-UHFFFAOYSA-N 1 1 369.425 4.043 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCOc2c(Cl)cccc21 ZINC000595008676 1115507831 /nfs/dbraw/zinc/50/78/31/1115507831.db2.gz QNINEJLPUMONRZ-MEDUHNTESA-N 1 1 362.813 4.431 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1nccn1C ZINC000595107578 1115516465 /nfs/dbraw/zinc/51/64/65/1115516465.db2.gz NKZBMGDCIWBYNM-QWHCGFSZSA-N 1 1 356.451 4.469 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cc(F)ccc1OC(F)F ZINC000595093731 1115517552 /nfs/dbraw/zinc/51/75/52/1115517552.db2.gz OOOFOTGKDAEDIW-LLVKDONJSA-N 1 1 354.328 4.495 20 5 FIBDMO CCCOc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595415294 1115535045 /nfs/dbraw/zinc/53/50/45/1115535045.db2.gz LMSCOHZDOMVWQH-ZDUSSCGKSA-N 1 1 362.401 4.382 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000595484035 1115536504 /nfs/dbraw/zinc/53/65/04/1115536504.db2.gz OSVRWHBNDJVXSR-OAHLLOKOSA-N 1 1 373.211 4.254 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccccc2OC(C)C)c1 ZINC000593021850 1115539348 /nfs/dbraw/zinc/53/93/48/1115539348.db2.gz YWAHBAKLNZQKCG-CQSZACIVSA-N 1 1 372.421 4.019 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000593122915 1115563022 /nfs/dbraw/zinc/56/30/22/1115563022.db2.gz BJCICPRFKQGVTE-ZJOUEHCJSA-N 1 1 368.433 4.098 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000593122915 1115563025 /nfs/dbraw/zinc/56/30/25/1115563025.db2.gz BJCICPRFKQGVTE-ZJOUEHCJSA-N 1 1 368.433 4.098 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)c1 ZINC000595785780 1115563470 /nfs/dbraw/zinc/56/34/70/1115563470.db2.gz GOEDNUXTPJCPJZ-DYVFJYSZSA-N 1 1 372.387 4.395 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](CCC1CC1)CC1CC1 ZINC000595871426 1115566951 /nfs/dbraw/zinc/56/69/51/1115566951.db2.gz NNFINPSYZLRJGD-CYBMUJFWSA-N 1 1 356.426 4.218 20 5 FIBDMO Cc1noc(CNc2ccccc2C[N@H+](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000596029512 1115570159 /nfs/dbraw/zinc/57/01/59/1115570159.db2.gz XAMSKKIBLRYWFD-UHFFFAOYSA-N 1 1 358.442 4.268 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000597207317 1115647873 /nfs/dbraw/zinc/64/78/73/1115647873.db2.gz ZWXXEDNJXCJEQG-BSUSYPBHSA-N 1 1 366.461 4.096 20 5 FIBDMO Cc1ccc(CNc2ccnc3cc([N+](=O)[O-])ccc32)c(N2CCCC2)[nH+]1 ZINC000593469172 1115691880 /nfs/dbraw/zinc/69/18/80/1115691880.db2.gz IMUGMRQDQFIGNV-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H](CO)CC3)o2)c(Cl)c1 ZINC000560627321 1115715495 /nfs/dbraw/zinc/71/54/95/1115715495.db2.gz FVYQIXFASVRDEJ-CYBMUJFWSA-N 1 1 364.829 4.103 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1csc(C(F)(F)F)c1 ZINC000599006029 1115776489 /nfs/dbraw/zinc/77/64/89/1115776489.db2.gz HTTIIBBMDFIQNX-UHFFFAOYSA-N 1 1 360.357 4.364 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cc(-c2ccccc2)n(C)n1 ZINC000599024999 1115777774 /nfs/dbraw/zinc/77/77/74/1115777774.db2.gz WDPPDISUHJVAFJ-LSDHHAIUSA-N 1 1 350.422 4.407 20 5 FIBDMO C[N@H+]1CCCC[C@@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000599070736 1115787054 /nfs/dbraw/zinc/78/70/54/1115787054.db2.gz OGHJDWFKUBQJPS-UWJYYQICSA-N 1 1 353.466 4.006 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](Cc1ccccc1)c1nccn1C ZINC000593723254 1115804888 /nfs/dbraw/zinc/80/48/88/1115804888.db2.gz UNNBXVPPWVKKOL-UZLBHIALSA-N 1 1 364.449 4.271 20 5 FIBDMO COc1ccc(C[N@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000603837394 1115819943 /nfs/dbraw/zinc/81/99/43/1115819943.db2.gz FRNJIAIGFBQKTB-CXAGYDPISA-N 1 1 356.422 4.484 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000603837394 1115819944 /nfs/dbraw/zinc/81/99/44/1115819944.db2.gz FRNJIAIGFBQKTB-CXAGYDPISA-N 1 1 356.422 4.484 20 5 FIBDMO CCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](CC)c1ccccc1 ZINC000604492852 1115867598 /nfs/dbraw/zinc/86/75/98/1115867598.db2.gz INPJBEVBFZVJKJ-SFHVURJKSA-N 1 1 355.438 4.057 20 5 FIBDMO C[N@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000604506833 1115868506 /nfs/dbraw/zinc/86/85/06/1115868506.db2.gz PITNSEVEEIEICY-KRWDZBQOSA-N 1 1 365.355 4.107 20 5 FIBDMO C[C@@H](O)c1ccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000172115380 1115916565 /nfs/dbraw/zinc/91/65/65/1115916565.db2.gz ZKBYOTVTAUREGI-CYBMUJFWSA-N 1 1 369.446 4.061 20 5 FIBDMO CCc1ccc(C[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C2CC2)cc1 ZINC000063498684 1116075225 /nfs/dbraw/zinc/07/52/25/1116075225.db2.gz HPKJVEXCDNHECS-UHFFFAOYSA-N 1 1 367.449 4.069 20 5 FIBDMO CCc1ccc(C[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C2CC2)cc1 ZINC000063498684 1116075227 /nfs/dbraw/zinc/07/52/27/1116075227.db2.gz HPKJVEXCDNHECS-UHFFFAOYSA-N 1 1 367.449 4.069 20 5 FIBDMO CCN(Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000608788721 1116130009 /nfs/dbraw/zinc/13/00/09/1116130009.db2.gz QSCZSXQUDNSWHA-LAUBAEHRSA-N 1 1 353.466 4.252 20 5 FIBDMO COc1cc(NCc2ccccc2C[N@@H+](C)C(C)C)c(F)cc1[N+](=O)[O-] ZINC000534183451 1116167339 /nfs/dbraw/zinc/16/73/39/1116167339.db2.gz RJXXYOCSSNFZGG-UHFFFAOYSA-N 1 1 361.417 4.195 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC12CCCCC2 ZINC000462467635 1116355441 /nfs/dbraw/zinc/35/54/41/1116355441.db2.gz JJVIVCUCKWNHHS-OAHLLOKOSA-N 1 1 370.453 4.437 20 5 FIBDMO CCn1cc(C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)cn1 ZINC000539828935 1116387972 /nfs/dbraw/zinc/38/79/72/1116387972.db2.gz OESYTCDNWXNTTK-UHFFFAOYSA-N 1 1 356.451 4.172 20 5 FIBDMO CCn1cc(C[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)cn1 ZINC000539828935 1116387975 /nfs/dbraw/zinc/38/79/75/1116387975.db2.gz OESYTCDNWXNTTK-UHFFFAOYSA-N 1 1 356.451 4.172 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]4COCC[C@@H]43)s2)cc1 ZINC000539891336 1116395847 /nfs/dbraw/zinc/39/58/47/1116395847.db2.gz LMZKIIOOZBJTGN-YJBOKZPZSA-N 1 1 358.463 4.324 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]4COCC[C@H]43)s2)cc1 ZINC000539891328 1116395890 /nfs/dbraw/zinc/39/58/90/1116395890.db2.gz LMZKIIOOZBJTGN-CRAIPNDOSA-N 1 1 358.463 4.324 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@@H+](CC4CCCC4)C3)o2)cc1 ZINC000462741910 1117740864 /nfs/dbraw/zinc/74/08/64/1117740864.db2.gz VXNGVVVZTCQTCK-SFHVURJKSA-N 1 1 369.465 4.209 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCN(CC4CCCC4)C3)o2)cc1 ZINC000462741910 1117740867 /nfs/dbraw/zinc/74/08/67/1117740867.db2.gz VXNGVVVZTCQTCK-SFHVURJKSA-N 1 1 369.465 4.209 20 5 FIBDMO Cc1[nH+]cn(-c2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2)c1C ZINC000462759028 1117758881 /nfs/dbraw/zinc/75/88/81/1117758881.db2.gz CCAJPYSXNHLQQI-UHFFFAOYSA-N 1 1 370.796 4.303 20 5 FIBDMO C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463030399 1117934315 /nfs/dbraw/zinc/93/43/15/1117934315.db2.gz VFTUMYVNOCMLHQ-CABCVRRESA-N 1 1 374.359 4.014 20 5 FIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463030399 1117934318 /nfs/dbraw/zinc/93/43/18/1117934318.db2.gz VFTUMYVNOCMLHQ-CABCVRRESA-N 1 1 374.359 4.014 20 5 FIBDMO C[C@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[N@H+]1C ZINC000540610970 1118150075 /nfs/dbraw/zinc/15/00/75/1118150075.db2.gz YVKWQWNKCHLRIJ-QWHCGFSZSA-N 1 1 363.845 4.081 20 5 FIBDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCN1C ZINC000540610970 1118150078 /nfs/dbraw/zinc/15/00/78/1118150078.db2.gz YVKWQWNKCHLRIJ-QWHCGFSZSA-N 1 1 363.845 4.081 20 5 FIBDMO CC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000463482451 1118178374 /nfs/dbraw/zinc/17/83/74/1118178374.db2.gz BWPQZQTWQBHOSX-CYBMUJFWSA-N 1 1 362.401 4.334 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000463482451 1118178377 /nfs/dbraw/zinc/17/83/77/1118178377.db2.gz BWPQZQTWQBHOSX-CYBMUJFWSA-N 1 1 362.401 4.334 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCOc2ccc(Cl)cc21 ZINC000541570575 1118567168 /nfs/dbraw/zinc/56/71/68/1118567168.db2.gz VYKGQKWUNROKPR-MRXNPFEDSA-N 1 1 362.813 4.260 20 5 FIBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(N(C)C)c2)c([N+](=O)[O-])cc1F ZINC000464677943 1118648791 /nfs/dbraw/zinc/64/87/91/1118648791.db2.gz NTBPGIILIKULHI-SFHVURJKSA-N 1 1 373.428 4.146 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(N(C)C)c2)c([N+](=O)[O-])cc1F ZINC000464677943 1118648792 /nfs/dbraw/zinc/64/87/92/1118648792.db2.gz NTBPGIILIKULHI-SFHVURJKSA-N 1 1 373.428 4.146 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](CSc3ccccc3)C2)c1 ZINC000464757329 1118682543 /nfs/dbraw/zinc/68/25/43/1118682543.db2.gz MENHWZHVBWCCRJ-INIZCTEOSA-N 1 1 358.463 4.088 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000464761336 1118684312 /nfs/dbraw/zinc/68/43/12/1118684312.db2.gz NBULVMKXUDDDMH-MRXNPFEDSA-N 1 1 358.463 4.088 20 5 FIBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000464780446 1118692082 /nfs/dbraw/zinc/69/20/82/1118692082.db2.gz SUFHBRFYLZMNSO-RDJZCZTQSA-N 1 1 352.500 4.488 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](CO)c2ccc(C(F)(F)F)cc2)c(Cl)c1 ZINC000542044916 1118761818 /nfs/dbraw/zinc/76/18/18/1118761818.db2.gz AAQXMBUEPPHZHW-HNNXBMFYSA-N 1 1 374.746 4.090 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000151896632 1119000391 /nfs/dbraw/zinc/00/03/91/1119000391.db2.gz BLRPLKQDWNBUEF-WMZOPIPTSA-N 1 1 374.437 4.063 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](CCCO)[C@@H]2CCc3ccccc32)cc1Cl ZINC000761510137 1119404630 /nfs/dbraw/zinc/40/46/30/1119404630.db2.gz DOZBZNVQCSOWPC-GOSISDBHSA-N 1 1 360.841 4.120 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C2CC2)cc1 ZINC000761506009 1119406378 /nfs/dbraw/zinc/40/63/78/1119406378.db2.gz LRMOECJXLQPBQP-UHFFFAOYSA-N 1 1 361.785 4.321 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C2CC2)cc1 ZINC000761506009 1119406381 /nfs/dbraw/zinc/40/63/81/1119406381.db2.gz LRMOECJXLQPBQP-UHFFFAOYSA-N 1 1 361.785 4.321 20 5 FIBDMO C[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C[N@@H+]1Cc1ccccc1 ZINC000761526500 1119409773 /nfs/dbraw/zinc/40/97/73/1119409773.db2.gz FDENJPUGQSEMJT-RHSMWYFYSA-N 1 1 359.857 4.001 20 5 FIBDMO C[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C[N@H+]1Cc1ccccc1 ZINC000761526500 1119409778 /nfs/dbraw/zinc/40/97/78/1119409778.db2.gz FDENJPUGQSEMJT-RHSMWYFYSA-N 1 1 359.857 4.001 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526585 1119409957 /nfs/dbraw/zinc/40/99/57/1119409957.db2.gz OWFKQDGSUPXMCJ-KXBFYZLASA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526585 1119409963 /nfs/dbraw/zinc/40/99/63/1119409963.db2.gz OWFKQDGSUPXMCJ-KXBFYZLASA-N 1 1 373.884 4.248 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000494292538 1119821804 /nfs/dbraw/zinc/82/18/04/1119821804.db2.gz GXBGGRDSQYLZGK-QINSGFPZSA-N 1 1 364.405 4.180 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000494292538 1119821811 /nfs/dbraw/zinc/82/18/11/1119821811.db2.gz GXBGGRDSQYLZGK-QINSGFPZSA-N 1 1 364.405 4.180 20 5 FIBDMO Cc1c([C@H](C)N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000495440340 1120824433 /nfs/dbraw/zinc/82/44/33/1120824433.db2.gz RGBQZMXLZXTEOF-BJLQDIEVSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1c([C@H](C)N[C@@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000495440340 1120824441 /nfs/dbraw/zinc/82/44/41/1120824441.db2.gz RGBQZMXLZXTEOF-BJLQDIEVSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc(Sc2ccc(CNC[C@@H](C)[NH+](C)C)cc2[N+](=O)[O-])cc1 ZINC000609223297 1121013593 /nfs/dbraw/zinc/01/35/93/1121013593.db2.gz FCSJNNXISWVNQM-OAHLLOKOSA-N 1 1 359.495 4.094 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-] ZINC000090943873 1121161889 /nfs/dbraw/zinc/16/18/89/1121161889.db2.gz CMJHNTROKPMVLH-CQSZACIVSA-N 1 1 354.385 4.079 20 5 FIBDMO CC(=O)c1c(NC[C@H](c2ccco2)[NH+]2CCCCC2)cccc1[N+](=O)[O-] ZINC000763206884 1121275896 /nfs/dbraw/zinc/27/58/96/1121275896.db2.gz NAVSPXHVVPWUAM-QGZVFWFLSA-N 1 1 357.410 4.030 20 5 FIBDMO C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000301544738 1122218427 /nfs/dbraw/zinc/21/84/27/1122218427.db2.gz OPADDSUAMSUSOR-ZFWWWQNUSA-N 1 1 360.845 4.108 20 5 FIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(-n2cccn2)cc1 ZINC000064350177 1123705956 /nfs/dbraw/zinc/70/59/56/1123705956.db2.gz RJFJECQQWRNXDF-UHFFFAOYSA-N 1 1 350.422 4.191 20 5 FIBDMO CC(C)N(C(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)c1ccccc1 ZINC000064350574 1123706297 /nfs/dbraw/zinc/70/62/97/1123706297.db2.gz GKEHAPFULLNHLY-UHFFFAOYSA-N 1 1 369.465 4.247 20 5 FIBDMO CC(C)N(C(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C)c1ccccc1 ZINC000064350574 1123706300 /nfs/dbraw/zinc/70/63/00/1123706300.db2.gz GKEHAPFULLNHLY-UHFFFAOYSA-N 1 1 369.465 4.247 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC4(CCCCC4)C3)n2)c1 ZINC000609541425 1123747742 /nfs/dbraw/zinc/74/77/42/1123747742.db2.gz QNSWKGMTPHVEEA-UHFFFAOYSA-N 1 1 356.426 4.191 20 5 FIBDMO Cc1ccc(C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C2CC2)cc1C ZINC000610133786 1123949539 /nfs/dbraw/zinc/94/95/39/1123949539.db2.gz BVOPZWPACUUOSM-UHFFFAOYSA-N 1 1 368.433 4.243 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C2CC2)cc1C ZINC000610133786 1123949540 /nfs/dbraw/zinc/94/95/40/1123949540.db2.gz BVOPZWPACUUOSM-UHFFFAOYSA-N 1 1 368.433 4.243 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000615834328 1124127907 /nfs/dbraw/zinc/12/79/07/1124127907.db2.gz AOAOUWYRCXSSAW-WYPWOVKWSA-N 1 1 352.434 4.462 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC12CCCCC2 ZINC000462467634 1124287762 /nfs/dbraw/zinc/28/77/62/1124287762.db2.gz JJVIVCUCKWNHHS-HNNXBMFYSA-N 1 1 370.453 4.437 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000554291370 1124325027 /nfs/dbraw/zinc/32/50/27/1124325027.db2.gz SCEZGKOUOJLBCB-HNNXBMFYSA-N 1 1 355.221 4.115 20 5 FIBDMO COc1cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)ccc1OC(C)C ZINC001168686299 1124823856 /nfs/dbraw/zinc/82/38/56/1124823856.db2.gz QYZKNRBLIBYMSB-ZDUSSCGKSA-N 1 1 362.401 4.381 20 5 FIBDMO CN(Cc1ccc([N+](=O)[O-])cc1Cl)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000542927569 1124879892 /nfs/dbraw/zinc/87/98/92/1124879892.db2.gz MALLDPUIWJSNJV-QGZVFWFLSA-N 1 1 373.884 4.202 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000542929386 1124888904 /nfs/dbraw/zinc/88/89/04/1124888904.db2.gz XXMRHQDFCSIWCI-OIISXLGYSA-N 1 1 352.862 4.274 20 5 FIBDMO C[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(O)c1 ZINC000113336420 1125154599 /nfs/dbraw/zinc/15/45/99/1125154599.db2.gz OTNMICYVCXRMHC-GFCCVEGCSA-N 1 1 355.419 4.275 20 5 FIBDMO COc1ccc(C[N@H+](C)Cc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000051454555 567961181 /nfs/dbraw/zinc/96/11/81/567961181.db2.gz BIYYHFSJSHPFKI-UHFFFAOYSA-N 1 1 371.256 4.059 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(Br)s2)cc1[N+](=O)[O-] ZINC000051454555 567961182 /nfs/dbraw/zinc/96/11/82/567961182.db2.gz BIYYHFSJSHPFKI-UHFFFAOYSA-N 1 1 371.256 4.059 20 5 FIBDMO CC[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1c(C)noc1C ZINC000602575401 567996585 /nfs/dbraw/zinc/99/65/85/567996585.db2.gz GYSMVOAOUMOPEX-NSHDSACASA-N 1 1 374.260 4.265 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c1 ZINC000568998107 568265550 /nfs/dbraw/zinc/26/55/50/568265550.db2.gz YGMYVAPFVGRGBP-MLGOLLRUSA-N 1 1 358.360 4.005 20 5 FIBDMO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000078571602 1125564748 /nfs/dbraw/zinc/56/47/48/1125564748.db2.gz UBQRHNQOGUXGCP-MRXNPFEDSA-N 1 1 354.454 4.285 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000619722722 1125668239 /nfs/dbraw/zinc/66/82/39/1125668239.db2.gz VDNJIQDJAWWSSA-IRXDYDNUSA-N 1 1 368.481 4.377 20 5 FIBDMO CC(=O)c1cc(N[C@@H](C)c2ccc(-n3cc[nH+]c3C)cc2)ccc1[N+](=O)[O-] ZINC000557605371 1079576412 /nfs/dbraw/zinc/57/64/12/1079576412.db2.gz JCBIAZFYMLRXGC-ZDUSSCGKSA-N 1 1 364.405 4.465 20 5 FIBDMO CC(=O)c1cc(N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)ccc1[N+](=O)[O-] ZINC000557605370 1079577622 /nfs/dbraw/zinc/57/76/22/1079577622.db2.gz JCBIAZFYMLRXGC-CYBMUJFWSA-N 1 1 364.405 4.465 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCOC[C@@H](C4CCC4)C3)o2)c1 ZINC000430142928 1079594423 /nfs/dbraw/zinc/59/44/23/1079594423.db2.gz AYOSCLHZTUPJME-KRWDZBQOSA-N 1 1 356.422 4.103 20 5 FIBDMO Cc1ccccc1[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)C ZINC000183227522 1125781368 /nfs/dbraw/zinc/78/13/68/1125781368.db2.gz NSXRDNHWKYBHGH-IBGZPJMESA-N 1 1 366.421 4.440 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccc(Br)s1 ZINC000430192190 1079811746 /nfs/dbraw/zinc/81/17/46/1079811746.db2.gz AXNQHCCAWBDEQV-SECBINFHSA-N 1 1 371.256 4.278 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000430208862 1079959991 /nfs/dbraw/zinc/95/99/91/1079959991.db2.gz PUIBAODLCNJNFM-UHFFFAOYSA-N 1 1 366.339 4.401 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1OCC ZINC000430213210 1079979417 /nfs/dbraw/zinc/97/94/17/1079979417.db2.gz SBIKKNFTUUQCHM-AWEZNQCLSA-N 1 1 374.437 4.252 20 5 FIBDMO COc1cc(C[N@H+]2C[C@@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000610215343 1079986922 /nfs/dbraw/zinc/98/69/22/1079986922.db2.gz FAIJURMZSPQUOW-RYUDHWBXSA-N 1 1 358.385 4.215 20 5 FIBDMO COc1cc(C[N@H+]2C[C@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000610215344 1079987055 /nfs/dbraw/zinc/98/70/55/1079987055.db2.gz FAIJURMZSPQUOW-VXGBXAGGSA-N 1 1 358.385 4.215 20 5 FIBDMO Cc1ccc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cc1[N+](=O)[O-] ZINC000157533734 1079994233 /nfs/dbraw/zinc/99/42/33/1079994233.db2.gz OJKHNJHRTXBFDQ-QGZVFWFLSA-N 1 1 373.497 4.020 20 5 FIBDMO Cc1ccc(NC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000118787466 1080057643 /nfs/dbraw/zinc/05/76/43/1080057643.db2.gz IGZIFVXKOXZCPJ-DLBZAZTESA-N 1 1 374.485 4.022 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc3ccccc3n2)CC1 ZINC000471199566 1080243157 /nfs/dbraw/zinc/24/31/57/1080243157.db2.gz QAXQYCYUYVIJDK-INIZCTEOSA-N 1 1 362.433 4.026 20 5 FIBDMO CC[N@H+](Cc1ccc(Cl)cc1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167243916 1080901675 /nfs/dbraw/zinc/90/16/75/1080901675.db2.gz AHVOTCHQSNVBJQ-UHFFFAOYSA-N 1 1 362.813 4.057 20 5 FIBDMO CC[N@@H+](Cc1ccc(Cl)cc1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167243916 1080901677 /nfs/dbraw/zinc/90/16/77/1080901677.db2.gz AHVOTCHQSNVBJQ-UHFFFAOYSA-N 1 1 362.813 4.057 20 5 FIBDMO CC[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(OC)c(OC)c1 ZINC000510257352 1080932090 /nfs/dbraw/zinc/93/20/90/1080932090.db2.gz QDFTUPWSUYNJQU-INIZCTEOSA-N 1 1 366.364 4.131 20 5 FIBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001167298105 1081188853 /nfs/dbraw/zinc/18/88/53/1081188853.db2.gz FDCMFTXCRBJOLQ-ZDUSSCGKSA-N 1 1 364.833 4.309 20 5 FIBDMO Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000544898561 1081190823 /nfs/dbraw/zinc/19/08/23/1081190823.db2.gz UEVGRJSBHXIDBL-CQSZACIVSA-N 1 1 352.394 4.112 20 5 FIBDMO C[C@@H]1C[C@H](C)C[N@H+](CCCNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001648813802 1081215434 /nfs/dbraw/zinc/21/54/34/1081215434.db2.gz AHAPVBYMWZVXPH-CALCHBBNSA-N 1 1 371.481 4.312 20 5 FIBDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083170559 1081274444 /nfs/dbraw/zinc/27/44/44/1081274444.db2.gz FWRCOIFYVXISGO-MRXNPFEDSA-N 1 1 353.378 4.082 20 5 FIBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083170559 1081274450 /nfs/dbraw/zinc/27/44/50/1081274450.db2.gz FWRCOIFYVXISGO-MRXNPFEDSA-N 1 1 353.378 4.082 20 5 FIBDMO C[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000379656993 1081851642 /nfs/dbraw/zinc/85/16/42/1081851642.db2.gz RDPUZLQPCXDZMT-CRAIPNDOSA-N 1 1 373.884 4.391 20 5 FIBDMO CC[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC001167380731 1081853139 /nfs/dbraw/zinc/85/31/39/1081853139.db2.gz ILVSWLBYIGOOTH-OLZOCXBDSA-N 1 1 353.850 4.087 20 5 FIBDMO CC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC001167380731 1081853146 /nfs/dbraw/zinc/85/31/46/1081853146.db2.gz ILVSWLBYIGOOTH-OLZOCXBDSA-N 1 1 353.850 4.087 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)c(F)c1 ZINC000610481367 1082562674 /nfs/dbraw/zinc/56/26/74/1082562674.db2.gz VKQBYDFXSQEGOG-CQSZACIVSA-N 1 1 355.369 4.255 20 5 FIBDMO CC(C)n1ncc2cc(C[N@H+](Cc3ccccc3[N+](=O)[O-])C3CC3)cnc21 ZINC000135231901 1082580028 /nfs/dbraw/zinc/58/00/28/1082580028.db2.gz FNIGCPRXQPXMPT-UHFFFAOYSA-N 1 1 365.437 4.085 20 5 FIBDMO CC(C)n1ncc2cc(C[N@@H+](Cc3ccccc3[N+](=O)[O-])C3CC3)cnc21 ZINC000135231901 1082580032 /nfs/dbraw/zinc/58/00/32/1082580032.db2.gz FNIGCPRXQPXMPT-UHFFFAOYSA-N 1 1 365.437 4.085 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1cnn(Cc2ccccc2)c1 ZINC000090853219 1082742809 /nfs/dbraw/zinc/74/28/09/1082742809.db2.gz FYLGRFVCSUXVTF-HZPDHXFCSA-N 1 1 350.422 4.251 20 5 FIBDMO Cc1cnn([C@H]2CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C2)c1 ZINC000581975685 1083128242 /nfs/dbraw/zinc/12/82/42/1083128242.db2.gz QSORBLDVZMWORS-KRWDZBQOSA-N 1 1 368.462 4.275 20 5 FIBDMO COc1cccc(C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC(C)C)c1 ZINC000610581559 1083207278 /nfs/dbraw/zinc/20/72/78/1083207278.db2.gz SQQDEHRUVINTRP-UHFFFAOYSA-N 1 1 369.421 4.403 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCCCC[C@H]3c3ccncc3)nc2c1 ZINC000610581228 1083210064 /nfs/dbraw/zinc/21/00/64/1083210064.db2.gz TWUNXUVWVFYOPD-KRWDZBQOSA-N 1 1 352.394 4.248 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCCC[C@H]3c3ccncc3)nc2c1 ZINC000610581228 1083210069 /nfs/dbraw/zinc/21/00/69/1083210069.db2.gz TWUNXUVWVFYOPD-KRWDZBQOSA-N 1 1 352.394 4.248 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCS[C@H](c4ccccc4)C3)nc2c1 ZINC000610582185 1083210751 /nfs/dbraw/zinc/21/07/51/1083210751.db2.gz RDQSUHSSADQJGI-KRWDZBQOSA-N 1 1 355.419 4.026 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCS[C@H](c4ccccc4)C3)nc2c1 ZINC000610582185 1083210756 /nfs/dbraw/zinc/21/07/56/1083210756.db2.gz RDQSUHSSADQJGI-KRWDZBQOSA-N 1 1 355.419 4.026 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430941356 1083244590 /nfs/dbraw/zinc/24/45/90/1083244590.db2.gz WAXOMFYPGICAMG-IEBWSBKVSA-N 1 1 354.450 4.380 20 5 FIBDMO CC(C)[C@H]1c2ccccc2CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610788002 1083518600 /nfs/dbraw/zinc/51/86/00/1083518600.db2.gz DKPRPWRDHNKCNW-FQEVSTJZSA-N 1 1 368.433 4.217 20 5 FIBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001167496452 1083527891 /nfs/dbraw/zinc/52/78/91/1083527891.db2.gz MBRADGCRQLZHDN-TZMCWYRMSA-N 1 1 373.316 4.463 20 5 FIBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001167496448 1083530316 /nfs/dbraw/zinc/53/03/16/1083530316.db2.gz MBRADGCRQLZHDN-JSGCOSHPSA-N 1 1 373.316 4.463 20 5 FIBDMO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000179704256 1083607225 /nfs/dbraw/zinc/60/72/25/1083607225.db2.gz YTDZKCHLAMQEPT-GOSISDBHSA-N 1 1 368.462 4.394 20 5 FIBDMO Cn1cccc1[C@H]1CCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000179704256 1083607236 /nfs/dbraw/zinc/60/72/36/1083607236.db2.gz YTDZKCHLAMQEPT-GOSISDBHSA-N 1 1 368.462 4.394 20 5 FIBDMO O=C(c1ccccc1)C1CC[NH+](CC=Cc2ccccc2[N+](=O)[O-])CC1 ZINC000179878246 1083792454 /nfs/dbraw/zinc/79/24/54/1083792454.db2.gz IMBBNSDXXGFFRT-UXBLZVDNSA-N 1 1 350.418 4.203 20 5 FIBDMO COc1ccc(C[N@@H+]2CC[C@](C)(F)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000535842687 1083799166 /nfs/dbraw/zinc/79/91/66/1083799166.db2.gz KYQIBPKKQPVEGY-FQEVSTJZSA-N 1 1 374.412 4.116 20 5 FIBDMO COc1ccc(C[N@H+]2CC[C@](C)(F)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000535842687 1083799171 /nfs/dbraw/zinc/79/91/71/1083799171.db2.gz KYQIBPKKQPVEGY-FQEVSTJZSA-N 1 1 374.412 4.116 20 5 FIBDMO C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548933641 1083844627 /nfs/dbraw/zinc/84/46/27/1083844627.db2.gz IMIAIWKFSXGDLC-OAHLLOKOSA-N 1 1 351.406 4.485 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000612578851 1083924917 /nfs/dbraw/zinc/92/49/17/1083924917.db2.gz XATIFXQHMIYBDN-RYUDHWBXSA-N 1 1 356.266 4.076 20 5 FIBDMO CCC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180004016 1083989283 /nfs/dbraw/zinc/98/92/83/1083989283.db2.gz DDMSTIAELJUUQV-INIZCTEOSA-N 1 1 357.454 4.019 20 5 FIBDMO C[C@H](N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000380523404 1084045351 /nfs/dbraw/zinc/04/53/51/1084045351.db2.gz CMAKKJQSTIGNCL-RCVZYCBYSA-N 1 1 365.477 4.156 20 5 FIBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc(OC)c1OC ZINC000123380409 1084072743 /nfs/dbraw/zinc/07/27/43/1084072743.db2.gz RFFNVUDUQSRQSF-UHFFFAOYSA-N 1 1 374.437 4.031 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1ccco1)Cc1cccs1 ZINC000071949011 1084372193 /nfs/dbraw/zinc/37/21/93/1084372193.db2.gz WNIKNCOIMYVIBQ-UHFFFAOYSA-N 1 1 358.419 4.331 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1ccco1)Cc1cccs1 ZINC000071949011 1084372209 /nfs/dbraw/zinc/37/22/09/1084372209.db2.gz WNIKNCOIMYVIBQ-UHFFFAOYSA-N 1 1 358.419 4.331 20 5 FIBDMO Cc1c(C[N@H+]2CCCN(Cc3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000071950145 1084382241 /nfs/dbraw/zinc/38/22/41/1084382241.db2.gz IQUFWNFEOBBIFU-UHFFFAOYSA-N 1 1 373.884 4.265 20 5 FIBDMO Cc1c(CN2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000071950145 1084382255 /nfs/dbraw/zinc/38/22/55/1084382255.db2.gz IQUFWNFEOBBIFU-UHFFFAOYSA-N 1 1 373.884 4.265 20 5 FIBDMO Cc1c(CN2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)cccc1[N+](=O)[O-] ZINC000071950145 1084382269 /nfs/dbraw/zinc/38/22/69/1084382269.db2.gz IQUFWNFEOBBIFU-UHFFFAOYSA-N 1 1 373.884 4.265 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC(OCC3CC3)CC2)c1 ZINC000580469003 1084432441 /nfs/dbraw/zinc/43/24/41/1084432441.db2.gz HAMAJXKIFWYDPK-UHFFFAOYSA-N 1 1 358.360 4.005 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2ccc(F)cc2)n1 ZINC000511073657 1084614202 /nfs/dbraw/zinc/61/42/02/1084614202.db2.gz PYJOBOKWQFRYGI-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2ccc(F)cc2)n1 ZINC000511073657 1084614210 /nfs/dbraw/zinc/61/42/10/1084614210.db2.gz PYJOBOKWQFRYGI-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)c2cccnc12 ZINC000511073290 1084621772 /nfs/dbraw/zinc/62/17/72/1084621772.db2.gz KCLVJSIIRCRFSF-UHFFFAOYSA-N 1 1 355.825 4.471 20 5 FIBDMO C[C@@H](NCc1ccc(C[NH+]2CCCCC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000119890336 1084689190 /nfs/dbraw/zinc/68/91/90/1084689190.db2.gz YNWMJUCFCYOMAC-QGZVFWFLSA-N 1 1 353.466 4.432 20 5 FIBDMO Cc1ccccc1-c1noc([C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000511092482 1084767719 /nfs/dbraw/zinc/76/77/19/1084767719.db2.gz ABHUVVCKEMUAQL-OAHLLOKOSA-N 1 1 366.421 4.189 20 5 FIBDMO Cc1ccccc1-c1noc([C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000511092482 1084767723 /nfs/dbraw/zinc/76/77/23/1084767723.db2.gz ABHUVVCKEMUAQL-OAHLLOKOSA-N 1 1 366.421 4.189 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H]([NH2+]Cc2cccc3c2OCO3)c2ccccc2)c1 ZINC000180191580 1084846918 /nfs/dbraw/zinc/84/69/18/1084846918.db2.gz FOPNKEFGLYAMAH-FQEVSTJZSA-N 1 1 362.385 4.203 20 5 FIBDMO C[C@@]1(Cc2ccccc2)CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613502792 1084852930 /nfs/dbraw/zinc/85/29/30/1084852930.db2.gz CTHARMATHOKQQD-FQEVSTJZSA-N 1 1 351.406 4.333 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000170906041 1084978756 /nfs/dbraw/zinc/97/87/56/1084978756.db2.gz RBHQEYPCJTUYKR-OAHLLOKOSA-N 1 1 351.406 4.485 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](OC(F)F)C2)o1 ZINC000611609460 1085513893 /nfs/dbraw/zinc/51/38/93/1085513893.db2.gz JFXLFNUHWIFFQQ-GFCCVEGCSA-N 1 1 352.337 4.058 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@H](OCC3CC3)C2)c1 ZINC000549556633 1085705786 /nfs/dbraw/zinc/70/57/86/1085705786.db2.gz ZXCOFXKNAVVBBM-HNNXBMFYSA-N 1 1 358.360 4.005 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H](OCC3CC3)C2)c1 ZINC000549556633 1085705795 /nfs/dbraw/zinc/70/57/95/1085705795.db2.gz ZXCOFXKNAVVBBM-HNNXBMFYSA-N 1 1 358.360 4.005 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(SC)c(F)c1 ZINC000178729138 1085965978 /nfs/dbraw/zinc/96/59/78/1085965978.db2.gz ZUQVAQNBUMFSOT-LLVKDONJSA-N 1 1 350.415 4.315 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC001167658699 1086388115 /nfs/dbraw/zinc/38/81/15/1086388115.db2.gz KNOOCNRQBQROTO-INIZCTEOSA-N 1 1 363.477 4.210 20 5 FIBDMO CC[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nnc2n1CCCCC2 ZINC000278873790 1086503121 /nfs/dbraw/zinc/50/31/21/1086503121.db2.gz XHZLARAHZYNKNR-QZTJIDSGSA-N 1 1 369.469 4.031 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000708585551 1087629191 /nfs/dbraw/zinc/62/91/91/1087629191.db2.gz HBSRQXWKLVEXOT-MAUKXSAKSA-N 1 1 373.884 4.106 20 5 FIBDMO COc1ccc(F)cc1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000189201562 1088456593 /nfs/dbraw/zinc/45/65/93/1088456593.db2.gz WUNZVXPKVWGLMC-UHFFFAOYSA-N 1 1 356.353 4.292 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000181411049 1088459453 /nfs/dbraw/zinc/45/94/53/1088459453.db2.gz HVXIZRIIIRCMLQ-ZDUSSCGKSA-N 1 1 373.840 4.226 20 5 FIBDMO COc1cnccc1[C@@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189567005 1088493004 /nfs/dbraw/zinc/49/30/04/1088493004.db2.gz JKVNSFYVVWVRCQ-CYBMUJFWSA-N 1 1 353.378 4.109 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCOC[C@H](C3CCC3)C2)o1 ZINC000430121207 1088994820 /nfs/dbraw/zinc/99/48/20/1088994820.db2.gz GJCAARXODHFUIP-MRXNPFEDSA-N 1 1 356.422 4.103 20 5 FIBDMO O=C(c1ccc(F)cc1)C1CC[NH+](CC=Cc2ccccc2[N+](=O)[O-])CC1 ZINC000435054666 1089243639 /nfs/dbraw/zinc/24/36/39/1089243639.db2.gz DZTFJTWKLYOPEA-HYXAFXHYSA-N 1 1 368.408 4.342 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Br)nc1 ZINC000290632929 1090152513 /nfs/dbraw/zinc/15/25/13/1090152513.db2.gz JBZOLODWMWZPMV-GHMZBOCLSA-N 1 1 350.216 4.164 20 5 FIBDMO Cc1ccc([C@H](CC(=O)OC(C)C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000541203819 1090236030 /nfs/dbraw/zinc/23/60/30/1090236030.db2.gz GWZRHJDNJNERQN-IBGZPJMESA-N 1 1 374.412 4.215 20 5 FIBDMO CCCO[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000549426530 1090343731 /nfs/dbraw/zinc/34/37/31/1090343731.db2.gz UWSGKIHAIIZYBG-HNNXBMFYSA-N 1 1 360.376 4.395 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CC[C@H]2c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000511622822 1090855064 /nfs/dbraw/zinc/85/50/64/1090855064.db2.gz LRJMPVKUTJVTFA-SFHVURJKSA-N 1 1 373.840 4.332 20 5 FIBDMO O=C(CC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000500070172 1091019434 /nfs/dbraw/zinc/01/94/34/1091019434.db2.gz OAUDOWWDACGLPQ-GOSISDBHSA-N 1 1 371.412 4.290 20 5 FIBDMO C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(F)c1 ZINC000500120486 1091052270 /nfs/dbraw/zinc/05/22/70/1091052270.db2.gz XSNWPMSPAQRCGL-XOBRGWDASA-N 1 1 371.412 4.146 20 5 FIBDMO O=C(CC[N@@H+](C1CC1)[C@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000500138433 1091063746 /nfs/dbraw/zinc/06/37/46/1091063746.db2.gz LNVZKKNBGIWVSN-IBGZPJMESA-N 1 1 365.433 4.075 20 5 FIBDMO CC(=O)c1ccc(N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000053580484 1091204105 /nfs/dbraw/zinc/20/41/05/1091204105.db2.gz XVYFNEZWRCHHDQ-KSSFIOAISA-N 1 1 353.422 4.045 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@]3(CC=CCC3)C2)cccc1[N+](=O)[O-] ZINC000512213588 1091917642 /nfs/dbraw/zinc/91/76/42/1091917642.db2.gz ODHCDCKRBCFTSI-JXFKEZNVSA-N 1 1 357.454 4.053 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512291896 1092014317 /nfs/dbraw/zinc/01/43/17/1092014317.db2.gz MRJNOKYWEUVXJG-INIZCTEOSA-N 1 1 367.449 4.457 20 5 FIBDMO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000073987580 1092233312 /nfs/dbraw/zinc/23/33/12/1092233312.db2.gz FMLXVAXWOZCWIQ-CYBMUJFWSA-N 1 1 368.389 4.401 20 5 FIBDMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000073987580 1092233325 /nfs/dbraw/zinc/23/33/25/1092233325.db2.gz FMLXVAXWOZCWIQ-CYBMUJFWSA-N 1 1 368.389 4.401 20 5 FIBDMO Cc1c(C(=O)Nc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)cccc1[N+](=O)[O-] ZINC000500744812 1092482642 /nfs/dbraw/zinc/48/26/42/1092482642.db2.gz FEGWJILVQQUXMF-OAHLLOKOSA-N 1 1 367.449 4.387 20 5 FIBDMO CCc1ccc(C(=O)Nc2ccc(Cl)c(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000500785254 1092573973 /nfs/dbraw/zinc/57/39/73/1092573973.db2.gz FWZBCKKVUPZSDH-UHFFFAOYSA-N 1 1 361.829 4.125 20 5 FIBDMO CCc1ccc(C[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000015442605 1092621450 /nfs/dbraw/zinc/62/14/50/1092621450.db2.gz MDXKPQSDFNFVEH-AWEZNQCLSA-N 1 1 366.421 4.400 20 5 FIBDMO CCc1ccc(C[N@@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000015442605 1092621451 /nfs/dbraw/zinc/62/14/51/1092621451.db2.gz MDXKPQSDFNFVEH-AWEZNQCLSA-N 1 1 366.421 4.400 20 5 FIBDMO COc1cccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1OC(C)C ZINC000549808087 1092797060 /nfs/dbraw/zinc/79/70/60/1092797060.db2.gz JGDNULYGNQKPQV-UHFFFAOYSA-N 1 1 358.438 4.065 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(OC(F)F)c(F)c1 ZINC000549806643 1092808622 /nfs/dbraw/zinc/80/86/22/1092808622.db2.gz WXDRSKYBWJZJLP-UHFFFAOYSA-N 1 1 354.328 4.010 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@H](c4ccccc4F)C3)co2)cc1 ZINC000549813927 1092832406 /nfs/dbraw/zinc/83/24/06/1092832406.db2.gz VHRZSGHYGNXTDO-HNNXBMFYSA-N 1 1 367.380 4.378 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1 ZINC001167911065 1092858888 /nfs/dbraw/zinc/85/88/88/1092858888.db2.gz AIZZDNMLFOMLGL-KRWDZBQOSA-N 1 1 365.433 4.335 20 5 FIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCCc2cccnc21 ZINC000614215629 1093207896 /nfs/dbraw/zinc/20/78/96/1093207896.db2.gz NMUZSEWMYKJSEM-KRWDZBQOSA-N 1 1 366.421 4.421 20 5 FIBDMO CN(C)Cc1cc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)ccc1F ZINC000433118198 1093277808 /nfs/dbraw/zinc/27/78/08/1093277808.db2.gz RETGRCWXTDTVQJ-HXUWFJFHSA-N 1 1 371.456 4.308 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)cc1 ZINC000474233490 1093602870 /nfs/dbraw/zinc/60/28/70/1093602870.db2.gz QQLXSQUMVBSUEQ-SFHVURJKSA-N 1 1 367.405 4.342 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)cc1 ZINC000474233490 1093602875 /nfs/dbraw/zinc/60/28/75/1093602875.db2.gz QQLXSQUMVBSUEQ-SFHVURJKSA-N 1 1 367.405 4.342 20 5 FIBDMO Cc1cccc(C[N@@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1C ZINC000428754041 1093637099 /nfs/dbraw/zinc/63/70/99/1093637099.db2.gz SCYSRJOBDGFYKF-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1cccc(C[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1C ZINC000428754041 1093637102 /nfs/dbraw/zinc/63/71/02/1093637102.db2.gz SCYSRJOBDGFYKF-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(Br)cs1 ZINC000404138634 1093772142 /nfs/dbraw/zinc/77/21/42/1093772142.db2.gz FTFNPAKFZWSHRI-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473512389 1093905720 /nfs/dbraw/zinc/90/57/20/1093905720.db2.gz HSSHTZPEROQQEL-SJORKVTESA-N 1 1 368.481 4.234 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](n4cccn4)C3)s2)cc1 ZINC000513150882 1093908145 /nfs/dbraw/zinc/90/81/45/1093908145.db2.gz SUQAZDZKQGSTOX-QGZVFWFLSA-N 1 1 368.462 4.357 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000513247244 1094028922 /nfs/dbraw/zinc/02/89/22/1094028922.db2.gz LWMQJUNXRNVZTQ-ACJLOTCBSA-N 1 1 373.840 4.270 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000513247244 1094028927 /nfs/dbraw/zinc/02/89/27/1094028927.db2.gz LWMQJUNXRNVZTQ-ACJLOTCBSA-N 1 1 373.840 4.270 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000513267014 1094041015 /nfs/dbraw/zinc/04/10/15/1094041015.db2.gz NJFIHXJWOODKLH-FOIQADDNSA-N 1 1 367.449 4.315 20 5 FIBDMO COc1ccccc1O[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000513367749 1094083048 /nfs/dbraw/zinc/08/30/48/1094083048.db2.gz RLBSUETUUNWFKO-MAUKXSAKSA-N 1 1 356.422 4.208 20 5 FIBDMO C[C@@H]1C[C@@H](CC[NH2+]Cc2csc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000513545574 1094205836 /nfs/dbraw/zinc/20/58/36/1094205836.db2.gz RIIGZUUCJZLXTO-NVXWUHKLSA-N 1 1 359.495 4.047 20 5 FIBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501051684 1094457389 /nfs/dbraw/zinc/45/73/89/1094457389.db2.gz FBQWUXYRKRQWLK-OAQYLSRUSA-N 1 1 367.449 4.021 20 5 FIBDMO C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000237391126 1094607514 /nfs/dbraw/zinc/60/75/14/1094607514.db2.gz SKKHSOKUGDFMOH-OQHXTRMZSA-N 1 1 368.368 4.148 20 5 FIBDMO COc1cc(C)c(C[N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000522536368 1095119768 /nfs/dbraw/zinc/11/97/68/1095119768.db2.gz NJGCYFFNSQNUKQ-UHFFFAOYSA-N 1 1 364.829 4.206 20 5 FIBDMO COc1cc(C)c(C[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])cc1OC ZINC000522536368 1095119772 /nfs/dbraw/zinc/11/97/72/1095119772.db2.gz NJGCYFFNSQNUKQ-UHFFFAOYSA-N 1 1 364.829 4.206 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)cn1 ZINC000281318330 1095526227 /nfs/dbraw/zinc/52/62/27/1095526227.db2.gz ZQKMRTDGSMXQHW-NEPJUHHUSA-N 1 1 364.243 4.473 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1OC(F)F ZINC000016420002 1095634919 /nfs/dbraw/zinc/63/49/19/1095634919.db2.gz PVGSAQUTGOBIIW-GFCCVEGCSA-N 1 1 366.364 4.398 20 5 FIBDMO CCCCN1CCC([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000513790470 1096435665 /nfs/dbraw/zinc/43/56/65/1096435665.db2.gz YKRSDVXULWEMLW-PXNSSMCTSA-N 1 1 359.514 4.160 20 5 FIBDMO CC(C)C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000532932926 1098606675 /nfs/dbraw/zinc/60/66/75/1098606675.db2.gz IQXPTMAXCROHMD-UHFFFAOYSA-N 1 1 366.421 4.303 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c1 ZINC000533100556 1098761313 /nfs/dbraw/zinc/76/13/13/1098761313.db2.gz JPSAWOSONSUWIU-CQSZACIVSA-N 1 1 355.369 4.255 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1OC ZINC000533250726 1098911881 /nfs/dbraw/zinc/91/18/81/1098911881.db2.gz KQYNCOFBIRZFRX-HNNXBMFYSA-N 1 1 371.437 4.015 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1OC ZINC000533250726 1098911883 /nfs/dbraw/zinc/91/18/83/1098911883.db2.gz KQYNCOFBIRZFRX-HNNXBMFYSA-N 1 1 371.437 4.015 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+](Cc2ccccc2F)C(C)C)cccc1[N+](=O)[O-] ZINC000533250471 1098912451 /nfs/dbraw/zinc/91/24/51/1098912451.db2.gz MQUACRVOJHDCGU-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000533303368 1098955271 /nfs/dbraw/zinc/95/52/71/1098955271.db2.gz RIKOFMFWADKGLF-ZFWWWQNUSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000533303368 1098955275 /nfs/dbraw/zinc/95/52/75/1098955275.db2.gz RIKOFMFWADKGLF-ZFWWWQNUSA-N 1 1 373.840 4.065 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000436394254 1098984649 /nfs/dbraw/zinc/98/46/49/1098984649.db2.gz VUXRHNDMNOHPBS-QGZVFWFLSA-N 1 1 374.485 4.130 20 5 FIBDMO C[C@H](c1ccc(F)c(Cl)c1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000533380295 1098995904 /nfs/dbraw/zinc/99/59/04/1098995904.db2.gz HUDQYWZKFZPFND-DGCLKSJQSA-N 1 1 364.808 4.030 20 5 FIBDMO C[C@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000533380295 1098995913 /nfs/dbraw/zinc/99/59/13/1098995913.db2.gz HUDQYWZKFZPFND-DGCLKSJQSA-N 1 1 364.808 4.030 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000505845044 1099110179 /nfs/dbraw/zinc/11/01/79/1099110179.db2.gz JWCDSAVNYNXWQY-SIKDUDHDSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000505845044 1099110184 /nfs/dbraw/zinc/11/01/84/1099110184.db2.gz JWCDSAVNYNXWQY-SIKDUDHDSA-N 1 1 365.433 4.020 20 5 FIBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1[C@@H]1CCCO1 ZINC000516357246 1099408141 /nfs/dbraw/zinc/40/81/41/1099408141.db2.gz TZNNOCNOJBFYSX-OALUTQOASA-N 1 1 356.422 4.244 20 5 FIBDMO CC(C)[C@@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000536670263 1100151972 /nfs/dbraw/zinc/15/19/72/1100151972.db2.gz OQSULDXYZHFRDK-INIZCTEOSA-N 1 1 363.508 4.292 20 5 FIBDMO CC(C)[C@@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000536670263 1100151984 /nfs/dbraw/zinc/15/19/84/1100151984.db2.gz OQSULDXYZHFRDK-INIZCTEOSA-N 1 1 363.508 4.292 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)s1 ZINC000536692323 1100188933 /nfs/dbraw/zinc/18/89/33/1100188933.db2.gz DMESMSODKKHNIO-CABCVRRESA-N 1 1 358.463 4.182 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000459650296 1100393488 /nfs/dbraw/zinc/39/34/88/1100393488.db2.gz XLLPIRSQQQPIQC-XJKSGUPXSA-N 1 1 372.387 4.337 20 5 FIBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518263607 1101048748 /nfs/dbraw/zinc/04/87/48/1101048748.db2.gz YWQMYBDFNYSNFW-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CN1CCC[C@H](C)C1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518263607 1101048750 /nfs/dbraw/zinc/04/87/50/1101048750.db2.gz YWQMYBDFNYSNFW-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO CCOC[C@H]1CCCC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000459667905 1101305969 /nfs/dbraw/zinc/30/59/69/1101305969.db2.gz AUBWENFJKSOSHY-QGZVFWFLSA-N 1 1 361.467 4.109 20 5 FIBDMO CCOC[C@H]1CCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000459667905 1101305986 /nfs/dbraw/zinc/30/59/86/1101305986.db2.gz AUBWENFJKSOSHY-QGZVFWFLSA-N 1 1 361.467 4.109 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2cc3cccc(F)c3o2)c([N+](=O)[O-])cc1F ZINC000475706226 1101387198 /nfs/dbraw/zinc/38/71/98/1101387198.db2.gz WKUUFTLFYHSMCK-JTQLQIEISA-N 1 1 362.332 4.479 20 5 FIBDMO COc1cc(C[N@H+](C)C/C(C)=C/c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000426374913 1101411688 /nfs/dbraw/zinc/41/16/88/1101411688.db2.gz YUDHDEHMUIFNSI-XNTDXEJSSA-N 1 1 356.422 4.147 20 5 FIBDMO COc1cc(C[N@@H+](C)C/C(C)=C/c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000426374913 1101411699 /nfs/dbraw/zinc/41/16/99/1101411699.db2.gz YUDHDEHMUIFNSI-XNTDXEJSSA-N 1 1 356.422 4.147 20 5 FIBDMO C[C@H](c1ccc(Cl)cc1)[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CC1 ZINC000054396730 1101870910 /nfs/dbraw/zinc/87/09/10/1101870910.db2.gz CQOVHRZJHFXQMF-GFCCVEGCSA-N 1 1 373.840 4.073 20 5 FIBDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CC1 ZINC000054396730 1101870925 /nfs/dbraw/zinc/87/09/25/1101870925.db2.gz CQOVHRZJHFXQMF-GFCCVEGCSA-N 1 1 373.840 4.073 20 5 FIBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H](C)C(=O)Nc1ccccc1C ZINC000426532802 1101909601 /nfs/dbraw/zinc/90/96/01/1101909601.db2.gz YIVISLOWKDQFIN-QGZVFWFLSA-N 1 1 369.465 4.451 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H](C)C(=O)Nc1ccccc1C ZINC000426532802 1101909606 /nfs/dbraw/zinc/90/96/06/1101909606.db2.gz YIVISLOWKDQFIN-QGZVFWFLSA-N 1 1 369.465 4.451 20 5 FIBDMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc2ccccc2c1 ZINC000026250367 1102299460 /nfs/dbraw/zinc/29/94/60/1102299460.db2.gz MLRQZYOOYHXAHA-UHFFFAOYSA-N 1 1 363.417 4.209 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@H](C(F)(F)F)C3)o2)c1 ZINC000170905744 1102306607 /nfs/dbraw/zinc/30/66/07/1102306607.db2.gz UWYVYJMRHSFLRJ-CYBMUJFWSA-N 1 1 369.343 4.067 20 5 FIBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccn1 ZINC000532475167 1102402479 /nfs/dbraw/zinc/40/24/79/1102402479.db2.gz JVHUBQKUPASYCR-UHFFFAOYSA-N 1 1 366.421 4.098 20 5 FIBDMO CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000171128076 1102407213 /nfs/dbraw/zinc/40/72/13/1102407213.db2.gz BKDMDBWPPVZNCG-AWEZNQCLSA-N 1 1 372.421 4.099 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000532485563 1102426690 /nfs/dbraw/zinc/42/66/90/1102426690.db2.gz ZFMXOCUDZMSCQW-AZUAARDMSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000532485563 1102426698 /nfs/dbraw/zinc/42/66/98/1102426698.db2.gz ZFMXOCUDZMSCQW-AZUAARDMSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000532485563 1102426705 /nfs/dbraw/zinc/42/67/05/1102426705.db2.gz ZFMXOCUDZMSCQW-AZUAARDMSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000053232769 1102542171 /nfs/dbraw/zinc/54/21/71/1102542171.db2.gz OOUFTJATCKBGQT-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000053232769 1102542177 /nfs/dbraw/zinc/54/21/77/1102542177.db2.gz OOUFTJATCKBGQT-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000121880384 1102752481 /nfs/dbraw/zinc/75/24/81/1102752481.db2.gz HSZWNOYHNKSJCE-ZDUSSCGKSA-N 1 1 371.828 4.022 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000506944004 1102985867 /nfs/dbraw/zinc/98/58/67/1102985867.db2.gz KDBKSXBNDMIUPS-GUTXKFCHSA-N 1 1 371.403 4.455 20 5 FIBDMO Cc1ccccc1[C@@H](C)[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC(C)C ZINC000551423826 1103207011 /nfs/dbraw/zinc/20/70/11/1103207011.db2.gz OZWJHMSLNMJUMX-MRXNPFEDSA-N 1 1 369.465 4.221 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@@H](C)C(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000507246142 1103247852 /nfs/dbraw/zinc/24/78/52/1103247852.db2.gz GXOSOIDQQMMFAI-NSHDSACASA-N 1 1 364.364 4.021 20 5 FIBDMO COc1cccc([C@H](C)[NH+]2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000507750425 1104731439 /nfs/dbraw/zinc/73/14/39/1104731439.db2.gz WSEGSVVZVZVMBL-IRXDYDNUSA-N 1 1 369.465 4.043 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000248408608 1104868012 /nfs/dbraw/zinc/86/80/12/1104868012.db2.gz CEPJUHIPPGBYCA-SWLSCSKDSA-N 1 1 368.359 4.208 20 5 FIBDMO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CCO2 ZINC000184663165 1104937917 /nfs/dbraw/zinc/93/79/17/1104937917.db2.gz CQSZMIZUESWPCW-QGZVFWFLSA-N 1 1 362.813 4.260 20 5 FIBDMO O=c1[nH]c2ccccc2cc1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543508 1107161257 /nfs/dbraw/zinc/16/12/57/1107161257.db2.gz CDRBMOIWSXVWGV-KRWDZBQOSA-N 1 1 363.417 4.228 20 5 FIBDMO CCCCc1noc([C@@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548486 1107168233 /nfs/dbraw/zinc/16/82/33/1107168233.db2.gz NSMFHUQYSMTGOB-GDBMZVCRSA-N 1 1 358.442 4.261 20 5 FIBDMO CCCCc1noc([C@@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548486 1107168239 /nfs/dbraw/zinc/16/82/39/1107168239.db2.gz NSMFHUQYSMTGOB-GDBMZVCRSA-N 1 1 358.442 4.261 20 5 FIBDMO Cc1ccccc1NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548443 1107168451 /nfs/dbraw/zinc/16/84/51/1107168451.db2.gz NGJKDNWLUPQIER-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccccc1NC(=O)[C@@H](C)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548443 1107168453 /nfs/dbraw/zinc/16/84/53/1107168453.db2.gz NGJKDNWLUPQIER-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3nc(-c4ccccc4)no3)C2)cc1 ZINC000451569213 1107184769 /nfs/dbraw/zinc/18/47/69/1107184769.db2.gz OJOWWCNBSZJBCZ-KRWDZBQOSA-N 1 1 364.405 4.024 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc(-c4ccccc4)no3)C2)cc1 ZINC000451569213 1107184775 /nfs/dbraw/zinc/18/47/75/1107184775.db2.gz OJOWWCNBSZJBCZ-KRWDZBQOSA-N 1 1 364.405 4.024 20 5 FIBDMO C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1c1cccc(F)c1 ZINC000531104748 1107535970 /nfs/dbraw/zinc/53/59/70/1107535970.db2.gz UYGSNDBOHLYKLA-DJJJIMSYSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1c1cccc(F)c1 ZINC000531104748 1107535988 /nfs/dbraw/zinc/53/59/88/1107535988.db2.gz UYGSNDBOHLYKLA-DJJJIMSYSA-N 1 1 372.396 4.184 20 5 FIBDMO Cc1ccccc1C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000520168871 1107934081 /nfs/dbraw/zinc/93/40/81/1107934081.db2.gz CQDVRHTYWNVKNZ-UHFFFAOYSA-N 1 1 364.405 4.118 20 5 FIBDMO Cc1ccccc1C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000520168871 1107934088 /nfs/dbraw/zinc/93/40/88/1107934088.db2.gz CQDVRHTYWNVKNZ-UHFFFAOYSA-N 1 1 364.405 4.118 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCC[N@H+]1CC1CCCCC1 ZINC000520240970 1108117581 /nfs/dbraw/zinc/11/75/81/1108117581.db2.gz YGJPOUBNGSEVCR-GOSISDBHSA-N 1 1 374.485 4.069 20 5 FIBDMO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000519920675 1108297585 /nfs/dbraw/zinc/29/75/85/1108297585.db2.gz VIAGLXAUDRAACM-SFHVURJKSA-N 1 1 367.449 4.062 20 5 FIBDMO O=[N+]([O-])c1cc(CN2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)cs1 ZINC000532243780 1108733641 /nfs/dbraw/zinc/73/36/41/1108733641.db2.gz GOVVADQDHADGBF-MOPGFXCFSA-N 1 1 371.506 4.143 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000524036592 1108766819 /nfs/dbraw/zinc/76/68/19/1108766819.db2.gz DYVUKQFVJBRSEN-LIRRHRJNSA-N 1 1 358.463 4.282 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@@H](C)[C@H]1c1ccccc1 ZINC000524036592 1108766827 /nfs/dbraw/zinc/76/68/27/1108766827.db2.gz DYVUKQFVJBRSEN-LIRRHRJNSA-N 1 1 358.463 4.282 20 5 FIBDMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)o1 ZINC000524752948 1109138298 /nfs/dbraw/zinc/13/82/98/1109138298.db2.gz MEELWDUPZIFESX-UGSOOPFHSA-N 1 1 372.421 4.336 20 5 FIBDMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)o1 ZINC000524752948 1109138302 /nfs/dbraw/zinc/13/83/02/1109138302.db2.gz MEELWDUPZIFESX-UGSOOPFHSA-N 1 1 372.421 4.336 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000446500109 1109248660 /nfs/dbraw/zinc/24/86/60/1109248660.db2.gz VLRSNDLDWMBIEX-UHFFFAOYSA-N 1 1 374.485 4.023 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1C ZINC000525121585 1109269422 /nfs/dbraw/zinc/26/94/22/1109269422.db2.gz UNOXFXZZUYFOLA-HXUWFJFHSA-N 1 1 368.433 4.415 20 5 FIBDMO Cc1cc2cc(C[NH2+]Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)oc2cc1C ZINC000446835722 1109356425 /nfs/dbraw/zinc/35/64/25/1109356425.db2.gz PUNBGDDBANDXLW-UHFFFAOYSA-N 1 1 350.378 4.124 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccccc3OC3CCCC3)nc2c1 ZINC000446845851 1109363422 /nfs/dbraw/zinc/36/34/22/1109363422.db2.gz RXMUWAJBXXQNGN-UHFFFAOYSA-N 1 1 366.421 4.082 20 5 FIBDMO CCCC[N@@H+](CC)Cc1cccc(CNC(=O)c2ccccc2[N+](=O)[O-])c1 ZINC000447271331 1109493024 /nfs/dbraw/zinc/49/30/24/1109493024.db2.gz NFXBSHUZPKCBQS-UHFFFAOYSA-N 1 1 369.465 4.147 20 5 FIBDMO CC[C@H]([NH2+]Cc1ccn(-c2ccc(OC)cc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000121725882 1109512264 /nfs/dbraw/zinc/51/22/64/1109512264.db2.gz HPDDOBKICJZHDF-FQEVSTJZSA-N 1 1 366.421 4.030 20 5 FIBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCc2ccccc21 ZINC000508592726 1109524402 /nfs/dbraw/zinc/52/44/02/1109524402.db2.gz BOIBBRISSDIHOB-HXUWFJFHSA-N 1 1 368.433 4.361 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cn3cc(Cl)ccc3n1)CCC2 ZINC000447538675 1109571458 /nfs/dbraw/zinc/57/14/58/1109571458.db2.gz CJEOBMDLBHPWFW-QGZVFWFLSA-N 1 1 356.813 4.063 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc(OC(F)(F)F)cc3)CC2)c(F)c1 ZINC000449368004 1110045086 /nfs/dbraw/zinc/04/50/86/1110045086.db2.gz BDDJZBFEBREVLW-UHFFFAOYSA-N 1 1 370.302 4.411 20 5 FIBDMO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449563280 1110111431 /nfs/dbraw/zinc/11/14/31/1110111431.db2.gz UAQOWWXBFHYBRM-ZDUSSCGKSA-N 1 1 356.451 4.391 20 5 FIBDMO C[C@@H](Nc1cccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000538589709 1111211857 /nfs/dbraw/zinc/21/18/57/1111211857.db2.gz RJNFLXBAONKLJB-IXDOHACOSA-N 1 1 369.465 4.377 20 5 FIBDMO C[C@@H]1CCCC[C@@H]1CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000552045349 1111556066 /nfs/dbraw/zinc/55/60/66/1111556066.db2.gz DXDCPVVFNHKSFN-GPMSIDNRSA-N 1 1 356.470 4.224 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCC4(CCOCC4)C3)o2)cc1 ZINC000552278160 1111657099 /nfs/dbraw/zinc/65/70/99/1111657099.db2.gz UUTHYGJWKGMTTG-UHFFFAOYSA-N 1 1 356.422 4.247 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000479096582 1111947911 /nfs/dbraw/zinc/94/79/11/1111947911.db2.gz GQAMPMJHZIQBOP-KDOFPFPSSA-N 1 1 364.405 4.023 20 5 FIBDMO CC(=O)c1cc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000553487230 1111987555 /nfs/dbraw/zinc/98/75/55/1111987555.db2.gz OWWMOURIQCTZPW-FOIQADDNSA-N 1 1 367.449 4.120 20 5 FIBDMO CC(=O)c1cc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000553487232 1111987777 /nfs/dbraw/zinc/98/77/77/1111987777.db2.gz OWWMOURIQCTZPW-QRWLVFNGSA-N 1 1 367.449 4.120 20 5 FIBDMO CCC(=O)c1ccc(NC[C@@H](c2ccco2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000479846245 1112167644 /nfs/dbraw/zinc/16/76/44/1112167644.db2.gz BMXXOWPUVYKQRR-KRWDZBQOSA-N 1 1 357.410 4.030 20 5 FIBDMO CC(C)[N@H+](Cc1ccc(Br)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000483172724 1113457400 /nfs/dbraw/zinc/45/74/00/1113457400.db2.gz GDJXKSPHRJFEDO-UHFFFAOYSA-N 1 1 353.216 4.361 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc(Br)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000483172724 1113457401 /nfs/dbraw/zinc/45/74/01/1113457401.db2.gz GDJXKSPHRJFEDO-UHFFFAOYSA-N 1 1 353.216 4.361 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccncc21 ZINC000192954310 1113579558 /nfs/dbraw/zinc/57/95/58/1113579558.db2.gz VESKBPSMYAQYAL-KRWDZBQOSA-N 1 1 362.433 4.077 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnc(Oc3ccccc3F)c2)c(F)c1 ZINC000486786412 1113644341 /nfs/dbraw/zinc/64/43/41/1113644341.db2.gz CJEWWLALHCLURX-UHFFFAOYSA-N 1 1 371.343 4.350 20 5 FIBDMO C[C@H](c1ccc(F)cc1)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000027557515 1113698173 /nfs/dbraw/zinc/69/81/73/1113698173.db2.gz AFMXOWKFHYIMBD-LLVKDONJSA-N 1 1 365.792 4.019 20 5 FIBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000027557515 1113698175 /nfs/dbraw/zinc/69/81/75/1113698175.db2.gz AFMXOWKFHYIMBD-LLVKDONJSA-N 1 1 365.792 4.019 20 5 FIBDMO CC[N@H+](Cc1cccc(Cl)c1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488556564 1113951261 /nfs/dbraw/zinc/95/12/61/1113951261.db2.gz RPLOLRHUTROAFO-CYBMUJFWSA-N 1 1 361.829 4.097 20 5 FIBDMO CC[N@@H+](Cc1cccc(Cl)c1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000488556564 1113951264 /nfs/dbraw/zinc/95/12/64/1113951264.db2.gz RPLOLRHUTROAFO-CYBMUJFWSA-N 1 1 361.829 4.097 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+](Cc2ccco2)C2CCCC2)cccc1[N+](=O)[O-] ZINC000138780343 1114142600 /nfs/dbraw/zinc/14/26/00/1114142600.db2.gz KJMMAXOVTROSEF-UHFFFAOYSA-N 1 1 371.437 4.270 20 5 FIBDMO C[N@H+](Cc1ccccc1)CC1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000489658581 1114151421 /nfs/dbraw/zinc/15/14/21/1114151421.db2.gz KMOJANPYERCXRG-UHFFFAOYSA-N 1 1 359.495 4.000 20 5 FIBDMO Cc1ccc([C@H]2C[C@H](C)[N@H+](CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000490039214 1114206844 /nfs/dbraw/zinc/20/68/44/1114206844.db2.gz JBTIZPKKAHKUIU-WMZOPIPTSA-N 1 1 367.449 4.028 20 5 FIBDMO CC[C@@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CCCC1 ZINC000490171810 1114229694 /nfs/dbraw/zinc/22/96/94/1114229694.db2.gz ILTLODXSYOQTJD-FPOVZHCZSA-N 1 1 353.466 4.148 20 5 FIBDMO O=[N+]([O-])c1cccc([C@H](N[C@@H]2CC[N@H+](C3CCCC3)C2)c2ccccc2)c1 ZINC000491060504 1114368893 /nfs/dbraw/zinc/36/88/93/1114368893.db2.gz ODLKPGXYMVLHPR-DENIHFKCSA-N 1 1 365.477 4.291 20 5 FIBDMO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000164944796 1114657138 /nfs/dbraw/zinc/65/71/38/1114657138.db2.gz KKVBWVUYTZOLOS-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000164944796 1114657139 /nfs/dbraw/zinc/65/71/39/1114657139.db2.gz KKVBWVUYTZOLOS-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO COc1cc(C[NH+]2CC(C3CC3)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000589736771 1114837191 /nfs/dbraw/zinc/83/71/91/1114837191.db2.gz LCGQZZBGMMEOFR-UHFFFAOYSA-N 1 1 368.433 4.024 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000165628890 1114855633 /nfs/dbraw/zinc/85/56/33/1114855633.db2.gz MUCKQRZFVCFEDA-LJQANCHMSA-N 1 1 371.412 4.208 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(F)c(Br)c1 ZINC000590193874 1114905459 /nfs/dbraw/zinc/90/54/59/1114905459.db2.gz WCSCVVYJSFRGHV-SECBINFHSA-N 1 1 371.181 4.486 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)c(Cl)c1 ZINC000590659563 1114960605 /nfs/dbraw/zinc/96/06/05/1114960605.db2.gz YADRDNXOJCLIOH-WBVHZDCISA-N 1 1 350.846 4.029 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccccc1F)[C@H]1CC[C@H](O)CC1 ZINC000592131301 1115205263 /nfs/dbraw/zinc/20/52/63/1115205263.db2.gz WNMJLTAITXOKCM-IYARVYRRSA-N 1 1 358.413 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccccc1F)[C@H]1CC[C@H](O)CC1 ZINC000592131301 1115205264 /nfs/dbraw/zinc/20/52/64/1115205264.db2.gz WNMJLTAITXOKCM-IYARVYRRSA-N 1 1 358.413 4.040 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCC[C@@H](OC4CCC4)C3)cs2)c1 ZINC000594613741 1115470951 /nfs/dbraw/zinc/47/09/51/1115470951.db2.gz SONXHINAUHKEGP-GOSISDBHSA-N 1 1 373.478 4.252 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H](OC4CCC4)C3)cs2)c1 ZINC000594613741 1115470953 /nfs/dbraw/zinc/47/09/53/1115470953.db2.gz SONXHINAUHKEGP-GOSISDBHSA-N 1 1 373.478 4.252 20 5 FIBDMO Cc1cc(Br)c(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000594977991 1115500493 /nfs/dbraw/zinc/50/04/93/1115500493.db2.gz PIMDOBKWSJJNPO-UHFFFAOYSA-N 1 1 355.257 4.325 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1csc(Br)c1 ZINC000595007224 1115507781 /nfs/dbraw/zinc/50/77/81/1115507781.db2.gz KHXVJFSLHNKMOE-VIFPVBQESA-N 1 1 371.256 4.278 20 5 FIBDMO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ncnc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000595064148 1115509036 /nfs/dbraw/zinc/50/90/36/1115509036.db2.gz DPKDFWXYZDDGIN-DYEKYZERSA-N 1 1 369.450 4.271 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccccc1N1CCCCC1 ZINC000595033572 1115510628 /nfs/dbraw/zinc/51/06/28/1115510628.db2.gz NNDZVBOIFJBNQM-MRXNPFEDSA-N 1 1 369.465 4.445 20 5 FIBDMO COC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1ccc(Cl)cc1 ZINC000595050862 1115512181 /nfs/dbraw/zinc/51/21/81/1115512181.db2.gz UUAKKPMWNKWLSH-PXAZEXFGSA-N 1 1 364.829 4.295 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595290287 1115521425 /nfs/dbraw/zinc/52/14/25/1115521425.db2.gz YIHQQPCCTCBURE-INIZCTEOSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595290287 1115521429 /nfs/dbraw/zinc/52/14/29/1115521429.db2.gz YIHQQPCCTCBURE-INIZCTEOSA-N 1 1 360.385 4.088 20 5 FIBDMO CC(C)([NH2+]Cc1cccc(F)c1OC(F)F)c1ccccc1[N+](=O)[O-] ZINC000595512828 1115539594 /nfs/dbraw/zinc/53/95/94/1115539594.db2.gz VWKNMSYRIXSSFO-UHFFFAOYSA-N 1 1 354.328 4.360 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000593110583 1115558093 /nfs/dbraw/zinc/55/80/93/1115558093.db2.gz BJQSKDSSYZONOR-UHFFFAOYSA-N 1 1 366.339 4.401 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595746524 1115561046 /nfs/dbraw/zinc/56/10/46/1115561046.db2.gz BIYDAIYRFRSDKV-IMFGXOCKSA-N 1 1 354.450 4.062 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H]([C@H]4CCCCO4)C3)co2)cc1 ZINC000595787448 1115563203 /nfs/dbraw/zinc/56/32/03/1115563203.db2.gz IXLWUKGFTZCFHL-QFBILLFUSA-N 1 1 371.437 4.031 20 5 FIBDMO Cc1c(C[NH2+][C@H](CO)c2cccc(Cl)c2Cl)cccc1[N+](=O)[O-] ZINC000595828862 1115565454 /nfs/dbraw/zinc/56/54/54/1115565454.db2.gz MCBZLUNBXGQKRO-CQSZACIVSA-N 1 1 355.221 4.033 20 5 FIBDMO Cc1c([C@H](C)[NH2+][C@@H]2CCc3ccccc3-n3ccnc32)cccc1[N+](=O)[O-] ZINC000596095274 1115574531 /nfs/dbraw/zinc/57/45/31/1115574531.db2.gz OOSDZSDTZMQNSG-MAUKXSAKSA-N 1 1 362.433 4.427 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000597217311 1115648789 /nfs/dbraw/zinc/64/87/89/1115648789.db2.gz CCNUMFMZKYYEOH-GRFAERAESA-N 1 1 368.433 4.445 20 5 FIBDMO CCC[C@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1ccccn1 ZINC000602538377 1115709535 /nfs/dbraw/zinc/70/95/35/1115709535.db2.gz KUYHOEIDVDTDEG-LBPRGKRZSA-N 1 1 370.272 4.445 20 5 FIBDMO CC[C@@H]([NH2+][C@H](Cc1ccccc1)c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593723561 1115803704 /nfs/dbraw/zinc/80/37/04/1115803704.db2.gz YKGBYLVCKYYAKA-WOJBJXKFSA-N 1 1 364.449 4.353 20 5 FIBDMO CC[C@H]([NH2+][C@@H](Cc1ccccc1)c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593723558 1115803852 /nfs/dbraw/zinc/80/38/52/1115803852.db2.gz YKGBYLVCKYYAKA-PMACEKPBSA-N 1 1 364.449 4.353 20 5 FIBDMO Cc1c([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2nccn2C)cccc1[N+](=O)[O-] ZINC000593722282 1115804894 /nfs/dbraw/zinc/80/48/94/1115804894.db2.gz MVFKPKAMQOUXOX-VQIMIIECSA-N 1 1 364.449 4.271 20 5 FIBDMO COc1ccc(OC)c(C[N@H+](Cc2cccc([N+](=O)[O-])c2C)C2CC2)c1 ZINC000603837857 1115818379 /nfs/dbraw/zinc/81/83/79/1115818379.db2.gz QOUJWRMRXZCZOU-UHFFFAOYSA-N 1 1 356.422 4.085 20 5 FIBDMO COc1ccc(OC)c(C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C2CC2)c1 ZINC000603837857 1115818386 /nfs/dbraw/zinc/81/83/86/1115818386.db2.gz QOUJWRMRXZCZOU-UHFFFAOYSA-N 1 1 356.422 4.085 20 5 FIBDMO Cc1c(C[N@H+](C)Cc2ccc(Br)s2)cccc1[N+](=O)[O-] ZINC000603844489 1115820533 /nfs/dbraw/zinc/82/05/33/1115820533.db2.gz JUCCSAJOOFMKSF-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO Cc1c(C[N@@H+](C)Cc2ccc(Br)s2)cccc1[N+](=O)[O-] ZINC000603844489 1115820535 /nfs/dbraw/zinc/82/05/35/1115820535.db2.gz JUCCSAJOOFMKSF-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H](CCO)c1cc(Cl)cc(Cl)c1 ZINC000599665233 1115834481 /nfs/dbraw/zinc/83/44/81/1115834481.db2.gz HEVFJZFGJZTLPV-OAHLLOKOSA-N 1 1 355.221 4.115 20 5 FIBDMO COc1ccc(C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000604012533 1115840913 /nfs/dbraw/zinc/84/09/13/1115840913.db2.gz NGQWBNPROOYWSZ-UHFFFAOYSA-N 1 1 356.422 4.037 20 5 FIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000604521401 1115867133 /nfs/dbraw/zinc/86/71/33/1115867133.db2.gz HXOQFKNHUNIWON-NQIIRXRSSA-N 1 1 370.449 4.073 20 5 FIBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000604521753 1115867245 /nfs/dbraw/zinc/86/72/45/1115867245.db2.gz XMOVFQAGRCKMHI-RXVVDRJESA-N 1 1 370.449 4.073 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000604492863 1115867693 /nfs/dbraw/zinc/86/76/93/1115867693.db2.gz KXEQCAQAFIVMBD-GOSISDBHSA-N 1 1 367.449 4.241 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@@H]2c2cccc3c2OCCO3)cccc1[N+](=O)[O-] ZINC000608977561 1116139281 /nfs/dbraw/zinc/13/92/81/1116139281.db2.gz QVUMDPUHKIXQQQ-GOSISDBHSA-N 1 1 354.406 4.012 20 5 FIBDMO C[C@H]1C[C@@H](N(C)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000491228786 1116226078 /nfs/dbraw/zinc/22/60/78/1116226078.db2.gz SHXZGAFUMYAYMG-LPHOPBHVSA-N 1 1 371.456 4.219 20 5 FIBDMO COc1ccc(C[N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1C ZINC000089892824 1116338954 /nfs/dbraw/zinc/33/89/54/1116338954.db2.gz DGVKDUZGUOESGR-UHFFFAOYSA-N 1 1 367.405 4.199 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1C ZINC000089892824 1116338956 /nfs/dbraw/zinc/33/89/56/1116338956.db2.gz DGVKDUZGUOESGR-UHFFFAOYSA-N 1 1 367.405 4.199 20 5 FIBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089907090 1116346994 /nfs/dbraw/zinc/34/69/94/1116346994.db2.gz LJQPJTWXTPTORL-IAGOWNOFSA-N 1 1 361.467 4.356 20 5 FIBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000089909912 1116351860 /nfs/dbraw/zinc/35/18/60/1116351860.db2.gz NFJULJVCPGNJHT-QZTJIDSGSA-N 1 1 371.437 4.029 20 5 FIBDMO COc1ccccc1-c1cc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)on1 ZINC000595103362 1117749024 /nfs/dbraw/zinc/74/90/24/1117749024.db2.gz LZWZFCZTEVMPLS-CQSZACIVSA-N 1 1 367.405 4.418 20 5 FIBDMO Cc1cnc(NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c([N+](=O)[O-])c1 ZINC000463054817 1117949742 /nfs/dbraw/zinc/94/97/42/1117949742.db2.gz HRNDULJJYHTJID-HNNXBMFYSA-N 1 1 354.454 4.142 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cncc(C(F)(F)F)c2)C2CC2)c1 ZINC000463087697 1117961373 /nfs/dbraw/zinc/96/13/73/1117961373.db2.gz AFOUPNCVHSTXDJ-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cncc(C(F)(F)F)c2)C2CC2)c1 ZINC000463087697 1117961374 /nfs/dbraw/zinc/96/13/74/1117961374.db2.gz AFOUPNCVHSTXDJ-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO CC[C@H](NC1CC[NH+](CCc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000463207312 1118021224 /nfs/dbraw/zinc/02/12/24/1118021224.db2.gz RVNYADMCUFYBOD-QFIPXVFZSA-N 1 1 367.493 4.343 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000541022125 1118351253 /nfs/dbraw/zinc/35/12/53/1118351253.db2.gz UGPWYZFAHLWOJV-VFVRVIDISA-N 1 1 365.861 4.087 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000541022125 1118351259 /nfs/dbraw/zinc/35/12/59/1118351259.db2.gz UGPWYZFAHLWOJV-VFVRVIDISA-N 1 1 365.861 4.087 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1)C(C)C ZINC000541070514 1118369106 /nfs/dbraw/zinc/36/91/06/1118369106.db2.gz JBBFSOJVCATMGT-UHFFFAOYSA-N 1 1 371.437 4.086 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]CCOCC(F)(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541545762 1118550549 /nfs/dbraw/zinc/55/05/49/1118550549.db2.gz LRXPZACLCBWNKE-INIZCTEOSA-N 1 1 372.343 4.008 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C[C@H](C)Sc2sccc21 ZINC000541569812 1118567106 /nfs/dbraw/zinc/56/71/06/1118567106.db2.gz PXEGTTWAKJEWEN-HZMBPMFUSA-N 1 1 350.465 4.380 20 5 FIBDMO Cc1ccc(CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C[C@H]2CCCO2)cc1 ZINC000464776363 1118690669 /nfs/dbraw/zinc/69/06/69/1118690669.db2.gz NIECJKSDNRYFJM-OAQYLSRUSA-N 1 1 354.450 4.127 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(Cl)ccc2Br)cc1 ZINC000090250709 1118792050 /nfs/dbraw/zinc/79/20/50/1118792050.db2.gz LTTJOLJOQKFKEH-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO CCOc1cc(C[NH+]2CCC(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000492462694 1119097374 /nfs/dbraw/zinc/09/73/74/1119097374.db2.gz NTUNENCGMNHATC-UHFFFAOYSA-N 1 1 368.433 4.088 20 5 FIBDMO CCOc1cc(C[N@H+](CC)Cc2ccc(OC)cc2OC)ccc1[N+](=O)[O-] ZINC000492651167 1119156238 /nfs/dbraw/zinc/15/62/38/1119156238.db2.gz KABBSBCZKYXUQW-UHFFFAOYSA-N 1 1 374.437 4.033 20 5 FIBDMO CCOc1cc(C[N@@H+](CC)Cc2ccc(OC)cc2OC)ccc1[N+](=O)[O-] ZINC000492651167 1119156240 /nfs/dbraw/zinc/15/62/40/1119156240.db2.gz KABBSBCZKYXUQW-UHFFFAOYSA-N 1 1 374.437 4.033 20 5 FIBDMO CCOc1cc(C[N@@H+]2CCC[C@H]2CC(=O)c2cccs2)ccc1[N+](=O)[O-] ZINC000492721290 1119176222 /nfs/dbraw/zinc/17/62/22/1119176222.db2.gz JWHDOFVZMVRFOK-HNNXBMFYSA-N 1 1 374.462 4.292 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@H]2CC(=O)c2cccs2)ccc1[N+](=O)[O-] ZINC000492721290 1119176223 /nfs/dbraw/zinc/17/62/23/1119176223.db2.gz JWHDOFVZMVRFOK-HNNXBMFYSA-N 1 1 374.462 4.292 20 5 FIBDMO CCC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000493240667 1119431357 /nfs/dbraw/zinc/43/13/57/1119431357.db2.gz WLXFCBWRYBZCJN-CSMYWGQOSA-N 1 1 352.862 4.274 20 5 FIBDMO CCOc1cc(C[N@@H+](CC)Cc2c[nH]c3ccccc23)ccc1[N+](=O)[O-] ZINC000493677944 1119489693 /nfs/dbraw/zinc/48/96/93/1119489693.db2.gz KWGHKVMRXMFVGH-UHFFFAOYSA-N 1 1 353.422 4.497 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 ZINC000493904786 1119504317 /nfs/dbraw/zinc/50/43/17/1119504317.db2.gz FHGUCKHRLIUZII-WBVHZDCISA-N 1 1 368.767 4.146 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]CC2([C@H](O)C(C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542494066 1120066258 /nfs/dbraw/zinc/06/62/58/1120066258.db2.gz JQLGZMWTDKDPEI-VQTJNVASSA-N 1 1 372.465 4.226 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(OCc3ccccc3)CC2)ccc1Cl ZINC000153329769 1120502959 /nfs/dbraw/zinc/50/29/59/1120502959.db2.gz GCNADAVSLMJPIU-UHFFFAOYSA-N 1 1 360.841 4.429 20 5 FIBDMO Cc1nn(C[N@H+]2CCC[C@H]2c2cc(C)ccc2C)c2ncc([N+](=O)[O-])cc12 ZINC000761837449 1120528147 /nfs/dbraw/zinc/52/81/47/1120528147.db2.gz HZTSCBZBZBXQRV-IBGZPJMESA-N 1 1 365.437 4.059 20 5 FIBDMO C[C@@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)[N@H+]1CCc2sccc2C1 ZINC000301081256 1120974803 /nfs/dbraw/zinc/97/48/03/1120974803.db2.gz GMXJUIZYRNADHY-ZDUSSCGKSA-N 1 1 368.462 4.063 20 5 FIBDMO C[C@@H]1C[C@H]1c1ccc(C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000153689375 1121026362 /nfs/dbraw/zinc/02/63/62/1121026362.db2.gz HYYBIVNQNJYSSZ-ZNOIYHFQSA-N 1 1 356.422 4.009 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCCCC[C@H]1c1ccco1 ZINC000076803845 1121139156 /nfs/dbraw/zinc/13/91/56/1121139156.db2.gz DAYOGVDQQHNCFG-KRWDZBQOSA-N 1 1 357.410 4.052 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000076803845 1121139160 /nfs/dbraw/zinc/13/91/60/1121139160.db2.gz DAYOGVDQQHNCFG-KRWDZBQOSA-N 1 1 357.410 4.052 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000917082341 1122082174 /nfs/dbraw/zinc/08/21/74/1122082174.db2.gz QGLPCCVKSHJELP-NXEZZACHSA-N 1 1 363.767 4.306 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC=C(c3c[nH]c4ccccc43)CC2)c1 ZINC000917094633 1122123141 /nfs/dbraw/zinc/12/31/41/1122123141.db2.gz ZWIPNYBMFJXNRY-UHFFFAOYSA-N 1 1 363.417 4.244 20 5 FIBDMO CC[C@@H](NCc1cccc(C[NH+]2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000123038977 1122242760 /nfs/dbraw/zinc/24/27/60/1122242760.db2.gz ADLPACVTTWPQAX-OAQYLSRUSA-N 1 1 353.466 4.432 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1nc(-c2ccncc2)cs1 ZINC000542705224 1122300822 /nfs/dbraw/zinc/30/08/22/1122300822.db2.gz RYYPITXOJOQZTA-ZDUSSCGKSA-N 1 1 354.435 4.273 20 5 FIBDMO CCC[C@@]1(COC)CCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000194931163 1123018261 /nfs/dbraw/zinc/01/82/61/1123018261.db2.gz RHDJLHZBYJCIRO-IBGZPJMESA-N 1 1 359.426 4.031 20 5 FIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)cc1[N+](=O)[O-] ZINC000557027668 1123321909 /nfs/dbraw/zinc/32/19/09/1123321909.db2.gz SPWUHAMQOWDMGD-INIZCTEOSA-N 1 1 369.469 4.093 20 5 FIBDMO Cc1c(NC(=O)NC[C@@H]2CCC[N@H+]2CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000609451552 1123718068 /nfs/dbraw/zinc/71/80/68/1123718068.db2.gz GLBCDRCXKZVRDP-KRWDZBQOSA-N 1 1 374.485 4.069 20 5 FIBDMO CC[C@H]1c2ccccc2CC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000609625695 1123773841 /nfs/dbraw/zinc/77/38/41/1123773841.db2.gz PBGDEOTZNFSXNI-IBGZPJMESA-N 1 1 367.449 4.241 20 5 FIBDMO Cc1ccccc1C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000554150092 1124297183 /nfs/dbraw/zinc/29/71/83/1124297183.db2.gz CCGRLNRQBQMEDD-UHFFFAOYSA-N 1 1 373.840 4.160 20 5 FIBDMO Cc1ccccc1C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000554150092 1124297190 /nfs/dbraw/zinc/29/71/90/1124297190.db2.gz CCGRLNRQBQMEDD-UHFFFAOYSA-N 1 1 373.840 4.160 20 5 FIBDMO C[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000542820454 1124390564 /nfs/dbraw/zinc/39/05/64/1124390564.db2.gz ZLENPFJIWVCIMF-ZBFHGGJFSA-N 1 1 374.412 4.119 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](n3ncc4ccccc43)C2)c(Cl)c1 ZINC000542979840 1125110204 /nfs/dbraw/zinc/11/02/04/1125110204.db2.gz ASLIFMACJDQPIC-MRXNPFEDSA-N 1 1 356.813 4.045 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](n3ncc4ccccc43)C2)c(Cl)c1 ZINC000542979840 1125110207 /nfs/dbraw/zinc/11/02/07/1125110207.db2.gz ASLIFMACJDQPIC-MRXNPFEDSA-N 1 1 356.813 4.045 20 5 FIBDMO Cc1ccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1F ZINC000113316508 1125147900 /nfs/dbraw/zinc/14/79/00/1125147900.db2.gz SROUOMSMXRHQBO-UHFFFAOYSA-N 1 1 357.410 4.456 20 5 FIBDMO COCc1ccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000113318300 1125149455 /nfs/dbraw/zinc/14/94/55/1125149455.db2.gz PULUBDUQMFOSFT-UHFFFAOYSA-N 1 1 369.446 4.155 20 5 FIBDMO C[C@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255197751 1125221025 /nfs/dbraw/zinc/22/10/25/1125221025.db2.gz ASYUBDWHJKSHSX-JNLARVDPSA-N 1 1 358.463 4.038 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC23CCOCC3)ccc1Oc1ccc(F)cc1 ZINC000618614656 1125223196 /nfs/dbraw/zinc/22/31/96/1125223196.db2.gz ONLJTFOGWNWDAC-UHFFFAOYSA-N 1 1 372.396 4.281 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000109102602 209298288 /nfs/dbraw/zinc/29/82/88/209298288.db2.gz LPRPWUWTAUQKLC-HXUWFJFHSA-N 1 1 367.449 4.377 20 5 FIBDMO Cc1cccc([C@@H]2CC[N@H+]([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000569386202 568400109 /nfs/dbraw/zinc/40/01/09/568400109.db2.gz WFRQKJITAOBGRX-FUHWJXTLSA-N 1 1 367.449 4.028 20 5 FIBDMO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(F)c1 ZINC000570168486 568455260 /nfs/dbraw/zinc/45/52/60/568455260.db2.gz RQQLPRBLRLIFBU-UHFFFAOYSA-N 1 1 358.291 4.051 20 5 FIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(OC(F)(F)F)cc1 ZINC000182511175 1125540481 /nfs/dbraw/zinc/54/04/81/1125540481.db2.gz RKWLQUHFSXWHSL-JTQLQIEISA-N 1 1 358.291 4.483 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000046156093 1079586525 /nfs/dbraw/zinc/58/65/25/1079586525.db2.gz JMYUHQWHTUJXGP-MRXNPFEDSA-N 1 1 367.449 4.008 20 5 FIBDMO Cc1ccc([C@H]2CCCC[N@@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000610215232 1079982704 /nfs/dbraw/zinc/98/27/04/1079982704.db2.gz DMLWZDLVKPJFMK-HXUWFJFHSA-N 1 1 368.433 4.497 20 5 FIBDMO Cc1ccc([C@H]2CCCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000610215232 1079982707 /nfs/dbraw/zinc/98/27/07/1079982707.db2.gz DMLWZDLVKPJFMK-HXUWFJFHSA-N 1 1 368.433 4.497 20 5 FIBDMO CCCOc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430226538 1080024346 /nfs/dbraw/zinc/02/43/46/1080024346.db2.gz NGGJWAUXUJZLSL-CQSZACIVSA-N 1 1 374.437 4.252 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2)C1 ZINC000047283443 1080222635 /nfs/dbraw/zinc/22/26/35/1080222635.db2.gz OBRQCMAOFZKTKW-HNNXBMFYSA-N 1 1 353.422 4.079 20 5 FIBDMO C[C@@H](CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[NH+](C)C ZINC000609223250 1080310652 /nfs/dbraw/zinc/31/06/52/1080310652.db2.gz AKLZLVAZCPGVNV-ZDUSSCGKSA-N 1 1 363.845 4.080 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CCCCC1 ZINC001167147704 1080730688 /nfs/dbraw/zinc/73/06/88/1080730688.db2.gz ZSKQUCXUPQKXDH-UHFFFAOYSA-N 1 1 367.877 4.479 20 5 FIBDMO CC(C)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001167188285 1080813054 /nfs/dbraw/zinc/81/30/54/1080813054.db2.gz ZXXODXWYBFQKGN-UHFFFAOYSA-N 1 1 373.409 4.183 20 5 FIBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001167298104 1081188887 /nfs/dbraw/zinc/18/88/87/1081188887.db2.gz FDCMFTXCRBJOLQ-CYBMUJFWSA-N 1 1 364.833 4.309 20 5 FIBDMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCCCCC1 ZINC001167302365 1081217137 /nfs/dbraw/zinc/21/71/37/1081217137.db2.gz ORGZIZVHMSMKHQ-UHFFFAOYSA-N 1 1 351.422 4.107 20 5 FIBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000177529349 1081227025 /nfs/dbraw/zinc/22/70/25/1081227025.db2.gz LHXMTJKMHJIUJJ-KBXCAEBGSA-N 1 1 364.405 4.023 20 5 FIBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000177533156 1081227293 /nfs/dbraw/zinc/22/72/93/1081227293.db2.gz IBJIODAFLRSHSQ-KSSFIOAISA-N 1 1 364.405 4.023 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@@H](c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001167306592 1081243466 /nfs/dbraw/zinc/24/34/66/1081243466.db2.gz HRRZIYMUOUMRHS-GOSISDBHSA-N 1 1 370.449 4.252 20 5 FIBDMO Cc1[nH+]c2ccc(Br)cn2c1Nc1cccc([N+](=O)[O-])c1F ZINC001210381992 1081326444 /nfs/dbraw/zinc/32/64/44/1081326444.db2.gz UPGNTDMYBYENJJ-UHFFFAOYSA-N 1 1 365.162 4.196 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000610370763 1081554980 /nfs/dbraw/zinc/55/49/80/1081554980.db2.gz FNFAUHGFXBNSBL-ORAYPTAESA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000610370763 1081554984 /nfs/dbraw/zinc/55/49/84/1081554984.db2.gz FNFAUHGFXBNSBL-ORAYPTAESA-N 1 1 372.396 4.184 20 5 FIBDMO CC[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001167376285 1081811737 /nfs/dbraw/zinc/81/17/37/1081811737.db2.gz IBWRHGDLDZJIHD-OLZOCXBDSA-N 1 1 353.850 4.087 20 5 FIBDMO CC[C@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001167376285 1081811748 /nfs/dbraw/zinc/81/17/48/1081811748.db2.gz IBWRHGDLDZJIHD-OLZOCXBDSA-N 1 1 353.850 4.087 20 5 FIBDMO C[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000379656997 1081851435 /nfs/dbraw/zinc/85/14/35/1081851435.db2.gz RDPUZLQPCXDZMT-YJBOKZPZSA-N 1 1 373.884 4.391 20 5 FIBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCN(Cc2ccccc2)CC1 ZINC000119311227 1082105019 /nfs/dbraw/zinc/10/50/19/1082105019.db2.gz KOCMENLCLOPPSL-YRNVUSSQSA-N 1 1 365.477 4.204 20 5 FIBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2)CC1 ZINC000119311227 1082105023 /nfs/dbraw/zinc/10/50/23/1082105023.db2.gz KOCMENLCLOPPSL-YRNVUSSQSA-N 1 1 365.477 4.204 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000610468549 1082237797 /nfs/dbraw/zinc/23/77/97/1082237797.db2.gz XXEPKEGIJZCZIT-SFHVURJKSA-N 1 1 369.465 4.065 20 5 FIBDMO CC(=O)c1cc(NCC[C@H](C)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000561263895 1082244063 /nfs/dbraw/zinc/24/40/63/1082244063.db2.gz GKVLBCZLKOQZGZ-HNNXBMFYSA-N 1 1 355.438 4.120 20 5 FIBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000157798585 1082333145 /nfs/dbraw/zinc/33/31/45/1082333145.db2.gz WDKOYGDQVPIMJF-ZDUSSCGKSA-N 1 1 356.451 4.250 20 5 FIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000051132001 1082736105 /nfs/dbraw/zinc/73/61/05/1082736105.db2.gz HXOQFKNHUNIWON-GHTZIAJQSA-N 1 1 370.449 4.073 20 5 FIBDMO COc1cc(C[N@@H+](C)CC2CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000510448754 1082797425 /nfs/dbraw/zinc/79/74/25/1082797425.db2.gz YFTLLCYGUAMERO-UHFFFAOYSA-N 1 1 356.422 4.024 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCn2ccnc2)Cc2cccc(Cl)c2)c1 ZINC000581753360 1082867996 /nfs/dbraw/zinc/86/79/96/1082867996.db2.gz UOADTSSYKGPJLN-UHFFFAOYSA-N 1 1 370.840 4.147 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCCC(C)C)CC1 ZINC000510490029 1083001706 /nfs/dbraw/zinc/00/17/06/1083001706.db2.gz KFUNPROOTJQEHT-UHFFFAOYSA-N 1 1 350.459 4.021 20 5 FIBDMO COCC1=CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000187615603 1083063847 /nfs/dbraw/zinc/06/38/47/1083063847.db2.gz DLHCBANCICSHLW-UHFFFAOYSA-N 1 1 362.813 4.287 20 5 FIBDMO C[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@H]1c1cccc(F)c1 ZINC000610582291 1083213113 /nfs/dbraw/zinc/21/31/13/1083213113.db2.gz BMMGTKLCKQXPQU-HXPMCKFVSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@H]1c1cccc(F)c1 ZINC000610582291 1083213116 /nfs/dbraw/zinc/21/31/16/1083213116.db2.gz BMMGTKLCKQXPQU-HXPMCKFVSA-N 1 1 355.369 4.458 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](CCc1ccccn1)Cc1cccnc1 ZINC000430877460 1083220048 /nfs/dbraw/zinc/22/00/48/1083220048.db2.gz YGGHFAHHNHNQMO-RMKNXTFCSA-N 1 1 374.444 4.143 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCCO1 ZINC000179393614 1083445241 /nfs/dbraw/zinc/44/52/41/1083445241.db2.gz KTGRPWQCXSXZLB-GFCCVEGCSA-N 1 1 350.802 4.119 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@@H](Cn3cnc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000614235844 1083579105 /nfs/dbraw/zinc/57/91/05/1083579105.db2.gz KJYQAZKABGOJAI-QGZVFWFLSA-N 1 1 364.449 4.165 20 5 FIBDMO CC[N@@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000535721653 1083609229 /nfs/dbraw/zinc/60/92/29/1083609229.db2.gz RQMNLZUKFFTYJO-ZDUSSCGKSA-N 1 1 361.829 4.097 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)s1 ZINC000535799213 1083674495 /nfs/dbraw/zinc/67/44/95/1083674495.db2.gz HAEWTTXBRLNZOP-RHSMWYFYSA-N 1 1 358.463 4.324 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]([C@@H]4CCOC4)C3)o2)cc1 ZINC000535809811 1083698505 /nfs/dbraw/zinc/69/85/05/1083698505.db2.gz JUXGRVNFKIFBJB-IAGOWNOFSA-N 1 1 356.422 4.103 20 5 FIBDMO C[C@H]([NH2+][C@H](CN1CCCCC1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610809706 1083719282 /nfs/dbraw/zinc/71/92/82/1083719282.db2.gz PVVYUSJOUKHGOU-LAUBAEHRSA-N 1 1 353.466 4.473 20 5 FIBDMO CC(C)[NH+]1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000236603160 1083811009 /nfs/dbraw/zinc/81/10/09/1083811009.db2.gz DXJHPRJCIBDHJR-UHFFFAOYSA-N 1 1 359.495 4.286 20 5 FIBDMO CC(C)N1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000236603160 1083811015 /nfs/dbraw/zinc/81/10/15/1083811015.db2.gz DXJHPRJCIBDHJR-UHFFFAOYSA-N 1 1 359.495 4.286 20 5 FIBDMO Cc1c(C[N@H+]2CC3(CCOCC3)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000411996002 1083943809 /nfs/dbraw/zinc/94/38/09/1083943809.db2.gz FRIIBPUNPOVKDP-HXUWFJFHSA-N 1 1 352.434 4.257 20 5 FIBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000580279890 1084403673 /nfs/dbraw/zinc/40/36/73/1084403673.db2.gz VERWYBXHCPSLBV-OAHLLOKOSA-N 1 1 366.421 4.016 20 5 FIBDMO COc1ccc([C@@H](CN(C)C)[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000551226113 1084578162 /nfs/dbraw/zinc/57/81/62/1084578162.db2.gz DXIYZBWFRWELQZ-HXUWFJFHSA-N 1 1 371.481 4.119 20 5 FIBDMO COc1cc(N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000381226685 1084639074 /nfs/dbraw/zinc/63/90/74/1084639074.db2.gz XGCRAGMZDYOZJN-ZBFHGGJFSA-N 1 1 373.428 4.065 20 5 FIBDMO Cn1cc(C[N@H+]2CCC=C(c3ccccc3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000551586662 1084678657 /nfs/dbraw/zinc/67/86/57/1084678657.db2.gz QBCLWBTXQZJENQ-UHFFFAOYSA-N 1 1 374.444 4.285 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@@H]1CCOC(C)(C)C1 ZINC000582270208 1084823604 /nfs/dbraw/zinc/82/36/04/1084823604.db2.gz NVHLOXBHDKAEAM-QGZVFWFLSA-N 1 1 350.459 4.162 20 5 FIBDMO C[C@]1(Cc2ccccc2)CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000613502793 1084852497 /nfs/dbraw/zinc/85/24/97/1084852497.db2.gz CTHARMATHOKQQD-HXUWFJFHSA-N 1 1 351.406 4.333 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H](OC(F)F)C3)o2)c1 ZINC000611609593 1085027447 /nfs/dbraw/zinc/02/74/47/1085027447.db2.gz RFNHUNXXYSJYLB-CQSZACIVSA-N 1 1 352.337 4.058 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1OC(F)F ZINC000051709602 1085061812 /nfs/dbraw/zinc/06/18/12/1085061812.db2.gz WBKXJUCQCZIQIR-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO C[C@]1(CCc2ccccc2)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC001167599399 1085392976 /nfs/dbraw/zinc/39/29/76/1085392976.db2.gz UQOFAAGWBQMYAN-NRFANRHFSA-N 1 1 354.450 4.318 20 5 FIBDMO Cc1cc(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC2)n[nH]1 ZINC000549537025 1085463934 /nfs/dbraw/zinc/46/39/34/1085463934.db2.gz SKRMSLHLMXIIRW-UHFFFAOYSA-N 1 1 368.359 4.025 20 5 FIBDMO Cc1cc(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)CC2)[nH]n1 ZINC000549537025 1085463938 /nfs/dbraw/zinc/46/39/38/1085463938.db2.gz SKRMSLHLMXIIRW-UHFFFAOYSA-N 1 1 368.359 4.025 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000045960000 1085648045 /nfs/dbraw/zinc/64/80/45/1085648045.db2.gz RTKXKNVNPRNFSH-CYBMUJFWSA-N 1 1 368.865 4.024 20 5 FIBDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000093839191 1086206179 /nfs/dbraw/zinc/20/61/79/1086206179.db2.gz ADNXKVWCELKTOR-INIZCTEOSA-N 1 1 374.412 4.385 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576809 1086214875 /nfs/dbraw/zinc/21/48/75/1086214875.db2.gz USDZGCCHMGCOOF-QVKFZJNVSA-N 1 1 366.417 4.156 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576809 1086214881 /nfs/dbraw/zinc/21/48/81/1086214881.db2.gz USDZGCCHMGCOOF-QVKFZJNVSA-N 1 1 366.417 4.156 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC([C@@H]3CCCO3)CC2)c1 ZINC000549612692 1086548784 /nfs/dbraw/zinc/54/87/84/1086548784.db2.gz XAVZPSUEPDQCTQ-INIZCTEOSA-N 1 1 358.360 4.005 20 5 FIBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000054010827 1086631021 /nfs/dbraw/zinc/63/10/21/1086631021.db2.gz GGEOPLBGNKHAHU-UHFFFAOYSA-N 1 1 364.405 4.215 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCc3ccc4cn[nH]c4c3)o2)cc1 ZINC000585743462 1086679491 /nfs/dbraw/zinc/67/94/91/1086679491.db2.gz SRAPTVATSOJGGJ-UHFFFAOYSA-N 1 1 362.389 4.063 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CCC[C@@H]3Cc3ccccc3)c2)cc1 ZINC000728898319 1086889181 /nfs/dbraw/zinc/88/91/81/1086889181.db2.gz SQLIJXYJGRCIBO-OAQYLSRUSA-N 1 1 362.433 4.123 20 5 FIBDMO CC(C)(CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCCCC1 ZINC000409577179 1087524819 /nfs/dbraw/zinc/52/48/19/1087524819.db2.gz YZFAWIKXMXFRHI-UHFFFAOYSA-N 1 1 357.454 4.209 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000472357974 1087782391 /nfs/dbraw/zinc/78/23/91/1087782391.db2.gz DGLLIFQKGSXHGF-VBKZILBWSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000472357974 1087782402 /nfs/dbraw/zinc/78/24/02/1087782402.db2.gz DGLLIFQKGSXHGF-VBKZILBWSA-N 1 1 371.412 4.064 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000541022121 1088210644 /nfs/dbraw/zinc/21/06/44/1088210644.db2.gz UGPWYZFAHLWOJV-FHSNZYRGSA-N 1 1 365.861 4.087 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000541022121 1088210651 /nfs/dbraw/zinc/21/06/51/1088210651.db2.gz UGPWYZFAHLWOJV-FHSNZYRGSA-N 1 1 365.861 4.087 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(N2CCCC2=O)c1 ZINC000181411069 1088460267 /nfs/dbraw/zinc/46/02/67/1088460267.db2.gz HVXIZRIIIRCMLQ-CYBMUJFWSA-N 1 1 373.840 4.226 20 5 FIBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1ccc(F)cc1 ZINC000434790732 1089042545 /nfs/dbraw/zinc/04/25/45/1089042545.db2.gz YBNNLIJCSMOOAJ-CQSZACIVSA-N 1 1 359.401 4.064 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1ccc(F)cc1 ZINC000434790732 1089042557 /nfs/dbraw/zinc/04/25/57/1089042557.db2.gz YBNNLIJCSMOOAJ-CQSZACIVSA-N 1 1 359.401 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434896720 1089113134 /nfs/dbraw/zinc/11/31/34/1089113134.db2.gz QAHCFWVEYSRZSZ-VQIMIIECSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000434898012 1089116333 /nfs/dbraw/zinc/11/63/33/1089116333.db2.gz SYFVQDUVCIFVQR-VQIMIIECSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4ccc(Cl)cc4)C3)nc2c1 ZINC000435049137 1089235493 /nfs/dbraw/zinc/23/54/93/1089235493.db2.gz LZACZPSOORULLL-CYBMUJFWSA-N 1 1 357.797 4.379 20 5 FIBDMO CCC[N@@H+]1CC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236810794 1090167256 /nfs/dbraw/zinc/16/72/56/1090167256.db2.gz JYXOMYXPSSZNHV-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CCC[N@H+]1CC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236810794 1090167268 /nfs/dbraw/zinc/16/72/68/1090167268.db2.gz JYXOMYXPSSZNHV-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@H](c4ccccc4)C3)o2)c1 ZINC000104679693 1090294492 /nfs/dbraw/zinc/29/44/92/1090294492.db2.gz KYIGMAWSYNDHKK-SFHVURJKSA-N 1 1 363.417 4.282 20 5 FIBDMO O=C(CC[N@H+]1CC[C@H]1c1ccc(Cl)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000511606396 1090688188 /nfs/dbraw/zinc/68/81/88/1090688188.db2.gz VLKTYIOCIXMANL-KRWDZBQOSA-N 1 1 359.813 4.024 20 5 FIBDMO Cc1cccc2nc(C[NH2+][C@@H]3CCCCc4ccc([N+](=O)[O-])cc43)cn21 ZINC000417318361 1090798489 /nfs/dbraw/zinc/79/84/89/1090798489.db2.gz YNYPQVIGBVOJQJ-LJQANCHMSA-N 1 1 350.422 4.108 20 5 FIBDMO Cc1cccc2nc(C[NH2+][C@H]3CCCCc4ccc([N+](=O)[O-])cc43)cn21 ZINC000417318360 1090799339 /nfs/dbraw/zinc/79/93/39/1090799339.db2.gz YNYPQVIGBVOJQJ-IBGZPJMESA-N 1 1 350.422 4.108 20 5 FIBDMO COc1ccc(C[NH+]2CCC(c3cccc(F)c3F)CC2)cc1[N+](=O)[O-] ZINC000613744369 1091334141 /nfs/dbraw/zinc/33/41/41/1091334141.db2.gz SYDMNKUKUKMQEN-UHFFFAOYSA-N 1 1 362.376 4.261 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1cccc(Br)n1 ZINC000925693657 1091408799 /nfs/dbraw/zinc/40/87/99/1091408799.db2.gz QNLNMCNNTKNZNE-GHMZBOCLSA-N 1 1 350.216 4.164 20 5 FIBDMO C[C@@H](C[N@@H+](C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)c1ccccc1 ZINC000728900140 1091815183 /nfs/dbraw/zinc/81/51/83/1091815183.db2.gz FPPGFAHZUZMPLD-INIZCTEOSA-N 1 1 350.422 4.151 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCc1nc(-c2ccccc2)no1 ZINC000512214156 1091919099 /nfs/dbraw/zinc/91/90/99/1091919099.db2.gz UWVCQKLRDMZPRG-OAHLLOKOSA-N 1 1 366.421 4.189 20 5 FIBDMO C[C@@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccc(-n2cccn2)c(F)c1 ZINC000549828942 1092855616 /nfs/dbraw/zinc/85/56/16/1092855616.db2.gz SDQOJDJCNAZLDU-GFCCVEGCSA-N 1 1 374.803 4.424 20 5 FIBDMO C[N@@H+](CCSc1ccc([N+](=O)[O-])c2cnccc12)Cc1ccccc1 ZINC000432944911 1092979659 /nfs/dbraw/zinc/97/96/59/1092979659.db2.gz WDDMVTGWDYNXMK-UHFFFAOYSA-N 1 1 353.447 4.367 20 5 FIBDMO Cc1c[nH+]cn1C1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000439131990 1092980749 /nfs/dbraw/zinc/98/07/49/1092980749.db2.gz NJUXVRBUJLKDHE-UHFFFAOYSA-N 1 1 363.421 4.003 20 5 FIBDMO COc1cc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])ccc1SC ZINC000512706029 1093176374 /nfs/dbraw/zinc/17/63/74/1093176374.db2.gz UGNRKXCMPHVAMX-VURMDHGXSA-N 1 1 358.463 4.471 20 5 FIBDMO COc1ccc(C)[nH+]c1NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000150975119 1093443123 /nfs/dbraw/zinc/44/31/23/1093443123.db2.gz BVVPVYFFJBMKJK-UHFFFAOYSA-N 1 1 356.407 4.042 20 5 FIBDMO CC(C)[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000052006010 1093549254 /nfs/dbraw/zinc/54/92/54/1093549254.db2.gz DCWASEZQLPZJJI-SFHVURJKSA-N 1 1 352.394 4.132 20 5 FIBDMO CC(C)[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000052006013 1093549393 /nfs/dbraw/zinc/54/93/93/1093549393.db2.gz DCWASEZQLPZJJI-GOSISDBHSA-N 1 1 352.394 4.132 20 5 FIBDMO CC(C)c1nc2n(n1)CCC[C@@H]2[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433305512 1093559978 /nfs/dbraw/zinc/55/99/78/1093559978.db2.gz PRUAPRTWVFIBGB-IRXDYDNUSA-N 1 1 369.469 4.157 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@@H](c2c(F)cccc2Cl)[NH+]2CCCC2)cn1 ZINC000513190357 1093997707 /nfs/dbraw/zinc/99/77/07/1093997707.db2.gz SYYYCRSHLOZBFR-HNNXBMFYSA-N 1 1 364.808 4.031 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(Br)c1 ZINC000404219008 1094189282 /nfs/dbraw/zinc/18/92/82/1094189282.db2.gz WCQNBOKAUOITRV-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO C[C@H](Nc1nccc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000413252035 1094802477 /nfs/dbraw/zinc/80/24/77/1094802477.db2.gz YLGPJRSFTJMAFD-HOCLYGCPSA-N 1 1 354.454 4.208 20 5 FIBDMO Cc1cc(CNc2ccc([N+](=O)[O-])c3ncccc23)cc(N2CCCC2)[nH+]1 ZINC000413308525 1094902215 /nfs/dbraw/zinc/90/22/15/1094902215.db2.gz JXZWRMZFLGGCIC-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@H](CC(F)(F)F)C3)co2)cc1 ZINC000420947341 1095188868 /nfs/dbraw/zinc/18/88/68/1095188868.db2.gz MSGIJLPCOWXEBE-LBPRGKRZSA-N 1 1 369.343 4.414 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H](CC(F)(F)F)C3)co2)cc1 ZINC000420947341 1095188872 /nfs/dbraw/zinc/18/88/72/1095188872.db2.gz MSGIJLPCOWXEBE-LBPRGKRZSA-N 1 1 369.343 4.414 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H](O)CC23CCC3)s1 ZINC000421380247 1095579769 /nfs/dbraw/zinc/57/97/69/1095579769.db2.gz XXMKQLZNSDCNHF-CQSZACIVSA-N 1 1 358.463 4.203 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H](O)CC34CCC4)s2)cc1 ZINC000421380270 1095580142 /nfs/dbraw/zinc/58/01/42/1095580142.db2.gz YBTKKNCLYMBJAC-INIZCTEOSA-N 1 1 358.463 4.203 20 5 FIBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000016442269 1095686462 /nfs/dbraw/zinc/68/64/62/1095686462.db2.gz GUCXTGMNCDXJKJ-IBGZPJMESA-N 1 1 353.422 4.069 20 5 FIBDMO CCc1ccc([C@@H](NC2CCC([NH+](C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000421878617 1095973042 /nfs/dbraw/zinc/97/30/42/1095973042.db2.gz NONBVCXWQSTHCW-BPZDKFOGSA-N 1 1 371.481 4.302 20 5 FIBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000502937493 1095979418 /nfs/dbraw/zinc/97/94/18/1095979418.db2.gz FNOHIKUZOSCNTQ-MRXNPFEDSA-N 1 1 355.438 4.224 20 5 FIBDMO Cc1c(C[NH2+]Cc2ccc(Br)cc2F)cccc1[N+](=O)[O-] ZINC000231883736 1096126078 /nfs/dbraw/zinc/12/60/78/1096126078.db2.gz BQUPUWMKECIAGF-UHFFFAOYSA-N 1 1 353.191 4.095 20 5 FIBDMO Cc1cccc(-c2n[nH]cc2C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000183804479 1096205313 /nfs/dbraw/zinc/20/53/13/1096205313.db2.gz BYPLYXIIWJRRRC-UHFFFAOYSA-N 1 1 356.813 4.237 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)c1ccc(F)cc1 ZINC000532926875 1098595413 /nfs/dbraw/zinc/59/54/13/1098595413.db2.gz QIBRYXFCVDNQAV-HNNXBMFYSA-N 1 1 373.428 4.454 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000532918636 1098609345 /nfs/dbraw/zinc/60/93/45/1098609345.db2.gz BDIYNVVCHXKPDQ-GUYCJALGSA-N 1 1 359.451 4.129 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000532918636 1098609352 /nfs/dbraw/zinc/60/93/52/1098609352.db2.gz BDIYNVVCHXKPDQ-GUYCJALGSA-N 1 1 359.451 4.129 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](c3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000533435584 1099055812 /nfs/dbraw/zinc/05/58/12/1099055812.db2.gz LYBVWMIVCSHKDD-QAPCUYQASA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000516326094 1099370866 /nfs/dbraw/zinc/37/08/66/1099370866.db2.gz CLBDZXUNJFNQCO-UHFFFAOYSA-N 1 1 365.355 4.089 20 5 FIBDMO COc1ccc(C[C@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000516610746 1099654717 /nfs/dbraw/zinc/65/47/17/1099654717.db2.gz SVUAKFQJGDPERG-LJQANCHMSA-N 1 1 354.450 4.101 20 5 FIBDMO CCCCOc1ncccc1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000516906699 1099915786 /nfs/dbraw/zinc/91/57/86/1099915786.db2.gz MOBWVXVMSPNCPZ-IBGZPJMESA-N 1 1 355.438 4.336 20 5 FIBDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000506100655 1100080348 /nfs/dbraw/zinc/08/03/48/1100080348.db2.gz FSPZKWKSNDJGMO-KRWDZBQOSA-N 1 1 354.406 4.012 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000506098430 1100091526 /nfs/dbraw/zinc/09/15/26/1100091526.db2.gz CYNGKMDUASFBHE-HNSSHINMSA-N 1 1 366.417 4.216 20 5 FIBDMO CCN(Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000517124071 1100091723 /nfs/dbraw/zinc/09/17/23/1100091723.db2.gz MAIRGSJOPZZJPG-DYESRHJHSA-N 1 1 353.466 4.252 20 5 FIBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536673573 1100159006 /nfs/dbraw/zinc/15/90/06/1100159006.db2.gz MECBUBCCKIBXKE-WUTDNEBXSA-N 1 1 365.477 4.062 20 5 FIBDMO CC1(C)C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC[C@H]1O ZINC000438336087 1100609632 /nfs/dbraw/zinc/60/96/32/1100609632.db2.gz SRUVXTVJAWAYCQ-LJQANCHMSA-N 1 1 374.412 4.119 20 5 FIBDMO CC1(C)C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC[C@H]1O ZINC000438336087 1100609638 /nfs/dbraw/zinc/60/96/38/1100609638.db2.gz SRUVXTVJAWAYCQ-LJQANCHMSA-N 1 1 374.412 4.119 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H]1CCSC1 ZINC000506217614 1100629652 /nfs/dbraw/zinc/62/96/52/1100629652.db2.gz JYYIASCKMISXLA-GFCCVEGCSA-N 1 1 352.843 4.446 20 5 FIBDMO COc1cc(OC)cc(OCCC[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000438543633 1100733389 /nfs/dbraw/zinc/73/33/89/1100733389.db2.gz BWUPMJDPHDCCGL-HNNXBMFYSA-N 1 1 374.437 4.074 20 5 FIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H](C)c1cccc(O)c1 ZINC000509557157 1100941501 /nfs/dbraw/zinc/94/15/01/1100941501.db2.gz LVKXVXWVWIONBS-GFCCVEGCSA-N 1 1 366.364 4.485 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H](C)c1cccc(O)c1 ZINC000509557157 1100941503 /nfs/dbraw/zinc/94/15/03/1100941503.db2.gz LVKXVXWVWIONBS-GFCCVEGCSA-N 1 1 366.364 4.485 20 5 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O=[N+]([O-])c1ccc(-c2ccc(CNC3CC[NH+](C4CCC4)CC3)s2)cc1 ZINC000518278344 1101061384 /nfs/dbraw/zinc/06/13/84/1101061384.db2.gz NUQWKVFGKCXWJN-UHFFFAOYSA-N 1 1 371.506 4.430 20 5 FIBDMO COC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 ZINC000536995161 1101375740 /nfs/dbraw/zinc/37/57/40/1101375740.db2.gz RVPMTXUZJNOUBW-KPZWWZAWSA-N 1 1 350.365 4.220 20 5 FIBDMO C[C@H]([NH2+]C[C@@H]1CCN(C2CC2)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000152364433 1101784116 /nfs/dbraw/zinc/78/41/16/1101784116.db2.gz IUMYNSVXLBVUDQ-GJZGRUSLSA-N 1 1 371.506 4.458 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@@H]23)s1 ZINC000237964519 1102391219 /nfs/dbraw/zinc/39/12/19/1102391219.db2.gz QQOUACLRJNBPEV-AEFFLSMTSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@H+]3CCCC[C@@H]23)s1 ZINC000237964519 1102391230 /nfs/dbraw/zinc/39/12/30/1102391230.db2.gz QQOUACLRJNBPEV-AEFFLSMTSA-N 1 1 357.479 4.040 20 5 FIBDMO 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O=[N+]([O-])c1cccc(C[N@H+](Cc2cnn(-c3ccc(F)cc3)c2)C2CC2)c1 ZINC000507155147 1103171035 /nfs/dbraw/zinc/17/10/35/1103171035.db2.gz MTZQCKINITYZPB-UHFFFAOYSA-N 1 1 366.396 4.084 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cnn(-c3ccc(F)cc3)c2)C2CC2)c1 ZINC000507155147 1103171041 /nfs/dbraw/zinc/17/10/41/1103171041.db2.gz MTZQCKINITYZPB-UHFFFAOYSA-N 1 1 366.396 4.084 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(OC(F)F)c(F)c1)C1CC1 ZINC000507170102 1103187393 /nfs/dbraw/zinc/18/73/93/1103187393.db2.gz YVIKSQLJVIUAPY-UHFFFAOYSA-N 1 1 366.339 4.500 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc(OC(F)F)c(F)c1)C1CC1 ZINC000507170102 1103187401 /nfs/dbraw/zinc/18/74/01/1103187401.db2.gz YVIKSQLJVIUAPY-UHFFFAOYSA-N 1 1 366.339 4.500 20 5 FIBDMO Cn1nccc1-c1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507241635 1103235696 /nfs/dbraw/zinc/23/56/96/1103235696.db2.gz BEKDXFIDNYRULW-UHFFFAOYSA-N 1 1 362.433 4.160 20 5 FIBDMO COc1ccc(C[N@@H+](C)CCc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000507279743 1103272573 /nfs/dbraw/zinc/27/25/73/1103272573.db2.gz PKPHCLRWQNDVTB-UHFFFAOYSA-N 1 1 350.418 4.431 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H](CO)c1ccc(C(F)(F)F)cc1 ZINC000543809624 1103614158 /nfs/dbraw/zinc/61/41/58/1103614158.db2.gz IOFBMUBBLPUVAJ-AWEZNQCLSA-N 1 1 374.746 4.090 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000018935407 1104194113 /nfs/dbraw/zinc/19/41/13/1104194113.db2.gz LGNJKJXAZLJVOL-UHFFFAOYSA-N 1 1 363.417 4.127 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)Cc1ccc2ccccc2c1 ZINC000018935407 1104194116 /nfs/dbraw/zinc/19/41/16/1104194116.db2.gz LGNJKJXAZLJVOL-UHFFFAOYSA-N 1 1 363.417 4.127 20 5 FIBDMO CC(C)c1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[nH]1 ZINC000536491092 1105173362 /nfs/dbraw/zinc/17/33/62/1105173362.db2.gz GPFVRAVEZGUXTA-GFCCVEGCSA-N 1 1 371.466 4.416 20 5 FIBDMO C[C@@H]1Cc2[nH+]cn(CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)c2C[C@@H]1C ZINC000451341542 1107043596 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NIDRHIQKNWILHX-DYVFJYSZSA-N 1 1 361.467 4.160 20 5 FIBDMO Cc1cc(C)cc(C[N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000444693293 1108097730 /nfs/dbraw/zinc/09/77/30/1108097730.db2.gz GXKFAAYCDGBTHC-UHFFFAOYSA-N 1 1 351.406 4.499 20 5 FIBDMO Cc1cc(C)cc(C[N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000444693293 1108097745 /nfs/dbraw/zinc/09/77/45/1108097745.db2.gz GXKFAAYCDGBTHC-UHFFFAOYSA-N 1 1 351.406 4.499 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000523451608 1108213902 /nfs/dbraw/zinc/21/39/02/1108213902.db2.gz LJADJUASULHGJA-WMLDXEAASA-N 1 1 356.397 4.390 20 5 FIBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000523860063 1108609452 /nfs/dbraw/zinc/60/94/52/1108609452.db2.gz ACYNVDXNMZQWIW-OAHLLOKOSA-N 1 1 358.442 4.293 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCC[N@@H+](Cc4ccccc4)C3)n2)s1 ZINC000445476285 1108815285 /nfs/dbraw/zinc/81/52/85/1108815285.db2.gz ASZDHVAEOTTWLQ-AWEZNQCLSA-N 1 1 370.434 4.086 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H](CO)c1c(Cl)cccc1Cl ZINC000475633959 1108951271 /nfs/dbraw/zinc/95/12/71/1108951271.db2.gz HYGCVPZNCAXMQQ-VOKGJARPSA-N 1 1 367.232 4.238 20 5 FIBDMO COc1ccc(OCC[N@@H+](Cc2ccc(C)s2)C(C)C)c([N+](=O)[O-])c1 ZINC000441239014 1109505150 /nfs/dbraw/zinc/50/51/50/1109505150.db2.gz ZOBQEJABDVICGJ-UHFFFAOYSA-N 1 1 364.467 4.263 20 5 FIBDMO CCC[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nnc2ccccn21 ZINC000447542136 1109574029 /nfs/dbraw/zinc/57/40/29/1109574029.db2.gz IBWINPCFZCWNDU-MSOLQXFVSA-N 1 1 365.437 4.146 20 5 FIBDMO Cn1c(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)nc2cccc(Cl)c21 ZINC000447592215 1109590211 /nfs/dbraw/zinc/59/02/11/1109590211.db2.gz KHCOWUIUILQGBA-MRXNPFEDSA-N 1 1 370.840 4.302 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000526096954 1109617950 /nfs/dbraw/zinc/61/79/50/1109617950.db2.gz KVYSZXQHQITBEX-IAGOWNOFSA-N 1 1 374.485 4.022 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000449517161 1110097339 /nfs/dbraw/zinc/09/73/39/1110097339.db2.gz JAUBNBBGFBUXOE-OHMJOTAUSA-N 1 1 356.466 4.279 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCSC[C@H]3C3CC3)cs2)c1 ZINC000449527556 1110099934 /nfs/dbraw/zinc/09/99/34/1110099934.db2.gz JIOBEARWRMFCKA-INIZCTEOSA-N 1 1 361.492 4.046 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCSC[C@H]3C3CC3)cs2)c1 ZINC000449527556 1110099938 /nfs/dbraw/zinc/09/99/38/1110099938.db2.gz JIOBEARWRMFCKA-INIZCTEOSA-N 1 1 361.492 4.046 20 5 FIBDMO Cc1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461772598 1111350001 /nfs/dbraw/zinc/35/00/01/1111350001.db2.gz GKYXEIWRHBNJHI-NSHDSACASA-N 1 1 354.332 4.029 20 5 FIBDMO C[C@@H]1CCCC[C@H]1CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000552045348 1111556367 /nfs/dbraw/zinc/55/63/67/1111556367.db2.gz DXDCPVVFNHKSFN-GJYPPUQNSA-N 1 1 356.470 4.224 20 5 FIBDMO C[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+]1CCCC[C@H]1C ZINC000478641288 1111842619 /nfs/dbraw/zinc/84/26/19/1111842619.db2.gz CPELUVHRISAHTG-IAGOWNOFSA-N 1 1 361.489 4.381 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000479096586 1111947882 /nfs/dbraw/zinc/94/78/82/1111947882.db2.gz GQAMPMJHZIQBOP-RDTXWAMCSA-N 1 1 364.405 4.023 20 5 FIBDMO CCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1ccc(F)cc1 ZINC000553832783 1112107941 /nfs/dbraw/zinc/10/79/41/1112107941.db2.gz MVWMIYONELQNRZ-UHFFFAOYSA-N 1 1 373.428 4.283 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(-c2cccc(F)c2F)o1 ZINC000480301712 1112377460 /nfs/dbraw/zinc/37/74/60/1112377460.db2.gz QBAIOXMDODFQGR-UHFFFAOYSA-N 1 1 374.343 4.431 20 5 FIBDMO Cc1cc2cc3ccc(N(C)C)cc3nc2cc1NC(=O)C[N@H+](C)C(C)C ZINC001142588146 1112389789 /nfs/dbraw/zinc/38/97/89/1112389789.db2.gz MPXPREUSBLPCKX-UHFFFAOYSA-N 1 1 364.493 4.041 20 5 FIBDMO COCC[C@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000555427563 1112836659 /nfs/dbraw/zinc/83/66/59/1112836659.db2.gz BAPMVHONVHDKEC-CYBMUJFWSA-N 1 1 360.376 4.252 20 5 FIBDMO CC[C@@H](NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482435453 1113254075 /nfs/dbraw/zinc/25/40/75/1113254075.db2.gz HQUPOFQNFDMJRS-SIKLNZKXSA-N 1 1 367.493 4.200 20 5 FIBDMO CC[C@@H](NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482435453 1113254076 /nfs/dbraw/zinc/25/40/76/1113254076.db2.gz HQUPOFQNFDMJRS-SIKLNZKXSA-N 1 1 367.493 4.200 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000482437311 1113254741 /nfs/dbraw/zinc/25/47/41/1113254741.db2.gz DESVTWVCGGTBNG-QUCCMNQESA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000482437311 1113254746 /nfs/dbraw/zinc/25/47/46/1113254746.db2.gz DESVTWVCGGTBNG-QUCCMNQESA-N 1 1 367.493 4.118 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483240517 1113469762 /nfs/dbraw/zinc/46/97/62/1113469762.db2.gz RIZCLZXBVFSEOJ-ZFWWWQNUSA-N 1 1 358.442 4.464 20 5 FIBDMO C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486551910 1113593072 /nfs/dbraw/zinc/59/30/72/1113593072.db2.gz UJUGEQLAUDSFOO-AYPAESJBSA-N 1 1 365.477 4.108 20 5 FIBDMO C[C@H](NC/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486551910 1113593075 /nfs/dbraw/zinc/59/30/75/1113593075.db2.gz UJUGEQLAUDSFOO-AYPAESJBSA-N 1 1 365.477 4.108 20 5 FIBDMO CC(C)[C@@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000246651133 1113899371 /nfs/dbraw/zinc/89/93/71/1113899371.db2.gz BWNCHOFQZCSZEZ-HUUCEWRRSA-N 1 1 358.442 4.464 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000489005483 1114034100 /nfs/dbraw/zinc/03/41/00/1114034100.db2.gz QEOZCDAWNYDGBM-ZBFHGGJFSA-N 1 1 359.401 4.042 20 5 FIBDMO COc1cc(C[N@H+](C)Cc2cccc(OC(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000490097672 1114214866 /nfs/dbraw/zinc/21/48/66/1114214866.db2.gz ALIURXIULMGCJA-UHFFFAOYSA-N 1 1 370.327 4.134 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2cccc(OC(F)(F)F)c2)ccc1[N+](=O)[O-] ZINC000490097672 1114214869 /nfs/dbraw/zinc/21/48/69/1114214869.db2.gz ALIURXIULMGCJA-UHFFFAOYSA-N 1 1 370.327 4.134 20 5 FIBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)cc1 ZINC000490083925 1114216274 /nfs/dbraw/zinc/21/62/74/1114216274.db2.gz VECSPTUTRZSQDP-DOTOQJQBSA-N 1 1 368.433 4.148 20 5 FIBDMO COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000490087977 1114216908 /nfs/dbraw/zinc/21/69/08/1114216908.db2.gz FCLNMDMRRLFUQE-KRWDZBQOSA-N 1 1 364.829 4.076 20 5 FIBDMO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000490087977 1114216911 /nfs/dbraw/zinc/21/69/11/1114216911.db2.gz FCLNMDMRRLFUQE-KRWDZBQOSA-N 1 1 364.829 4.076 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@@H]2c2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000490207731 1114232399 /nfs/dbraw/zinc/23/23/99/1114232399.db2.gz LVZYFKIEJQCZKQ-LJQANCHMSA-N 1 1 350.422 4.127 20 5 FIBDMO Cc1c(C[N@@H+]2CCC[C@@H]2c2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000490207731 1114232407 /nfs/dbraw/zinc/23/24/07/1114232407.db2.gz LVZYFKIEJQCZKQ-LJQANCHMSA-N 1 1 350.422 4.127 20 5 FIBDMO CCN(Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000490430387 1114290180 /nfs/dbraw/zinc/29/01/80/1114290180.db2.gz HPUIATFMGSLJNC-GOSISDBHSA-N 1 1 371.456 4.078 20 5 FIBDMO C[N@@H+](CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000491035701 1114364956 /nfs/dbraw/zinc/36/49/56/1114364956.db2.gz JRYIZICOBCCNOJ-OAQYLSRUSA-N 1 1 353.466 4.148 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H](N[C@@H]2CC[N@H+](C3CCCC3)C2)c2ccccc2)c1 ZINC000491060505 1114368561 /nfs/dbraw/zinc/36/85/61/1114368561.db2.gz ODLKPGXYMVLHPR-KNQAVFIVSA-N 1 1 365.477 4.291 20 5 FIBDMO COc1cc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000491094298 1114372797 /nfs/dbraw/zinc/37/27/97/1114372797.db2.gz XVGYBWVNWJQRSX-TXEJJXNPSA-N 1 1 358.385 4.010 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCc1ccc(F)cc1 ZINC000055023316 1114412161 /nfs/dbraw/zinc/41/21/61/1114412161.db2.gz OPQSPASLHUXEGT-ZDUSSCGKSA-N 1 1 370.384 4.019 20 5 FIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1cccc(OC)c1 ZINC000045806165 1115087236 /nfs/dbraw/zinc/08/72/36/1115087236.db2.gz DUFQUYNANZDSSP-CQSZACIVSA-N 1 1 372.421 4.053 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1cccc(OC)c1 ZINC000045806165 1115087238 /nfs/dbraw/zinc/08/72/38/1115087238.db2.gz DUFQUYNANZDSSP-CQSZACIVSA-N 1 1 372.421 4.053 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H](O)CC1 ZINC000592130392 1115204489 /nfs/dbraw/zinc/20/44/89/1115204489.db2.gz HFUMQUCNMHSXPI-WGSAOQKQSA-N 1 1 358.413 4.040 20 5 FIBDMO Cc1ccccc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592130379 1115204898 /nfs/dbraw/zinc/20/48/98/1115204898.db2.gz GFDJSGWAADNLOJ-MXVIHJGJSA-N 1 1 354.450 4.209 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC3(CC3(F)F)CC2)c1 ZINC000593073036 1115299402 /nfs/dbraw/zinc/29/94/02/1115299402.db2.gz OCWYWGSMMSOBMT-UHFFFAOYSA-N 1 1 350.287 4.235 20 5 FIBDMO CC[N@@H+](Cc1cccs1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157798514 1115320064 /nfs/dbraw/zinc/32/00/64/1115320064.db2.gz FQDXGXNEQZJBHK-UHFFFAOYSA-N 1 1 355.257 4.441 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC001168404596 1115433985 /nfs/dbraw/zinc/43/39/85/1115433985.db2.gz SUOHCYMFPYJIHW-UGFHNGPFSA-N 1 1 353.260 4.368 20 5 FIBDMO COc1cc(F)c([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1OC ZINC000574702991 1115440667 /nfs/dbraw/zinc/44/06/67/1115440667.db2.gz KFWQZOFYYZMOAX-BDJLRTHQSA-N 1 1 360.385 4.089 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1c(F)cccc1N1CCCC1 ZINC000594505008 1115451465 /nfs/dbraw/zinc/45/14/65/1115451465.db2.gz XWAPCIZESDVFNG-SFHVURJKSA-N 1 1 355.413 4.111 20 5 FIBDMO COc1ccc(Cl)cc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595012977 1115503597 /nfs/dbraw/zinc/50/35/97/1115503597.db2.gz HMHBHMBEAWTZJO-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014418 1115504124 /nfs/dbraw/zinc/50/41/24/1115504124.db2.gz PIYLDONDXDWIMQ-ACJLOTCBSA-N 1 1 356.422 4.340 20 5 FIBDMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000594983754 1115505507 /nfs/dbraw/zinc/50/55/07/1115505507.db2.gz NCXSBFIHLWMPGE-UHFFFAOYSA-N 1 1 366.421 4.146 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccnc(OC2CCCC2)c1 ZINC000595008180 1115507852 /nfs/dbraw/zinc/50/78/52/1115507852.db2.gz RVCCHXIUWUQYNZ-CQSZACIVSA-N 1 1 371.437 4.171 20 5 FIBDMO C[C@H]([NH2+][C@H]1C[C@H](C)n2ncnc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000595064150 1115508880 /nfs/dbraw/zinc/50/88/80/1115508880.db2.gz DPKDFWXYZDDGIN-OBJOEFQTSA-N 1 1 369.450 4.271 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccc(OC2CC2)c1F ZINC000595068308 1115509493 /nfs/dbraw/zinc/50/94/93/1115509493.db2.gz JHXBVSYAIHVTFL-LBPRGKRZSA-N 1 1 360.385 4.135 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCCOc2cc(F)ccc21 ZINC000595026734 1115510257 /nfs/dbraw/zinc/51/02/57/1115510257.db2.gz IGIVSDSXPABTLV-SJCJKPOMSA-N 1 1 360.385 4.307 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cc(Cl)cc2c1OCC2 ZINC000595030913 1115510781 /nfs/dbraw/zinc/51/07/81/1115510781.db2.gz CIGAZXYYQKBSNS-NSHDSACASA-N 1 1 362.813 4.043 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000595052173 1115512502 /nfs/dbraw/zinc/51/25/02/1115512502.db2.gz QPWOYPDDMHIKPA-SJKOYZFVSA-N 1 1 364.829 4.031 20 5 FIBDMO Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]Cc1onc(C)c1[N+](=O)[O-] ZINC000595429581 1115535249 /nfs/dbraw/zinc/53/52/49/1115535249.db2.gz GLQQHGZVDHMPMB-HNNXBMFYSA-N 1 1 357.435 4.335 20 5 FIBDMO CC(C)n1cc(C2=CCC[N@H+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)nn1 ZINC000595518305 1115540049 /nfs/dbraw/zinc/54/00/49/1115540049.db2.gz UYIPFKPKEIAVMQ-OAHLLOKOSA-N 1 1 355.442 4.008 20 5 FIBDMO CC(C)n1cc(C2=CCC[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)nn1 ZINC000595518304 1115540203 /nfs/dbraw/zinc/54/02/03/1115540203.db2.gz UYIPFKPKEIAVMQ-HNNXBMFYSA-N 1 1 355.442 4.008 20 5 FIBDMO CC[C@@H](c1ccccc1)[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C(C)C ZINC000595857598 1115564553 /nfs/dbraw/zinc/56/45/53/1115564553.db2.gz OUROTSOXJANODB-SFHVURJKSA-N 1 1 355.438 4.055 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc(O[C@@H]2CCOC2)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000596980195 1115631232 /nfs/dbraw/zinc/63/12/32/1115631232.db2.gz VOARRJMKYOTLBB-OAQYLSRUSA-N 1 1 370.449 4.173 20 5 FIBDMO O=C(c1ccc(Cl)cc1)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000060482339 1115645685 /nfs/dbraw/zinc/64/56/85/1115645685.db2.gz KAKYWYSUOJSIBS-UHFFFAOYSA-N 1 1 358.825 4.343 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC3(COC3)C2)ccc1Oc1ccccc1Cl ZINC000597231492 1115650109 /nfs/dbraw/zinc/65/01/09/1115650109.db2.gz YLJUYNRFDVKEFV-UHFFFAOYSA-N 1 1 374.824 4.263 20 5 FIBDMO Cc1ccc(C(C)(C)[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)cn1 ZINC000602611537 1115715778 /nfs/dbraw/zinc/71/57/78/1115715778.db2.gz FMRGUZLYUACYMS-UHFFFAOYSA-N 1 1 370.272 4.147 20 5 FIBDMO COc1ccc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1F ZINC000598996786 1115777627 /nfs/dbraw/zinc/77/76/27/1115777627.db2.gz NJIYGWNAZRPYLO-UHFFFAOYSA-N 1 1 352.793 4.421 20 5 FIBDMO CC(C)(C)OC(=O)[C@@H]1C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)c2ccccc21 ZINC000593691717 1115797272 /nfs/dbraw/zinc/79/72/72/1115797272.db2.gz SAWMCIVKPFGWCJ-CVEARBPZSA-N 1 1 374.462 4.316 20 5 FIBDMO Cc1cccc2c1CC[N@@H+]([C@H](C)c1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000170922599 1115803831 /nfs/dbraw/zinc/80/38/31/1115803831.db2.gz ZEYBCFQYEKDGQS-CQSZACIVSA-N 1 1 364.405 4.073 20 5 FIBDMO Cc1cccc2c1CC[N@H+]([C@H](C)c1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000170922599 1115803834 /nfs/dbraw/zinc/80/38/34/1115803834.db2.gz ZEYBCFQYEKDGQS-CQSZACIVSA-N 1 1 364.405 4.073 20 5 FIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000604521402 1115867053 /nfs/dbraw/zinc/86/70/53/1115867053.db2.gz HXOQFKNHUNIWON-RXVVDRJESA-N 1 1 370.449 4.073 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000604492282 1115867820 /nfs/dbraw/zinc/86/78/20/1115867820.db2.gz PSYFMEQPIROKNJ-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(c2ccc3cccnc3n2)CC1 ZINC000594020067 1115962263 /nfs/dbraw/zinc/96/22/63/1115962263.db2.gz VAVJUDAXEOCVCX-UHFFFAOYSA-N 1 1 366.396 4.057 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3cccc(OC(F)(F)F)c3)CC2)cs1 ZINC000594035811 1115972732 /nfs/dbraw/zinc/97/27/32/1115972732.db2.gz WNKSKGVOXROGJL-UHFFFAOYSA-N 1 1 358.341 4.334 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H]3CC3CCCC3)o2)cc1 ZINC000594052352 1115979587 /nfs/dbraw/zinc/97/95/87/1115979587.db2.gz FBZMMIHLLUYOCJ-KRWDZBQOSA-N 1 1 356.426 4.190 20 5 FIBDMO CC[C@H]1c2ccsc2CC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000063499028 1116075141 /nfs/dbraw/zinc/07/51/41/1116075141.db2.gz CZVVPPPXNKZYHK-INIZCTEOSA-N 1 1 373.478 4.303 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@@H+]1CCCC[C@@H]1C ZINC000608836450 1116131363 /nfs/dbraw/zinc/13/13/63/1116131363.db2.gz YOJKWFJRZYJBSD-HOTGVXAUSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@H+]1CCCC[C@@H]1C ZINC000608836450 1116131364 /nfs/dbraw/zinc/13/13/64/1116131364.db2.gz YOJKWFJRZYJBSD-HOTGVXAUSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@@H+]1CCCC[C@H]1C ZINC000608836449 1116131373 /nfs/dbraw/zinc/13/13/73/1116131373.db2.gz YOJKWFJRZYJBSD-CVEARBPZSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@H+]1CCCC[C@H]1C ZINC000608836449 1116131374 /nfs/dbraw/zinc/13/13/74/1116131374.db2.gz YOJKWFJRZYJBSD-CVEARBPZSA-N 1 1 357.454 4.207 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)cccc1[N+](=O)[O-] ZINC000608977562 1116139328 /nfs/dbraw/zinc/13/93/28/1116139328.db2.gz QVUMDPUHKIXQQQ-SFHVURJKSA-N 1 1 354.406 4.012 20 5 FIBDMO C[C@@H]1C[C@H](N(C)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000491228788 1116226129 /nfs/dbraw/zinc/22/61/29/1116226129.db2.gz SHXZGAFUMYAYMG-VQIMIIECSA-N 1 1 371.456 4.219 20 5 FIBDMO CC[N@@H+](CCc1ccccc1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534810486 1116238215 /nfs/dbraw/zinc/23/82/15/1116238215.db2.gz PIVDWXICAUGOLE-UHFFFAOYSA-N 1 1 351.406 4.314 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1ccc(OCC(F)(F)F)cc1)C2 ZINC000535248884 1116286908 /nfs/dbraw/zinc/28/69/08/1116286908.db2.gz WVVRKSGOVLXLIP-UHFFFAOYSA-N 1 1 366.339 4.094 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1ccc(OCC(F)(F)F)cc1)C2 ZINC000535248884 1116286909 /nfs/dbraw/zinc/28/69/09/1116286909.db2.gz WVVRKSGOVLXLIP-UHFFFAOYSA-N 1 1 366.339 4.094 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000535376713 1116300892 /nfs/dbraw/zinc/30/08/92/1116300892.db2.gz ZQOFGCFWMCYXAS-CYBMUJFWSA-N 1 1 356.426 4.384 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000535376713 1116300894 /nfs/dbraw/zinc/30/08/94/1116300894.db2.gz ZQOFGCFWMCYXAS-CYBMUJFWSA-N 1 1 356.426 4.384 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2Cc3ccccc3C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000535381896 1116301447 /nfs/dbraw/zinc/30/14/47/1116301447.db2.gz DOKFSHHSWXPKCO-UHFFFAOYSA-N 1 1 367.449 4.025 20 5 FIBDMO CC(C)c1ccc([C@@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000535383161 1116301486 /nfs/dbraw/zinc/30/14/86/1116301486.db2.gz ONPZJMUMHWAYJA-IBGZPJMESA-N 1 1 367.449 4.154 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](C[C@H]3CCCO3)C3CCCC3)co2)cc1 ZINC000089905831 1116346913 /nfs/dbraw/zinc/34/69/13/1116346913.db2.gz YDPFUPUHPFAZRI-LJQANCHMSA-N 1 1 371.437 4.173 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](C[C@@H]3CCCO3)C3CCCC3)co2)cc1 ZINC000089905828 1116346932 /nfs/dbraw/zinc/34/69/32/1116346932.db2.gz YDPFUPUHPFAZRI-IBGZPJMESA-N 1 1 371.437 4.173 20 5 FIBDMO C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1nc(-c2cccc(F)c2)no1 ZINC000462757358 1117758512 /nfs/dbraw/zinc/75/85/12/1117758512.db2.gz SKKHSOKUGDFMOH-DMTLFAOVSA-N 1 1 368.368 4.148 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCOc3c(F)ccc(F)c31)CCC2 ZINC000462963582 1117884528 /nfs/dbraw/zinc/88/45/28/1117884528.db2.gz HEGKUANIYUGHSP-IAGOWNOFSA-N 1 1 360.360 4.364 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@](CO)(Cc2ccccc2)C1 ZINC000463433793 1118153508 /nfs/dbraw/zinc/15/35/08/1118153508.db2.gz YJESBRCOWWQDAB-XMSQKQJNSA-N 1 1 368.477 4.281 20 5 FIBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463440361 1118164873 /nfs/dbraw/zinc/16/48/73/1118164873.db2.gz FPCRSULCOSAJAD-RISCZKNCSA-N 1 1 356.348 4.024 20 5 FIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463440361 1118164875 /nfs/dbraw/zinc/16/48/75/1118164875.db2.gz FPCRSULCOSAJAD-RISCZKNCSA-N 1 1 356.348 4.024 20 5 FIBDMO COc1cc(C[NH+]2CCC(OC3CCCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000463505852 1118184155 /nfs/dbraw/zinc/18/41/55/1118184155.db2.gz PINFOSBORBMETF-UHFFFAOYSA-N 1 1 366.433 4.056 20 5 FIBDMO C[C@@H]1CC[C@]2(CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000541019605 1118356408 /nfs/dbraw/zinc/35/64/08/1118356408.db2.gz FJXIPSFLPBLOTB-QRWLVFNGSA-N 1 1 355.438 4.304 20 5 FIBDMO Cc1ccc([C@@H](CC(=O)OC(C)C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000541205162 1118423021 /nfs/dbraw/zinc/42/30/21/1118423021.db2.gz QKEWLGJOCJTWMI-MRXNPFEDSA-N 1 1 362.451 4.137 20 5 FIBDMO C[N@@H+](CCCNc1ccc2ncccc2c1[N+](=O)[O-])Cc1ccccc1 ZINC000386566051 1118479144 /nfs/dbraw/zinc/47/91/44/1118479144.db2.gz OWSJYUSMRTZOOJ-UHFFFAOYSA-N 1 1 350.422 4.077 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCOc2cc(C)c(C)cc21 ZINC000541566929 1118557831 /nfs/dbraw/zinc/55/78/31/1118557831.db2.gz YHOPJGDUFANSNJ-GOSISDBHSA-N 1 1 356.422 4.224 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H](C)c3cccnc3)o2)c([N+](=O)[O-])c1 ZINC000541759979 1118633312 /nfs/dbraw/zinc/63/33/12/1118633312.db2.gz BKMNYSKGGROSOO-AWEZNQCLSA-N 1 1 367.405 4.451 20 5 FIBDMO COc1ccc(OCC[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2F)c([N+](=O)[O-])c1 ZINC000464727292 1118674059 /nfs/dbraw/zinc/67/40/59/1118674059.db2.gz VFZXZPRKYLSQRZ-KSSFIOAISA-N 1 1 374.412 4.204 20 5 FIBDMO C[C@@H](c1ccc(F)cc1F)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000464784562 1118694105 /nfs/dbraw/zinc/69/41/05/1118694105.db2.gz YWIDNXYETCGRMN-ZDUSSCGKSA-N 1 1 362.376 4.477 20 5 FIBDMO C[C@H](c1ccc(F)cc1F)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000464784561 1118694210 /nfs/dbraw/zinc/69/42/10/1118694210.db2.gz YWIDNXYETCGRMN-CYBMUJFWSA-N 1 1 362.376 4.477 20 5 FIBDMO CCC[C@H]([NH2+][C@H](C)c1cn(-c2ccccc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000090449818 1119161550 /nfs/dbraw/zinc/16/15/50/1119161550.db2.gz OUGAISAXUXDYHG-BEFAXECRSA-N 1 1 365.437 4.368 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000492912784 1119212492 /nfs/dbraw/zinc/21/24/92/1119212492.db2.gz QCGWLFRTFLOPAQ-HRAATJIYSA-N 1 1 352.434 4.138 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@]2(CCc3ccccc32)C1 ZINC000492912784 1119212498 /nfs/dbraw/zinc/21/24/98/1119212498.db2.gz QCGWLFRTFLOPAQ-HRAATJIYSA-N 1 1 352.434 4.138 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](CCCO)[C@H]2CCc3ccccc32)cc1Cl ZINC000761510140 1119404638 /nfs/dbraw/zinc/40/46/38/1119404638.db2.gz DOZBZNVQCSOWPC-SFHVURJKSA-N 1 1 360.841 4.120 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000494262285 1119814405 /nfs/dbraw/zinc/81/44/05/1119814405.db2.gz NDOGBYRROSUPBF-DTQAZKPQSA-N 1 1 367.449 4.267 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000494294112 1119822769 /nfs/dbraw/zinc/82/27/69/1119822769.db2.gz WLOKGRNXNCVAMZ-NTCAYCPXSA-N 1 1 364.405 4.180 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000494294112 1119822774 /nfs/dbraw/zinc/82/27/74/1119822774.db2.gz WLOKGRNXNCVAMZ-NTCAYCPXSA-N 1 1 364.405 4.180 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000609195453 1119842124 /nfs/dbraw/zinc/84/21/24/1119842124.db2.gz YLOIDUDRSQRXAU-HNNXBMFYSA-N 1 1 358.385 4.215 20 5 FIBDMO CCc1cccnc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494445438 1119863080 /nfs/dbraw/zinc/86/30/80/1119863080.db2.gz JFAHABKDUYWGLT-LLVKDONJSA-N 1 1 353.344 4.422 20 5 FIBDMO COc1ccccc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494513942 1119884461 /nfs/dbraw/zinc/88/44/61/1119884461.db2.gz MODMBGPPHKAZQS-NSHDSACASA-N 1 1 354.328 4.473 20 5 FIBDMO COC[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc(F)c(F)c1 ZINC000193068439 1120349060 /nfs/dbraw/zinc/34/90/60/1120349060.db2.gz PMGUVMGWIGUEIZ-RBUKOAKNSA-N 1 1 362.376 4.228 20 5 FIBDMO COC[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc(F)c(F)c1 ZINC000193068394 1120349181 /nfs/dbraw/zinc/34/91/81/1120349181.db2.gz PMGUVMGWIGUEIZ-MOPGFXCFSA-N 1 1 362.376 4.228 20 5 FIBDMO C[C@@H]1C[C@@H]1c1ccc(C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000153689173 1121027142 /nfs/dbraw/zinc/02/71/42/1121027142.db2.gz HYYBIVNQNJYSSZ-VMDGZTHMSA-N 1 1 356.422 4.009 20 5 FIBDMO CC(=O)c1c(NCc2ccccc2C[N@H+](C)C(C)C)cccc1[N+](=O)[O-] ZINC000763205154 1121273571 /nfs/dbraw/zinc/27/35/71/1121273571.db2.gz YSKWZTRMPJWRFK-UHFFFAOYSA-N 1 1 355.438 4.250 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000917082346 1122082008 /nfs/dbraw/zinc/08/20/08/1122082008.db2.gz QGLPCCVKSHJELP-ZJUUUORDSA-N 1 1 363.767 4.306 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000497389456 1122202354 /nfs/dbraw/zinc/20/23/54/1122202354.db2.gz MPSBYZVKXWCCHT-HXUWFJFHSA-N 1 1 355.438 4.171 20 5 FIBDMO CCC1CCC([N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C2CC2)CC1 ZINC000917440619 1122306515 /nfs/dbraw/zinc/30/65/15/1122306515.db2.gz XDRLYTXOABCYEM-UHFFFAOYSA-N 1 1 369.469 4.244 20 5 FIBDMO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000609280652 1122686072 /nfs/dbraw/zinc/68/60/72/1122686072.db2.gz IUCHUKCNNNCTDM-KRWDZBQOSA-N 1 1 356.422 4.339 20 5 FIBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000609280652 1122686075 /nfs/dbraw/zinc/68/60/75/1122686075.db2.gz IUCHUKCNNNCTDM-KRWDZBQOSA-N 1 1 356.422 4.339 20 5 FIBDMO C[N@H+](Cc1ccc(OCc2ccccn2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000195178077 1123255589 /nfs/dbraw/zinc/25/55/89/1123255589.db2.gz XNKANJNDFMMYFO-UHFFFAOYSA-N 1 1 363.417 4.201 20 5 FIBDMO C[N@@H+](Cc1ccc(OCc2ccccn2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000195178077 1123255592 /nfs/dbraw/zinc/25/55/92/1123255592.db2.gz XNKANJNDFMMYFO-UHFFFAOYSA-N 1 1 363.417 4.201 20 5 FIBDMO CC[N@@H+](Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[C@@H](C)CO ZINC000556946940 1123266700 /nfs/dbraw/zinc/26/67/00/1123266700.db2.gz TUUIGGUUSJGSAJ-ZDUSSCGKSA-N 1 1 364.829 4.243 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCc2sccc2C1 ZINC000609322829 1123548597 /nfs/dbraw/zinc/54/85/97/1123548597.db2.gz MUDQGKVVDLFCDS-LBPRGKRZSA-N 1 1 370.434 4.216 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCc2sccc2C1 ZINC000609322829 1123548603 /nfs/dbraw/zinc/54/86/03/1123548603.db2.gz MUDQGKVVDLFCDS-LBPRGKRZSA-N 1 1 370.434 4.216 20 5 FIBDMO O=[N+]([O-])c1sccc1N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000609625336 1123773100 /nfs/dbraw/zinc/77/31/00/1123773100.db2.gz IRNWDHCOYVGXJX-ZDUSSCGKSA-N 1 1 371.384 4.362 20 5 FIBDMO CC[N@H+]1CCCC[C@@H]1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609762404 1123835008 /nfs/dbraw/zinc/83/50/08/1123835008.db2.gz IBMZKMYFADFDSP-LJQANCHMSA-N 1 1 369.421 4.200 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000610151081 1123948681 /nfs/dbraw/zinc/94/86/81/1123948681.db2.gz PIVDRMNTYCIGRL-UHFFFAOYSA-N 1 1 371.437 4.088 20 5 FIBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000615842169 1124134738 /nfs/dbraw/zinc/13/47/38/1124134738.db2.gz FEGMVQOEJMOUPX-RCBBPTIPSA-N 1 1 358.360 4.041 20 5 FIBDMO COC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 ZINC000091413647 1124385519 /nfs/dbraw/zinc/38/55/19/1124385519.db2.gz LJCURUCQAWBVRP-PXAZEXFGSA-N 1 1 350.365 4.220 20 5 FIBDMO Cc1cc(NC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000153818104 1124527917 /nfs/dbraw/zinc/52/79/17/1124527917.db2.gz WSWKRKZSMXPPMO-IRXDYDNUSA-N 1 1 374.485 4.022 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](c4ccc(Cl)cc4)C3)nc2c1 ZINC000444656128 1124751649 /nfs/dbraw/zinc/75/16/49/1124751649.db2.gz ZNXRBIFBEMMDOI-ZDUSSCGKSA-N 1 1 356.813 4.114 20 5 FIBDMO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)CCO2 ZINC000181281815 1124818339 /nfs/dbraw/zinc/81/83/39/1124818339.db2.gz IKNVHNYLXIEAMZ-QGZVFWFLSA-N 1 1 362.813 4.260 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000301647943 1124826566 /nfs/dbraw/zinc/82/65/66/1124826566.db2.gz FDMCAGMRANHKHA-AWEZNQCLSA-N 1 1 366.893 4.124 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000181920744 1125184570 /nfs/dbraw/zinc/18/45/70/1125184570.db2.gz JAOCONVOAYYWGF-NSHDSACASA-N 1 1 365.227 4.217 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+]C1(c2ccc3c(c2)OCCO3)CCCC1 ZINC000113930459 1125308577 /nfs/dbraw/zinc/30/85/77/1125308577.db2.gz SXUUYPVMUUQHOT-UHFFFAOYSA-N 1 1 372.396 4.064 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H](C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000109093173 209298246 /nfs/dbraw/zinc/29/82/46/209298246.db2.gz TYNKWRGRICJEEK-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000109093821 209297532 /nfs/dbraw/zinc/29/75/32/209297532.db2.gz CBHCQRPJEZVLOA-LJQANCHMSA-N 1 1 353.422 4.069 20 5 FIBDMO CCN(Cc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000517900737 567829352 /nfs/dbraw/zinc/82/93/52/567829352.db2.gz VAOCCPZATYKCRX-YLJYHZDGSA-N 1 1 353.466 4.252 20 5 FIBDMO CCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H]1CCCc2cccnc21 ZINC000481397122 567892307 /nfs/dbraw/zinc/89/23/07/567892307.db2.gz BDVMUHLGCIMJJL-KRWDZBQOSA-N 1 1 355.438 4.288 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481696853 568092063 /nfs/dbraw/zinc/09/20/63/568092063.db2.gz VZNFHZDGPLAPRV-OAQYLSRUSA-N 1 1 368.433 4.015 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000481696853 568092064 /nfs/dbraw/zinc/09/20/64/568092064.db2.gz VZNFHZDGPLAPRV-OAQYLSRUSA-N 1 1 368.433 4.015 20 5 FIBDMO CC[C@H](C[N@@H+](CC)CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000481747656 568108416 /nfs/dbraw/zinc/10/84/16/568108416.db2.gz HXSIWKHAWRBACC-QGZVFWFLSA-N 1 1 369.465 4.357 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)c1 ZINC000568998108 568265510 /nfs/dbraw/zinc/26/55/10/568265510.db2.gz YGMYVAPFVGRGBP-WBMJQRKESA-N 1 1 358.360 4.005 20 5 FIBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541998954 568394401 /nfs/dbraw/zinc/39/44/01/568394401.db2.gz JJWSCOLIJQJFOK-ZDUSSCGKSA-N 1 1 368.861 4.192 20 5 FIBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000541998954 568394402 /nfs/dbraw/zinc/39/44/02/568394402.db2.gz JJWSCOLIJQJFOK-ZDUSSCGKSA-N 1 1 368.861 4.192 20 5 FIBDMO Cc1cccc([C@@H]2CC[N@H+]([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000569386203 568400087 /nfs/dbraw/zinc/40/00/87/568400087.db2.gz WFRQKJITAOBGRX-SJLPKXTDSA-N 1 1 367.449 4.028 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ccc(F)cc1F)C(C)C ZINC000430211427 1079968719 /nfs/dbraw/zinc/96/87/19/1079968719.db2.gz JFHXHANUZBDBRT-GOSISDBHSA-N 1 1 350.365 4.369 20 5 FIBDMO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccccc1OC(F)F ZINC000430218246 1080003973 /nfs/dbraw/zinc/00/39/73/1080003973.db2.gz JCAWPKNNUPUZGQ-OAHLLOKOSA-N 1 1 366.364 4.446 20 5 FIBDMO Cc1c(NC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000118792956 1080179873 /nfs/dbraw/zinc/17/98/73/1080179873.db2.gz BWZBKMLQGFNWQL-DOTOQJQBSA-N 1 1 374.485 4.022 20 5 FIBDMO COc1cccc(C2([NH2+]Cc3cc([N+](=O)[O-])ccc3OC(C)C)CC2)c1 ZINC000510126264 1080192191 /nfs/dbraw/zinc/19/21/91/1080192191.db2.gz ASUBSJWFKZLXED-UHFFFAOYSA-N 1 1 356.422 4.170 20 5 FIBDMO COc1ccc(C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](C)C2CC2)cc1 ZINC001167131408 1080661886 /nfs/dbraw/zinc/66/18/86/1080661886.db2.gz OQCJCDIFEVAHGH-MRXNPFEDSA-N 1 1 370.449 4.283 20 5 FIBDMO Cc1c(CN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000379652728 1081842617 /nfs/dbraw/zinc/84/26/17/1081842617.db2.gz XUNUPXPIQXZDGJ-OXQOHEQNSA-N 1 1 353.466 4.046 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2cncc3ccccc32)CC1 ZINC000580333811 1081853682 /nfs/dbraw/zinc/85/36/82/1081853682.db2.gz ZPAFMVBDJCFPHW-MRXNPFEDSA-N 1 1 362.433 4.026 20 5 FIBDMO C[C@@H](c1ccccc1)[NH+]1CCC(N[C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000581142670 1082342103 /nfs/dbraw/zinc/34/21/03/1082342103.db2.gz PPIPJEGPZOHRRY-KKSFZXQISA-N 1 1 365.477 4.397 20 5 FIBDMO COc1cc(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)c([N+](=O)[O-])cc1OC ZINC000157016354 1082426827 /nfs/dbraw/zinc/42/68/27/1082426827.db2.gz OCNQAKDYVZUJBJ-QGZVFWFLSA-N 1 1 371.437 4.124 20 5 FIBDMO COc1cc(C[N@H+]2CCCCC[C@@H]2c2ccncc2)c([N+](=O)[O-])cc1OC ZINC000157016354 1082426830 /nfs/dbraw/zinc/42/68/30/1082426830.db2.gz OCNQAKDYVZUJBJ-QGZVFWFLSA-N 1 1 371.437 4.124 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC1CCC1 ZINC001167453965 1082447943 /nfs/dbraw/zinc/44/79/43/1082447943.db2.gz PJLCGCBBOILQMS-IERDGZPVSA-N 1 1 354.450 4.492 20 5 FIBDMO C[C@@H]1C[C@@H](N(C)Cc2csc([N+](=O)[O-])c2)CC[N@H+]1Cc1ccccc1 ZINC000157071665 1082454236 /nfs/dbraw/zinc/45/42/36/1082454236.db2.gz GMCVRSCTZDGNIN-QAPCUYQASA-N 1 1 359.495 4.141 20 5 FIBDMO Cc1ccc(C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)cc1C ZINC001167467065 1082629874 /nfs/dbraw/zinc/62/98/74/1082629874.db2.gz CSBPATOIIAXKAM-UHFFFAOYSA-N 1 1 367.449 4.205 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175910863 1082704280 /nfs/dbraw/zinc/70/42/80/1082704280.db2.gz GGJXWJLSDJASDK-ABSDTBQOSA-N 1 1 353.466 4.299 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175910863 1082704285 /nfs/dbraw/zinc/70/42/85/1082704285.db2.gz GGJXWJLSDJASDK-ABSDTBQOSA-N 1 1 353.466 4.299 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCN(C(=O)CC2CCCC2)CC1 ZINC000581625830 1082720649 /nfs/dbraw/zinc/72/06/49/1082720649.db2.gz AKAQUFKZDDTHCF-KRWDZBQOSA-N 1 1 373.497 4.079 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN(C(=O)CC2CCCC2)CC1 ZINC000581625830 1082720655 /nfs/dbraw/zinc/72/06/55/1082720655.db2.gz AKAQUFKZDDTHCF-KRWDZBQOSA-N 1 1 373.497 4.079 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C(c3ccccc3)c3ccccc3)nc2c1 ZINC000051121768 1082721140 /nfs/dbraw/zinc/72/11/40/1082721140.db2.gz JNQIZDCFQYXCCD-UHFFFAOYSA-N 1 1 358.401 4.350 20 5 FIBDMO C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000533818368 1082846761 /nfs/dbraw/zinc/84/67/61/1082846761.db2.gz DGUQSOWQIWKZDP-HNNXBMFYSA-N 1 1 351.328 4.212 20 5 FIBDMO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OCC)CCO2 ZINC000187544940 1083029415 /nfs/dbraw/zinc/02/94/15/1083029415.db2.gz DAONSPUEOSCDFV-GOSISDBHSA-N 1 1 372.421 4.006 20 5 FIBDMO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582024 1083211702 /nfs/dbraw/zinc/21/17/02/1083211702.db2.gz JSRNVTMJEZZRBW-QGZVFWFLSA-N 1 1 367.405 4.472 20 5 FIBDMO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582024 1083211705 /nfs/dbraw/zinc/21/17/05/1083211705.db2.gz JSRNVTMJEZZRBW-QGZVFWFLSA-N 1 1 367.405 4.472 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3ccc(CC)c([N+](=O)[O-])c3)c2C1 ZINC000471885694 1083249403 /nfs/dbraw/zinc/24/94/03/1083249403.db2.gz LBMFGGBFZOKXNJ-UHFFFAOYSA-N 1 1 353.422 4.135 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3ccc(CC)c([N+](=O)[O-])c3)c2C1 ZINC000471885694 1083249408 /nfs/dbraw/zinc/24/94/08/1083249408.db2.gz LBMFGGBFZOKXNJ-UHFFFAOYSA-N 1 1 353.422 4.135 20 5 FIBDMO CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H](C)c1ccc(F)cc1 ZINC000053088796 1083670587 /nfs/dbraw/zinc/67/05/87/1083670587.db2.gz WJQYRXMINQEBKK-CYBMUJFWSA-N 1 1 370.384 4.367 20 5 FIBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H](C)c1ccc(F)cc1 ZINC000053088796 1083670601 /nfs/dbraw/zinc/67/06/01/1083670601.db2.gz WJQYRXMINQEBKK-CYBMUJFWSA-N 1 1 370.384 4.367 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(Cl)c2cccnc12 ZINC000548934329 1083849387 /nfs/dbraw/zinc/84/93/87/1083849387.db2.gz ZTSDSJADSYFCSW-UHFFFAOYSA-N 1 1 355.825 4.471 20 5 FIBDMO C[C@H](c1nc2ccccc2s1)[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065208956 1083893272 /nfs/dbraw/zinc/89/32/72/1083893272.db2.gz AXRDQEPQUZOEON-CYBMUJFWSA-N 1 1 357.435 4.276 20 5 FIBDMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065208956 1083893288 /nfs/dbraw/zinc/89/32/88/1083893288.db2.gz AXRDQEPQUZOEON-CYBMUJFWSA-N 1 1 357.435 4.276 20 5 FIBDMO C[C@H](N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000380523402 1084044525 /nfs/dbraw/zinc/04/45/25/1084044525.db2.gz CMAKKJQSTIGNCL-AGKXRFJRSA-N 1 1 365.477 4.156 20 5 FIBDMO CCO[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])C12CCCCC2 ZINC001167539407 1084493216 /nfs/dbraw/zinc/49/32/16/1084493216.db2.gz MQIIWLUUIIIFGX-QZTJIDSGSA-N 1 1 350.434 4.294 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@H](CC(C)C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC001167550539 1084673388 /nfs/dbraw/zinc/67/33/88/1084673388.db2.gz WFDPEUDZPBEOND-CYBMUJFWSA-N 1 1 372.412 4.115 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@H]1CCOC(C)(C)C1 ZINC000582270207 1084822841 /nfs/dbraw/zinc/82/28/41/1084822841.db2.gz NVHLOXBHDKAEAM-KRWDZBQOSA-N 1 1 350.459 4.162 20 5 FIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCN(c2ccccc2)C1 ZINC001167586219 1085182677 /nfs/dbraw/zinc/18/26/77/1085182677.db2.gz JCXAVPXIZMXJCP-GOSISDBHSA-N 1 1 359.857 4.349 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](Cc1ccoc1)C1CCCCC1 ZINC000124979921 1085237919 /nfs/dbraw/zinc/23/79/19/1085237919.db2.gz PIGUJDGUSDYRMP-UHFFFAOYSA-N 1 1 371.437 4.270 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000124979921 1085237927 /nfs/dbraw/zinc/23/79/27/1085237927.db2.gz PIGUJDGUSDYRMP-UHFFFAOYSA-N 1 1 371.437 4.270 20 5 FIBDMO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000115890268 1085321306 /nfs/dbraw/zinc/32/13/06/1085321306.db2.gz BPPKVIPWZIJDKF-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000115890268 1085321313 /nfs/dbraw/zinc/32/13/13/1085321313.db2.gz BPPKVIPWZIJDKF-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178651770 1085585100 /nfs/dbraw/zinc/58/51/00/1085585100.db2.gz FWVYRNZLRBPSEC-HOTGVXAUSA-N 1 1 359.495 4.219 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178651770 1085585107 /nfs/dbraw/zinc/58/51/07/1085585107.db2.gz FWVYRNZLRBPSEC-HOTGVXAUSA-N 1 1 359.495 4.219 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@H+](C)[C@@H]1c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000178658582 1085684466 /nfs/dbraw/zinc/68/44/66/1085684466.db2.gz MDOYKFVAZBFHOF-GMBSWORKSA-N 1 1 359.495 4.390 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000178658582 1085684472 /nfs/dbraw/zinc/68/44/72/1085684472.db2.gz MDOYKFVAZBFHOF-GMBSWORKSA-N 1 1 359.495 4.390 20 5 FIBDMO C[C@H](c1cccc(O)c1)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000112599080 1085943091 /nfs/dbraw/zinc/94/30/91/1085943091.db2.gz DZYLXLOCNXDPGS-CQSZACIVSA-N 1 1 367.405 4.191 20 5 FIBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000112731568 1085951844 /nfs/dbraw/zinc/95/18/44/1085951844.db2.gz ZWCWSJIZNCSOJS-IBGZPJMESA-N 1 1 366.421 4.474 20 5 FIBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC001167799441 1086430947 /nfs/dbraw/zinc/43/09/47/1086430947.db2.gz ZNUXSCVFMIAPKH-DOMZBBRYSA-N 1 1 353.850 4.087 20 5 FIBDMO CC[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nnc2n1CCCCC2 ZINC000278873792 1086503220 /nfs/dbraw/zinc/50/32/20/1086503220.db2.gz XHZLARAHZYNKNR-ROUUACIJSA-N 1 1 369.469 4.031 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1)C1CC1 ZINC000512172941 1086883514 /nfs/dbraw/zinc/88/35/14/1086883514.db2.gz QMPUSQQZYVBIRU-HNNXBMFYSA-N 1 1 367.449 4.070 20 5 FIBDMO CC[N@H+](Cc1ccccc1C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728898091 1086895950 /nfs/dbraw/zinc/89/59/50/1086895950.db2.gz WTRCTXPELWZPPK-UHFFFAOYSA-N 1 1 350.422 4.246 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000052486164 1086896201 /nfs/dbraw/zinc/89/62/01/1086896201.db2.gz WIRNUYPPNXBOKR-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO Cc1c(NC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000246101547 1086897131 /nfs/dbraw/zinc/89/71/31/1086897131.db2.gz BWZBKMLQGFNWQL-WBVHZDCISA-N 1 1 374.485 4.022 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cccc2c1C[N@@H+](CC(C)C)C2 ZINC000278658312 1087200203 /nfs/dbraw/zinc/20/02/03/1087200203.db2.gz NXUUAIZRKXQXBT-UHFFFAOYSA-N 1 1 353.422 4.127 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H]1c1cccc(F)c1 ZINC000472319507 1087295874 /nfs/dbraw/zinc/29/58/74/1087295874.db2.gz UWZFVVBRPQVOJE-ZUOKHONESA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H]1c1cccc(F)c1 ZINC000472319507 1087295877 /nfs/dbraw/zinc/29/58/77/1087295877.db2.gz UWZFVVBRPQVOJE-ZUOKHONESA-N 1 1 371.412 4.064 20 5 FIBDMO C[C@@H](c1cccc(Cl)c1)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000409852989 1087610660 /nfs/dbraw/zinc/61/06/60/1087610660.db2.gz BLFXFUUDIRTLHS-ZDUSSCGKSA-N 1 1 361.829 4.270 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000180714887 1088037160 /nfs/dbraw/zinc/03/71/60/1088037160.db2.gz FTBGQCOWZXHNAM-MLGOLLRUSA-N 1 1 360.385 4.307 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000414566736 1088833809 /nfs/dbraw/zinc/83/38/09/1088833809.db2.gz XHVQIDRUEOOYBR-RACPOZDESA-N 1 1 364.445 4.462 20 5 FIBDMO Cc1c(F)cccc1NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000434715064 1088958993 /nfs/dbraw/zinc/95/89/93/1088958993.db2.gz VTSOFDYQRQOKFC-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000505502486 1088993431 /nfs/dbraw/zinc/99/34/31/1088993431.db2.gz YBGQHYFYSAJQGG-UHFFFAOYSA-N 1 1 354.328 4.168 20 5 FIBDMO Cc1cccc(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1C ZINC000430106313 1088995162 /nfs/dbraw/zinc/99/51/62/1088995162.db2.gz PQLGNKCVHVYULU-UHFFFAOYSA-N 1 1 364.449 4.244 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](c3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000434891564 1089097281 /nfs/dbraw/zinc/09/72/81/1089097281.db2.gz IYAINUNAZZKEDM-BQFCYCMXSA-N 1 1 367.449 4.108 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[C@H]1c1ccccc1 ZINC000435027209 1089223972 /nfs/dbraw/zinc/22/39/72/1089223972.db2.gz LKKMAZCULYHXPA-WMLDXEAASA-N 1 1 351.406 4.362 20 5 FIBDMO C[C@@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1-n1cccn1 ZINC000119730443 1089687641 /nfs/dbraw/zinc/68/76/41/1089687641.db2.gz JHKADJOKRYYISH-CYBMUJFWSA-N 1 1 356.813 4.285 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CC[C@H](c3ccccc3)O2)C2CC2)c1 ZINC001167733819 1090265857 /nfs/dbraw/zinc/26/58/57/1090265857.db2.gz DPRXKLRFLYDXOI-LEWJYISDSA-N 1 1 352.434 4.480 20 5 FIBDMO COc1ccc(OC)c([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)c1 ZINC000104663308 1090288700 /nfs/dbraw/zinc/28/87/00/1090288700.db2.gz PHKKUFAGCZKJPG-AWEZNQCLSA-N 1 1 374.437 4.250 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCc1ccc(F)cc1 ZINC000104676480 1090293553 /nfs/dbraw/zinc/29/35/53/1090293553.db2.gz JWWYDFAYVVAHGZ-UHFFFAOYSA-N 1 1 369.396 4.106 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500119714 1091052023 /nfs/dbraw/zinc/05/20/23/1091052023.db2.gz AHNOCBSTDMBEJI-IAGOWNOFSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC(OC4CCC4)CC3)cs2)c1 ZINC000418088862 1091055391 /nfs/dbraw/zinc/05/53/91/1091055391.db2.gz HLBYAGVUEYSBHU-UHFFFAOYSA-N 1 1 373.478 4.252 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500130062 1091055700 /nfs/dbraw/zinc/05/57/00/1091055700.db2.gz CMLYENKFXLYARU-LIRRHRJNSA-N 1 1 371.412 4.146 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]3c3cccs3)n2)cc1 ZINC000047406649 1091715124 /nfs/dbraw/zinc/71/51/24/1091715124.db2.gz TYRIEZNAKCSDIX-CQSZACIVSA-N 1 1 356.407 4.043 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]3c3cccs3)n2)cc1 ZINC000047406649 1091715131 /nfs/dbraw/zinc/71/51/31/1091715131.db2.gz TYRIEZNAKCSDIX-CQSZACIVSA-N 1 1 356.407 4.043 20 5 FIBDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728900684 1091800992 /nfs/dbraw/zinc/80/09/92/1091800992.db2.gz PHFNSKKZMIPOKR-GOSISDBHSA-N 1 1 362.433 4.214 20 5 FIBDMO CC[C@H]1C[C@@]1([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccc(C)c1 ZINC000500532869 1092195848 /nfs/dbraw/zinc/19/58/48/1092195848.db2.gz LUNJQUVNJLROHF-UWJYYQICSA-N 1 1 368.433 4.185 20 5 FIBDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000508315651 1092239805 /nfs/dbraw/zinc/23/98/05/1092239805.db2.gz VQKVQPRSJJVXQY-DLBZAZTESA-N 1 1 361.489 4.238 20 5 FIBDMO C[NH+](C)Cc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)ccc1Cl ZINC000500788178 1092570072 /nfs/dbraw/zinc/57/00/72/1092570072.db2.gz QMVXUNLCCIHFOX-UHFFFAOYSA-N 1 1 373.796 4.308 20 5 FIBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000521813561 1092928128 /nfs/dbraw/zinc/92/81/28/1092928128.db2.gz ZIZRCKPJESWDFH-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CN1CCC[C@H](C)C1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000521813561 1092928129 /nfs/dbraw/zinc/92/81/29/1092928129.db2.gz ZIZRCKPJESWDFH-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO CC(C)c1ncc(C[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cn1 ZINC000443073855 1092934460 /nfs/dbraw/zinc/93/44/60/1092934460.db2.gz XDZHPWYVQPIEGN-UHFFFAOYSA-N 1 1 366.421 4.400 20 5 FIBDMO CC(C)c1ncc(C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cn1 ZINC000443073855 1092934462 /nfs/dbraw/zinc/93/44/62/1092934462.db2.gz XDZHPWYVQPIEGN-UHFFFAOYSA-N 1 1 366.421 4.400 20 5 FIBDMO Cc1ccn2cc(C[NH2+][C@@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000433124574 1093275071 /nfs/dbraw/zinc/27/50/71/1093275071.db2.gz DLNPJNJOOAHXSS-GOSISDBHSA-N 1 1 350.422 4.063 20 5 FIBDMO CC1(C)C[C@H]([NH2+]Cc2ccn(-c3ccccc3)n2)c2cc([N+](=O)[O-])ccc21 ZINC000433149752 1093335611 /nfs/dbraw/zinc/33/56/11/1093335611.db2.gz FBPFQQSXJJJBQF-FQEVSTJZSA-N 1 1 362.433 4.293 20 5 FIBDMO CCc1ccc([C@@H](COC)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000433268270 1093511677 /nfs/dbraw/zinc/51/16/77/1093511677.db2.gz CUAMVUBJDTZIRH-QZTJIDSGSA-N 1 1 358.438 4.450 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)c1 ZINC000474229229 1093600591 /nfs/dbraw/zinc/60/05/91/1093600591.db2.gz HSRNBESTAIWHKT-GOSISDBHSA-N 1 1 367.405 4.342 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)c1 ZINC000474229229 1093600595 /nfs/dbraw/zinc/60/05/95/1093600595.db2.gz HSRNBESTAIWHKT-GOSISDBHSA-N 1 1 367.405 4.342 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC4(CCCCO4)CC3)cs2)c1 ZINC000895654372 1093652413 /nfs/dbraw/zinc/65/24/13/1093652413.db2.gz RUSNFWWWAKZSSK-UHFFFAOYSA-N 1 1 373.478 4.253 20 5 FIBDMO CC(C)[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc(F)cc1 ZINC000047406690 1093771011 /nfs/dbraw/zinc/77/10/11/1093771011.db2.gz RKWHTOUJXZGLDY-SFHVURJKSA-N 1 1 370.384 4.271 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(C)s2)c([N+](=O)[O-])cc1OC ZINC000513485273 1094164991 /nfs/dbraw/zinc/16/49/91/1094164991.db2.gz PHVJAEIQYGNRBS-CQSZACIVSA-N 1 1 362.451 4.319 20 5 FIBDMO CC(C)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C[C@H](C)O ZINC000513656865 1094258012 /nfs/dbraw/zinc/25/80/12/1094258012.db2.gz YLMLSGDKWNTESO-LBPRGKRZSA-N 1 1 352.818 4.099 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413068789 1094409214 /nfs/dbraw/zinc/40/92/14/1094409214.db2.gz KAOVYKRBHSZKOM-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO O=[N+]([O-])c1sc(C[NH2+][C@H](c2ccccn2)C2CC2)cc1Br ZINC000896610004 1094824986 /nfs/dbraw/zinc/82/49/86/1094824986.db2.gz SBAPPQFYTCMZCY-ZDUSSCGKSA-N 1 1 368.256 4.055 20 5 FIBDMO C[N@H+](CCOc1c(Cl)cccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000501851332 1094967938 /nfs/dbraw/zinc/96/79/38/1094967938.db2.gz RMAWZBNLWIREET-UHFFFAOYSA-N 1 1 355.221 4.412 20 5 FIBDMO C[N@@H+](CCOc1c(Cl)cccc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000501851332 1094967942 /nfs/dbraw/zinc/96/79/42/1094967942.db2.gz RMAWZBNLWIREET-UHFFFAOYSA-N 1 1 355.221 4.412 20 5 FIBDMO Cc1ccc([C@H]2C[C@H](C)[N@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000501852327 1094970719 /nfs/dbraw/zinc/97/07/19/1094970719.db2.gz QTIOXBXIBINTPN-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000444162358 1095796223 /nfs/dbraw/zinc/79/62/23/1095796223.db2.gz AAITYKCCZGPGNG-ORAYPTAESA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000444162358 1095796233 /nfs/dbraw/zinc/79/62/33/1095796233.db2.gz AAITYKCCZGPGNG-ORAYPTAESA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000444162355 1095797894 /nfs/dbraw/zinc/79/78/94/1095797894.db2.gz AAITYKCCZGPGNG-BFUOFWGJSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000444162355 1095797901 /nfs/dbraw/zinc/79/79/01/1095797901.db2.gz AAITYKCCZGPGNG-BFUOFWGJSA-N 1 1 371.412 4.064 20 5 FIBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502890451 1095925132 /nfs/dbraw/zinc/92/51/32/1095925132.db2.gz AFILSRPVJOBGCX-AWEZNQCLSA-N 1 1 361.467 4.286 20 5 FIBDMO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000016587647 1095989484 /nfs/dbraw/zinc/98/94/84/1095989484.db2.gz OEJTZKUTXWOBNW-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000016587647 1095989485 /nfs/dbraw/zinc/98/94/85/1095989485.db2.gz OEJTZKUTXWOBNW-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c[nH]nc2-c2ccc(F)cc2)c(Cl)c1 ZINC000183800859 1096196818 /nfs/dbraw/zinc/19/68/18/1096196818.db2.gz KCBCEDWIINIBSY-UHFFFAOYSA-N 1 1 360.776 4.067 20 5 FIBDMO C[C@@H]1C[C@]1([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(Cl)cc1 ZINC000503369198 1096369924 /nfs/dbraw/zinc/36/99/24/1096369924.db2.gz OOUXRDPYISUACN-ADLMAVQZSA-N 1 1 356.813 4.149 20 5 FIBDMO CCCCN1CCC([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000513790469 1096435534 /nfs/dbraw/zinc/43/55/34/1096435534.db2.gz YKRSDVXULWEMLW-FXAWDEMLSA-N 1 1 359.514 4.160 20 5 FIBDMO C[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1Cl ZINC000008173452 1096796847 /nfs/dbraw/zinc/79/68/47/1096796847.db2.gz YKAACZHGDGEIEE-SNVBAGLBSA-N 1 1 368.220 4.191 20 5 FIBDMO Cc1ccccc1C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000532926241 1098596070 /nfs/dbraw/zinc/59/60/70/1098596070.db2.gz AKAOEWFOZZWSJG-UHFFFAOYSA-N 1 1 364.405 4.118 20 5 FIBDMO Cc1ccccc1C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000532926241 1098596078 /nfs/dbraw/zinc/59/60/78/1098596078.db2.gz AKAOEWFOZZWSJG-UHFFFAOYSA-N 1 1 364.405 4.118 20 5 FIBDMO CC[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])c1c(C)noc1C ZINC000425431591 1098596167 /nfs/dbraw/zinc/59/61/67/1098596167.db2.gz IPQXUQMGOAHHRX-CYBMUJFWSA-N 1 1 368.231 4.203 20 5 FIBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000532966467 1098635669 /nfs/dbraw/zinc/63/56/69/1098635669.db2.gz JHGWGKNAFOMNCU-VXGBXAGGSA-N 1 1 353.850 4.086 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532977188 1098647095 /nfs/dbraw/zinc/64/70/95/1098647095.db2.gz TZIIQEASTHKTPE-DZGCQCFKSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532977188 1098647108 /nfs/dbraw/zinc/64/71/08/1098647108.db2.gz TZIIQEASTHKTPE-DZGCQCFKSA-N 1 1 373.840 4.065 20 5 FIBDMO O=C(C[N@@H+](Cc1cccc(F)c1)C1CCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000533349909 1098986412 /nfs/dbraw/zinc/98/64/12/1098986412.db2.gz UJTIWQXABNVADQ-UHFFFAOYSA-N 1 1 371.412 4.117 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000533435038 1099054352 /nfs/dbraw/zinc/05/43/52/1099054352.db2.gz HYLFWBLEDRUPIH-ZVZYQTTQSA-N 1 1 367.449 4.108 20 5 FIBDMO CCc1cccc(C)c1NC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350448 1099343208 /nfs/dbraw/zinc/34/32/08/1099343208.db2.gz HOPBWOUCZJUBHX-UHFFFAOYSA-N 1 1 369.465 4.315 20 5 FIBDMO CCc1cccc(C)c1NC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350448 1099343221 /nfs/dbraw/zinc/34/32/21/1099343221.db2.gz HOPBWOUCZJUBHX-UHFFFAOYSA-N 1 1 369.465 4.315 20 5 FIBDMO CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)Cc1cccc(F)c1 ZINC000506045972 1099889317 /nfs/dbraw/zinc/88/93/17/1099889317.db2.gz OMQSKUXCBMXUHF-UHFFFAOYSA-N 1 1 368.412 4.157 20 5 FIBDMO COc1cc(C)c(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1OC ZINC000506045223 1099895431 /nfs/dbraw/zinc/89/54/31/1099895431.db2.gz AKLDEKKMANYFHS-CLFYSBASSA-N 1 1 356.422 4.066 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](Cc4ccncc4)C3)o2)cc1 ZINC000611983802 1100244051 /nfs/dbraw/zinc/24/40/51/1100244051.db2.gz LLCYZNKEYVRKDV-KRWDZBQOSA-N 1 1 363.417 4.314 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@@H+]1CCCC[C@H]1C ZINC000517535989 1100473133 /nfs/dbraw/zinc/47/31/33/1100473133.db2.gz SDRQPFVVYTVTAP-HZPDHXFCSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@H+]1CCCC[C@H]1C ZINC000517535989 1100473145 /nfs/dbraw/zinc/47/31/45/1100473145.db2.gz SDRQPFVVYTVTAP-HZPDHXFCSA-N 1 1 357.454 4.207 20 5 FIBDMO COCC[N@@H+](C)Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000506353554 1100910486 /nfs/dbraw/zinc/91/04/86/1100910486.db2.gz PZMKUWTWWCTYPK-UHFFFAOYSA-N 1 1 350.802 4.119 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](c2ccccc2)C[C@H]1C ZINC000439329447 1101352448 /nfs/dbraw/zinc/35/24/48/1101352448.db2.gz VHWPAHPFQGTXGK-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)C[C@H]1C ZINC000439329447 1101352460 /nfs/dbraw/zinc/35/24/60/1101352460.db2.gz VHWPAHPFQGTXGK-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO CC(C)c1ccc(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000439426463 1101423292 /nfs/dbraw/zinc/42/32/92/1101423292.db2.gz UEOHSUMWLNBDDU-INIZCTEOSA-N 1 1 361.486 4.103 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3c3ncc[nH]3)s2)cc1 ZINC000437977981 1101910949 /nfs/dbraw/zinc/91/09/49/1101910949.db2.gz LGYJHJRZDBQRIJ-INIZCTEOSA-N 1 1 354.435 4.384 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]3c3ncc[nH]3)s2)cc1 ZINC000437977981 1101910954 /nfs/dbraw/zinc/91/09/54/1101910954.db2.gz LGYJHJRZDBQRIJ-INIZCTEOSA-N 1 1 354.435 4.384 20 5 FIBDMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000506728636 1101925582 /nfs/dbraw/zinc/92/55/82/1101925582.db2.gz YHNCEEJKMJTEAZ-CYBMUJFWSA-N 1 1 368.462 4.176 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1ccccc1Cl ZINC000026224941 1101944570 /nfs/dbraw/zinc/94/45/70/1101944570.db2.gz KBBSZKBRSGISQD-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]3C3CCCCC3)n2)cc1 ZINC000532474498 1102399802 /nfs/dbraw/zinc/39/98/02/1102399802.db2.gz RVCTVITYNVQSCT-KRWDZBQOSA-N 1 1 356.426 4.190 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000532475574 1102413047 /nfs/dbraw/zinc/41/30/47/1102413047.db2.gz XUJZATGOBPMQMG-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000532485566 1102426370 /nfs/dbraw/zinc/42/63/70/1102426370.db2.gz ZFMXOCUDZMSCQW-UYAOXDASSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000532485566 1102426374 /nfs/dbraw/zinc/42/63/74/1102426374.db2.gz ZFMXOCUDZMSCQW-UYAOXDASSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000532485566 1102426376 /nfs/dbraw/zinc/42/63/76/1102426376.db2.gz ZFMXOCUDZMSCQW-UYAOXDASSA-N 1 1 367.493 4.118 20 5 FIBDMO CCC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccc(F)cc1 ZINC000532489930 1102429961 /nfs/dbraw/zinc/42/99/61/1102429961.db2.gz ZKCBLTIVKXLSHL-UHFFFAOYSA-N 1 1 370.384 4.196 20 5 FIBDMO CCC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccc(F)cc1 ZINC000532489930 1102429965 /nfs/dbraw/zinc/42/99/65/1102429965.db2.gz ZKCBLTIVKXLSHL-UHFFFAOYSA-N 1 1 370.384 4.196 20 5 FIBDMO Cc1cc(C[C@@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n[nH]1 ZINC000532627387 1102603939 /nfs/dbraw/zinc/60/39/39/1102603939.db2.gz NSKAENGSYXNNOG-GFCCVEGCSA-N 1 1 356.451 4.076 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2nccn2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000164271214 1102685735 /nfs/dbraw/zinc/68/57/35/1102685735.db2.gz YUZDUWMRSBYXMA-KRWDZBQOSA-N 1 1 364.449 4.193 20 5 FIBDMO Cc1nc2ccccc2n1C[C@@H]1CCC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000537658533 1102774051 /nfs/dbraw/zinc/77/40/51/1102774051.db2.gz LMCVEPJNRFOGOR-SFHVURJKSA-N 1 1 364.449 4.226 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3CC[C@H](c4cccc(F)c4)C3)c2)cc1 ZINC000729471011 1102869098 /nfs/dbraw/zinc/86/90/98/1102869098.db2.gz VVOYXEVKSXVIBO-KRWDZBQOSA-N 1 1 366.396 4.044 20 5 FIBDMO CC(=O)c1ccc(N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000507003703 1103042254 /nfs/dbraw/zinc/04/22/54/1103042254.db2.gz XVYFNEZWRCHHDQ-RDTXWAMCSA-N 1 1 353.422 4.045 20 5 FIBDMO C[N@@H+](Cc1ccc(OCC(F)(F)F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000507144654 1103144725 /nfs/dbraw/zinc/14/47/25/1103144725.db2.gz QHKCOWXBKRVKOG-UHFFFAOYSA-N 1 1 354.328 4.168 20 5 FIBDMO CC[N@H+](Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-])CC(C)C ZINC000507133162 1103152327 /nfs/dbraw/zinc/15/23/27/1103152327.db2.gz SRBDZUJYXUEVOO-UHFFFAOYSA-N 1 1 364.364 4.022 20 5 FIBDMO Cc1ccccc1[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000507166440 1103166971 /nfs/dbraw/zinc/16/69/71/1103166971.db2.gz WRHXDNYMBFVNAB-SJORKVTESA-N 1 1 367.449 4.028 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000532757614 1103185925 /nfs/dbraw/zinc/18/59/25/1103185925.db2.gz LZVMTJNMYGADJO-UHFFFAOYSA-N 1 1 355.438 4.062 20 5 FIBDMO CC(C)[N@H+](Cc1c[nH]c(-c2ccccc2)n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000507189947 1103205994 /nfs/dbraw/zinc/20/59/94/1103205994.db2.gz XGEUPVOSRQJYLR-UHFFFAOYSA-N 1 1 350.422 4.396 20 5 FIBDMO CC(C)[N@@H+](Cc1c[nH]c(-c2ccccc2)n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000507189947 1103206008 /nfs/dbraw/zinc/20/60/08/1103206008.db2.gz XGEUPVOSRQJYLR-UHFFFAOYSA-N 1 1 350.422 4.396 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]3[C@H]3CCCO3)s2)cc1 ZINC000551563861 1103364254 /nfs/dbraw/zinc/36/42/54/1103364254.db2.gz KWVVDPFFISGUPZ-ZWKOTPCHSA-N 1 1 358.463 4.467 20 5 FIBDMO COc1cccc([C@H](C)[NH+]2CCN([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000507750428 1104731422 /nfs/dbraw/zinc/73/14/22/1104731422.db2.gz WSEGSVVZVZVMBL-SJORKVTESA-N 1 1 369.465 4.043 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000520525563 1104975221 /nfs/dbraw/zinc/97/52/21/1104975221.db2.gz QQEGRMZFGAAOPV-AAEUAGOBSA-N 1 1 358.385 4.215 20 5 FIBDMO CC(C)CCOC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000520563934 1104997021 /nfs/dbraw/zinc/99/70/21/1104997021.db2.gz KAHMTKZWBYIPBG-UHFFFAOYSA-N 1 1 364.486 4.409 20 5 FIBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@@H](C)CO1 ZINC000508016240 1105301274 /nfs/dbraw/zinc/30/12/74/1105301274.db2.gz OPJCUQNFZXVYFZ-NWDGAFQWSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@@H](C)CO1 ZINC000508016240 1105301280 /nfs/dbraw/zinc/30/12/80/1105301280.db2.gz OPJCUQNFZXVYFZ-NWDGAFQWSA-N 1 1 350.802 4.117 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1c(F)cccc1OC(F)F ZINC000530524809 1107101506 /nfs/dbraw/zinc/10/15/06/1107101506.db2.gz XAEVNVCPGGOANV-NSHDSACASA-N 1 1 354.328 4.495 20 5 FIBDMO Cc1cccc(C)c1NC(=O)C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451551719 1107170655 /nfs/dbraw/zinc/17/06/55/1107170655.db2.gz USRLNMBALDEIJV-SFHVURJKSA-N 1 1 367.449 4.030 20 5 FIBDMO Cc1cccc(C)c1NC(=O)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451551719 1107170664 /nfs/dbraw/zinc/17/06/64/1107170664.db2.gz USRLNMBALDEIJV-SFHVURJKSA-N 1 1 367.449 4.030 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCC3CCCCC3)CC2)c(F)c1 ZINC000530863853 1107370323 /nfs/dbraw/zinc/37/03/23/1107370323.db2.gz JSZJVUCOSHRDGV-UHFFFAOYSA-N 1 1 350.434 4.295 20 5 FIBDMO C[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000248753953 1107376893 /nfs/dbraw/zinc/37/68/93/1107376893.db2.gz CJPTVENTAJLCDW-DVWBAYGPSA-N 1 1 365.477 4.441 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[C@H]1c1ccccc1 ZINC000444651928 1108049169 /nfs/dbraw/zinc/04/91/69/1108049169.db2.gz QKKTYNAHAGSCQD-RHSMWYFYSA-N 1 1 350.422 4.097 20 5 FIBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444689094 1108089546 /nfs/dbraw/zinc/08/95/46/1108089546.db2.gz MEELQDHDGXELDD-YJYMSZOUSA-N 1 1 366.421 4.063 20 5 FIBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444689094 1108089559 /nfs/dbraw/zinc/08/95/59/1108089559.db2.gz MEELQDHDGXELDD-YJYMSZOUSA-N 1 1 366.421 4.063 20 5 FIBDMO COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444689092 1108090577 /nfs/dbraw/zinc/09/05/77/1108090577.db2.gz MEELQDHDGXELDD-DJJJIMSYSA-N 1 1 366.421 4.063 20 5 FIBDMO COc1cccc([C@@H]2C[C@H](C)C[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444689092 1108090589 /nfs/dbraw/zinc/09/05/89/1108090589.db2.gz MEELQDHDGXELDD-DJJJIMSYSA-N 1 1 366.421 4.063 20 5 FIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cc2cccc(F)c2o1 ZINC000444693770 1108096776 /nfs/dbraw/zinc/09/67/76/1108096776.db2.gz PFIJLINCQDIWOB-SNVBAGLBSA-N 1 1 354.341 4.207 20 5 FIBDMO COCC[N@H+](Cc1ccco1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000508518041 1108418585 /nfs/dbraw/zinc/41/85/85/1108418585.db2.gz KVPYHNRLPFGZPX-UHFFFAOYSA-N 1 1 356.378 4.096 20 5 FIBDMO COCC[N@@H+](Cc1ccco1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000508518041 1108418591 /nfs/dbraw/zinc/41/85/91/1108418591.db2.gz KVPYHNRLPFGZPX-UHFFFAOYSA-N 1 1 356.378 4.096 20 5 FIBDMO CCc1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453342841 1108441270 /nfs/dbraw/zinc/44/12/70/1108441270.db2.gz HYQRNWADCIEMMC-UOLNFUGQSA-N 1 1 369.465 4.054 20 5 FIBDMO COCC[N@H+](Cc1ccco1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000508529305 1108743329 /nfs/dbraw/zinc/74/33/29/1108743329.db2.gz RRVLHPHTRAYXMF-UHFFFAOYSA-N 1 1 356.378 4.096 20 5 FIBDMO COCC[N@@H+](Cc1ccco1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000508529305 1108743336 /nfs/dbraw/zinc/74/33/36/1108743336.db2.gz RRVLHPHTRAYXMF-UHFFFAOYSA-N 1 1 356.378 4.096 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000524036591 1108767182 /nfs/dbraw/zinc/76/71/82/1108767182.db2.gz DYVUKQFVJBRSEN-KUHUBIRLSA-N 1 1 358.463 4.282 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@H](C)[C@H]1c1ccccc1 ZINC000524036591 1108767192 /nfs/dbraw/zinc/76/71/92/1108767192.db2.gz DYVUKQFVJBRSEN-KUHUBIRLSA-N 1 1 358.463 4.282 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000508532502 1108817255 /nfs/dbraw/zinc/81/72/55/1108817255.db2.gz SBKDAXAARZNJHF-UHFFFAOYSA-N 1 1 371.437 4.088 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H](CO)c1c(Cl)cccc1Cl ZINC000475633960 1108951033 /nfs/dbraw/zinc/95/10/33/1108951033.db2.gz HYGCVPZNCAXMQQ-ZDTYVGOBSA-N 1 1 367.232 4.238 20 5 FIBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000525127905 1109272723 /nfs/dbraw/zinc/27/27/23/1109272723.db2.gz RXRLHLQKGSRAIW-QGZVFWFLSA-N 1 1 366.421 4.098 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@H](O)[C@H](C)C3)cc2[N+](=O)[O-])cc1 ZINC000428449200 1109292526 /nfs/dbraw/zinc/29/25/26/1109292526.db2.gz SIIPYNXDKUZYHA-BEFAXECRSA-N 1 1 372.490 4.257 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@H+]3CC[C@H](O)[C@H](C)C3)cc2[N+](=O)[O-])cc1 ZINC000428449200 1109292527 /nfs/dbraw/zinc/29/25/27/1109292527.db2.gz SIIPYNXDKUZYHA-BEFAXECRSA-N 1 1 372.490 4.257 20 5 FIBDMO CC(C)C[C@@H]1CCCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000525407907 1109375667 /nfs/dbraw/zinc/37/56/67/1109375667.db2.gz KAYILKRKBYMASY-KRWDZBQOSA-N 1 1 358.442 4.436 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000441208068 1109458462 /nfs/dbraw/zinc/45/84/62/1109458462.db2.gz NUWQDLJECOAJAC-SFHVURJKSA-N 1 1 356.422 4.128 20 5 FIBDMO COc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000525707231 1109487438 /nfs/dbraw/zinc/48/74/38/1109487438.db2.gz BALAAOSUJZHFQY-UGSOOPFHSA-N 1 1 361.467 4.160 20 5 FIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525783993 1109518084 /nfs/dbraw/zinc/51/80/84/1109518084.db2.gz HSDUORZRHYVBEV-YJYMSZOUSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525783993 1109518090 /nfs/dbraw/zinc/51/80/90/1109518090.db2.gz HSDUORZRHYVBEV-YJYMSZOUSA-N 1 1 372.396 4.184 20 5 FIBDMO Cn1c(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)nc2cccc(Cl)c21 ZINC000447592214 1109590423 /nfs/dbraw/zinc/59/04/23/1109590423.db2.gz KHCOWUIUILQGBA-INIZCTEOSA-N 1 1 370.840 4.302 20 5 FIBDMO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000449363775 1110049704 /nfs/dbraw/zinc/04/97/04/1110049704.db2.gz OTXCJPSGEWBZPS-TUAOUCFPSA-N 1 1 374.359 4.013 20 5 FIBDMO COC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1Cl ZINC000450679464 1110328746 /nfs/dbraw/zinc/32/87/46/1110328746.db2.gz JPDATINAGCASFG-GFCCVEGCSA-N 1 1 362.813 4.194 20 5 FIBDMO COc1cccc([C@@H](C)[NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000539229263 1111474653 /nfs/dbraw/zinc/47/46/53/1111474653.db2.gz LIMFPOYTUWDKAK-CYBMUJFWSA-N 1 1 353.378 4.109 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC4(CCOCC4)[C@H]3C3CC3)o2)cc1 ZINC000552129822 1111594764 /nfs/dbraw/zinc/59/47/64/1111594764.db2.gz LRXGGILLNDQBEG-HXUWFJFHSA-N 1 1 368.433 4.246 20 5 FIBDMO Cn1ccnc1[C@@H]([NH2+]CCCC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000552253655 1111645594 /nfs/dbraw/zinc/64/55/94/1111645594.db2.gz NKOQCLMTTZUGBK-IBGZPJMESA-N 1 1 356.470 4.368 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1Cl ZINC000478027628 1111656014 /nfs/dbraw/zinc/65/60/14/1111656014.db2.gz LQGBNMCIDRERAP-UHFFFAOYSA-N 1 1 368.220 4.216 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)CCOc1cccc([N+](=O)[O-])c1)CCC2 ZINC000478047014 1111664284 /nfs/dbraw/zinc/66/42/84/1111664284.db2.gz KVIFQAGGHKSSJP-INIZCTEOSA-N 1 1 361.467 4.002 20 5 FIBDMO CC(C)c1[nH+]ccn1CCC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000552396613 1111693060 /nfs/dbraw/zinc/69/30/60/1111693060.db2.gz BCJWJVRUIQEWLY-UHFFFAOYSA-N 1 1 358.442 4.241 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](CO)CC2)ccc1Oc1ccc(F)cc1 ZINC000552422882 1111707981 /nfs/dbraw/zinc/70/79/81/1111707981.db2.gz HCVCAMWBTHURID-OAHLLOKOSA-N 1 1 374.412 4.121 20 5 FIBDMO C[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+]1CCCC[C@@H]1C ZINC000478641287 1111842490 /nfs/dbraw/zinc/84/24/90/1111842490.db2.gz CPELUVHRISAHTG-DLBZAZTESA-N 1 1 361.489 4.381 20 5 FIBDMO Cc1noc(C)c1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000171051155 1113304717 /nfs/dbraw/zinc/30/47/17/1113304717.db2.gz SVBWDICKSCBKQC-UHFFFAOYSA-N 1 1 361.785 4.403 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482697816 1113334866 /nfs/dbraw/zinc/33/48/66/1113334866.db2.gz WJYGMSIRVVESSF-GJZGRUSLSA-N 1 1 350.422 4.158 20 5 FIBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1cccc(OC)c1 ZINC000482701258 1113335882 /nfs/dbraw/zinc/33/58/82/1113335882.db2.gz WCUUDIXHYHMERJ-CYBMUJFWSA-N 1 1 354.410 4.063 20 5 FIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1cccc(OC)c1 ZINC000482701258 1113335886 /nfs/dbraw/zinc/33/58/86/1113335886.db2.gz WCUUDIXHYHMERJ-CYBMUJFWSA-N 1 1 354.410 4.063 20 5 FIBDMO CCC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000129134738 1113582448 /nfs/dbraw/zinc/58/24/48/1113582448.db2.gz UDPIVSNNHUDVDU-GDBMZVCRSA-N 1 1 353.426 4.138 20 5 FIBDMO CCC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000129134314 1113583127 /nfs/dbraw/zinc/58/31/27/1113583127.db2.gz UDPIVSNNHUDVDU-GOEBONIOSA-N 1 1 353.426 4.138 20 5 FIBDMO CCC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)c1nnc2ccccn21 ZINC000129193513 1113659266 /nfs/dbraw/zinc/65/92/66/1113659266.db2.gz XQWIANXTRREHSC-ZBFHGGJFSA-N 1 1 353.426 4.138 20 5 FIBDMO COc1cc(C[N@@H+](C)C2(C)CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000489895996 1114183760 /nfs/dbraw/zinc/18/37/60/1114183760.db2.gz ZRTUAKDCXLZRCP-UHFFFAOYSA-N 1 1 358.385 4.012 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000490029412 1114204577 /nfs/dbraw/zinc/20/45/77/1114204577.db2.gz JWNJZOWXUYFNEI-AZUAARDMSA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000490029412 1114204587 /nfs/dbraw/zinc/20/45/87/1114204587.db2.gz JWNJZOWXUYFNEI-AZUAARDMSA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@H]1CCN(Cc2ccccc2)C1 ZINC000490029412 1114204589 /nfs/dbraw/zinc/20/45/89/1114204589.db2.gz JWNJZOWXUYFNEI-AZUAARDMSA-N 1 1 367.493 4.418 20 5 FIBDMO CCN(CCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000249718934 1114659039 /nfs/dbraw/zinc/65/90/39/1114659039.db2.gz YBBUMHJIRJZELJ-GCJKJVERSA-N 1 1 367.493 4.295 20 5 FIBDMO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000249718934 1114659041 /nfs/dbraw/zinc/65/90/41/1114659041.db2.gz YBBUMHJIRJZELJ-GCJKJVERSA-N 1 1 367.493 4.295 20 5 FIBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000249718934 1114659043 /nfs/dbraw/zinc/65/90/43/1114659043.db2.gz YBBUMHJIRJZELJ-GCJKJVERSA-N 1 1 367.493 4.295 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H](c1ccc(Cl)cc1)[NH+](C)C ZINC000572972445 1114940290 /nfs/dbraw/zinc/94/02/90/1114940290.db2.gz YFFYRVRNKWIGOY-QGZVFWFLSA-N 1 1 361.829 4.106 20 5 FIBDMO Cc1cccc(C2([NH2+]Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CCC2)c1 ZINC000592145818 1115209367 /nfs/dbraw/zinc/20/93/67/1115209367.db2.gz CDWLPZLICWEMEK-UHFFFAOYSA-N 1 1 364.405 4.122 20 5 FIBDMO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594499625 1115450710 /nfs/dbraw/zinc/45/07/10/1115450710.db2.gz OJQFAIYMTRFTLO-CZUORRHYSA-N 1 1 350.422 4.303 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CC4(CC4(F)F)C3)o2)c(Cl)c1 ZINC000594609495 1115470895 /nfs/dbraw/zinc/47/08/95/1115470895.db2.gz ZEBOIQGZAZDAEI-UHFFFAOYSA-N 1 1 354.740 4.349 20 5 FIBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](c1ccccc1)[N@@H+]1CC[C@H]2C[C@H]21 ZINC000761078983 1115490505 /nfs/dbraw/zinc/49/05/05/1115490505.db2.gz APESQQFZWHKOLY-XCRHUMRWSA-N 1 1 371.824 4.022 20 5 FIBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](c1ccccc1)[N@H+]1CC[C@H]2C[C@H]21 ZINC000761078983 1115490507 /nfs/dbraw/zinc/49/05/07/1115490507.db2.gz APESQQFZWHKOLY-XCRHUMRWSA-N 1 1 371.824 4.022 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1sccc1Br ZINC000595014401 1115504088 /nfs/dbraw/zinc/50/40/88/1115504088.db2.gz PGAKQTOMYXEKEF-SECBINFHSA-N 1 1 371.256 4.278 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cc(C)ccc1OC(F)F ZINC000595021645 1115504698 /nfs/dbraw/zinc/50/46/98/1115504698.db2.gz QTSMGIMUYXMHBR-GFCCVEGCSA-N 1 1 366.364 4.364 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cc(C)ccc1OC(F)F ZINC000595021646 1115504758 /nfs/dbraw/zinc/50/47/58/1115504758.db2.gz QTSMGIMUYXMHBR-LBPRGKRZSA-N 1 1 366.364 4.364 20 5 FIBDMO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595003564 1115506864 /nfs/dbraw/zinc/50/68/64/1115506864.db2.gz IMYQVEQRWPVJMA-QWHCGFSZSA-N 1 1 360.410 4.032 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000595006269 1115507420 /nfs/dbraw/zinc/50/74/20/1115507420.db2.gz HXBASAARGCLJKS-YVEFUNNKSA-N 1 1 360.385 4.307 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCOc2cc(F)ccc21 ZINC000595026738 1115510147 /nfs/dbraw/zinc/51/01/47/1115510147.db2.gz IGIVSDSXPABTLV-YVEFUNNKSA-N 1 1 360.385 4.307 20 5 FIBDMO CCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595415293 1115535155 /nfs/dbraw/zinc/53/51/55/1115535155.db2.gz LMSCOHZDOMVWQH-CYBMUJFWSA-N 1 1 362.401 4.382 20 5 FIBDMO COc1ccc(CN(C)[C@@H](C)c2nc3ccc(Cl)cc3[nH]2)cc1[N+](=O)[O-] ZINC000595514160 1115539534 /nfs/dbraw/zinc/53/95/34/1115539534.db2.gz AYEMYQPSTUEOAO-NSHDSACASA-N 1 1 374.828 4.326 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C(C)(C)c2cccc(Cl)c2)c1 ZINC000593021238 1115539557 /nfs/dbraw/zinc/53/95/57/1115539557.db2.gz RPESFRGFLPONQM-UHFFFAOYSA-N 1 1 362.813 4.060 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000595563047 1115540710 /nfs/dbraw/zinc/54/07/10/1115540710.db2.gz XZORUZXQWLXUIT-UFYCRDLUSA-N 1 1 356.397 4.229 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000595563047 1115540712 /nfs/dbraw/zinc/54/07/12/1115540712.db2.gz XZORUZXQWLXUIT-UFYCRDLUSA-N 1 1 356.397 4.229 20 5 FIBDMO O=C(CC[N@H+]1CC2(CCCC2)[C@@H]1c1ccco1)Nc1ccccc1[N+](=O)[O-] ZINC000595673467 1115556209 /nfs/dbraw/zinc/55/62/09/1115556209.db2.gz FJOVOXWSRUFMQS-IBGZPJMESA-N 1 1 369.421 4.134 20 5 FIBDMO COc1cc(C[NH2+][C@@H](c2ccccc2F)C(C)C)c([N+](=O)[O-])cc1F ZINC000595686761 1115556652 /nfs/dbraw/zinc/55/66/52/1115556652.db2.gz BSBPXCORNMDTBN-GOSISDBHSA-N 1 1 350.365 4.369 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCC[C@H]3CC3CCC3)o2)cc1 ZINC000595866170 1115565094 /nfs/dbraw/zinc/56/50/94/1115565094.db2.gz FUFWVJFYDMBQTL-KRWDZBQOSA-N 1 1 356.426 4.190 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1c(C)noc1C ZINC000602575399 1115712604 /nfs/dbraw/zinc/71/26/04/1115712604.db2.gz GYSMVOAOUMOPEX-LLVKDONJSA-N 1 1 374.260 4.265 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](N(C)c2ccc(C)cc2)C1 ZINC001168413872 1115752390 /nfs/dbraw/zinc/75/23/90/1115752390.db2.gz LMYCQLDVBODHJK-HXUWFJFHSA-N 1 1 369.465 4.013 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+][C@H](Cc2ccccc2)c2nccn2C)cc1[N+](=O)[O-] ZINC000593718361 1115802129 /nfs/dbraw/zinc/80/21/29/1115802129.db2.gz HLIDLIRFDZIMNU-QFBILLFUSA-N 1 1 364.449 4.271 20 5 FIBDMO COc1ccc(C[N@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000603837395 1115820202 /nfs/dbraw/zinc/82/02/02/1115820202.db2.gz FRNJIAIGFBQKTB-DYVFJYSZSA-N 1 1 356.422 4.484 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000603837395 1115820203 /nfs/dbraw/zinc/82/02/03/1115820203.db2.gz FRNJIAIGFBQKTB-DYVFJYSZSA-N 1 1 356.422 4.484 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)Cc1cccc2ccccc21 ZINC000603892012 1115826890 /nfs/dbraw/zinc/82/68/90/1115826890.db2.gz VKGINBZGTSPODV-UHFFFAOYSA-N 1 1 363.417 4.127 20 5 FIBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000604521752 1115867422 /nfs/dbraw/zinc/86/74/22/1115867422.db2.gz XMOVFQAGRCKMHI-NQIIRXRSSA-N 1 1 370.449 4.073 20 5 FIBDMO CCCC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccc(C)o1 ZINC000604493608 1115868237 /nfs/dbraw/zinc/86/82/37/1115868237.db2.gz NGXSODGCDTYTJR-HNNXBMFYSA-N 1 1 359.426 4.298 20 5 FIBDMO CCCC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccc(C)o1 ZINC000604493608 1115868239 /nfs/dbraw/zinc/86/82/39/1115868239.db2.gz NGXSODGCDTYTJR-HNNXBMFYSA-N 1 1 359.426 4.298 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@@H+]4CCC[C@H]4C3)s2)cc1 ZINC000608836070 1116131322 /nfs/dbraw/zinc/13/13/22/1116131322.db2.gz JLZZNZJTCXJDMV-WBVHZDCISA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@H+]4CCC[C@H]4C3)s2)cc1 ZINC000608836070 1116131324 /nfs/dbraw/zinc/13/13/24/1116131324.db2.gz JLZZNZJTCXJDMV-WBVHZDCISA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)s1 ZINC000064029307 1116135197 /nfs/dbraw/zinc/13/51/97/1116135197.db2.gz PQEGKSWRUOZOGJ-UHFFFAOYSA-N 1 1 351.859 4.386 20 5 FIBDMO CCOc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1OC ZINC000535072225 1116267465 /nfs/dbraw/zinc/26/74/65/1116267465.db2.gz MFQIVQZRDDTHHT-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC000609075662 1116305071 /nfs/dbraw/zinc/30/50/71/1116305071.db2.gz QFHTWBLXNHEEQE-UHFFFAOYSA-N 1 1 352.434 4.475 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@H+](C)Cc2ccc[nH]2)cc1[N+](=O)[O-] ZINC000539824874 1116383951 /nfs/dbraw/zinc/38/39/51/1116383951.db2.gz HNDJROQXEIUWCY-UHFFFAOYSA-N 1 1 350.422 4.323 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)Cc2ccc[nH]2)cc1[N+](=O)[O-] ZINC000539824874 1116383953 /nfs/dbraw/zinc/38/39/53/1116383953.db2.gz HNDJROQXEIUWCY-UHFFFAOYSA-N 1 1 350.422 4.323 20 5 FIBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000462786795 1117770941 /nfs/dbraw/zinc/77/09/41/1117770941.db2.gz BYEPRGVSFGYGNQ-CYBMUJFWSA-N 1 1 357.401 4.120 20 5 FIBDMO CC[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H]1CCOC1 ZINC000463036224 1117928765 /nfs/dbraw/zinc/92/87/65/1117928765.db2.gz JNHFUIKRORIERT-INIZCTEOSA-N 1 1 360.385 4.137 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000463237731 1118045381 /nfs/dbraw/zinc/04/53/81/1118045381.db2.gz XJRTZTJLCHNEMF-QGZVFWFLSA-N 1 1 350.422 4.055 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCOc2cc(C)c(C)cc21 ZINC000541566930 1118557847 /nfs/dbraw/zinc/55/78/47/1118557847.db2.gz YHOPJGDUFANSNJ-SFHVURJKSA-N 1 1 356.422 4.224 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541701963 1118616669 /nfs/dbraw/zinc/61/66/69/1118616669.db2.gz ZTWZRZBPLQGYGD-YLJYHZDGSA-N 1 1 374.412 4.095 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCCc2cn(C3CCCC3)nc21 ZINC000541780743 1118640112 /nfs/dbraw/zinc/64/01/12/1118640112.db2.gz QLYBDOOAOXPWCE-LJQANCHMSA-N 1 1 354.454 4.382 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000464761508 1118684303 /nfs/dbraw/zinc/68/43/03/1118684303.db2.gz FEXLDYGEPTZLLS-HNNXBMFYSA-N 1 1 358.463 4.218 20 5 FIBDMO Cc1ccc(CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@@H]2CCCO2)cc1 ZINC000464782162 1118692131 /nfs/dbraw/zinc/69/21/31/1118692131.db2.gz YFDZUJFZQGASHI-NRFANRHFSA-N 1 1 354.450 4.127 20 5 FIBDMO CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464836321 1118710362 /nfs/dbraw/zinc/71/03/62/1118710362.db2.gz KFFMYBPLEOMWIX-KRWDZBQOSA-N 1 1 373.884 4.202 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000464857594 1118726130 /nfs/dbraw/zinc/72/61/30/1118726130.db2.gz KRAXZGGXAPBMOK-KBXCAEBGSA-N 1 1 371.437 4.298 20 5 FIBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000609144644 1118772247 /nfs/dbraw/zinc/77/22/47/1118772247.db2.gz TZUAOUWLAFZFKU-UZLBHIALSA-N 1 1 358.413 4.334 20 5 FIBDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000465273275 1118909368 /nfs/dbraw/zinc/90/93/68/1118909368.db2.gz QEMHYCSHSNPNOV-QGZVFWFLSA-N 1 1 361.489 4.096 20 5 FIBDMO Cn1cc(CNc2ccc(C3CCC3)c[nH+]2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000549924419 1118976349 /nfs/dbraw/zinc/97/63/49/1118976349.db2.gz WWOLZHKCKANXDS-UHFFFAOYSA-N 1 1 363.421 4.270 20 5 FIBDMO Cc1[nH+]ccn1-c1ccccc1CNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000492312544 1119069640 /nfs/dbraw/zinc/06/96/40/1119069640.db2.gz YGSKSAUGVQIZAB-UHFFFAOYSA-N 1 1 359.389 4.249 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492538828 1119126662 /nfs/dbraw/zinc/12/66/62/1119126662.db2.gz QRBNLEDQKRTHNP-GOSISDBHSA-N 1 1 355.438 4.070 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](CO)c2ccc(C(F)(F)F)cc2)cc1Cl ZINC000761528282 1119410057 /nfs/dbraw/zinc/41/00/57/1119410057.db2.gz YGOGZZCXLUQECQ-AWEZNQCLSA-N 1 1 374.746 4.090 20 5 FIBDMO C[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC000761524531 1119411934 /nfs/dbraw/zinc/41/19/34/1119411934.db2.gz FKDVVUXMIIPQJG-QAPCUYQASA-N 1 1 373.884 4.391 20 5 FIBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCN1Cc1ccccc1 ZINC000761524531 1119411937 /nfs/dbraw/zinc/41/19/37/1119411937.db2.gz FKDVVUXMIIPQJG-QAPCUYQASA-N 1 1 373.884 4.391 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000493252436 1119435601 /nfs/dbraw/zinc/43/56/01/1119435601.db2.gz HRIVIYJUWFILMV-MRXNPFEDSA-N 1 1 360.841 4.287 20 5 FIBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493630737 1119482528 /nfs/dbraw/zinc/48/25/28/1119482528.db2.gz BYBCRMMRUDEIFX-AWEZNQCLSA-N 1 1 373.840 4.099 20 5 FIBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493630737 1119482533 /nfs/dbraw/zinc/48/25/33/1119482533.db2.gz BYBCRMMRUDEIFX-AWEZNQCLSA-N 1 1 373.840 4.099 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494292843 1119822647 /nfs/dbraw/zinc/82/26/47/1119822647.db2.gz JWUPQYGASIGIEU-LCJXNMAOSA-N 1 1 367.449 4.266 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494292843 1119822651 /nfs/dbraw/zinc/82/26/51/1119822651.db2.gz JWUPQYGASIGIEU-LCJXNMAOSA-N 1 1 367.449 4.266 20 5 FIBDMO COC[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc(F)c(F)c1 ZINC000193068411 1120349294 /nfs/dbraw/zinc/34/92/94/1120349294.db2.gz PMGUVMGWIGUEIZ-RTBURBONSA-N 1 1 362.376 4.228 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(Cl)c1 ZINC000487998881 1121013681 /nfs/dbraw/zinc/01/36/81/1121013681.db2.gz YMBRBGMSNGPGIZ-INIZCTEOSA-N 1 1 359.857 4.225 20 5 FIBDMO CCOc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000090585812 1121015310 /nfs/dbraw/zinc/01/53/10/1121015310.db2.gz HDBIYJWYJMLIRX-SJORKVTESA-N 1 1 363.502 4.012 20 5 FIBDMO CC(=O)c1ccc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301430586 1121154887 /nfs/dbraw/zinc/15/48/87/1121154887.db2.gz QIBGGKIAOYWZQY-DNVCBOLYSA-N 1 1 373.478 4.354 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c(Cl)c1 ZINC000326406444 1121160592 /nfs/dbraw/zinc/16/05/92/1121160592.db2.gz IXTSMUQFNVYLAJ-KBAYOESNSA-N 1 1 352.862 4.154 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c(Cl)c1 ZINC000326406442 1121313212 /nfs/dbraw/zinc/31/32/12/1121313212.db2.gz IXTSMUQFNVYLAJ-CGTJXYLNSA-N 1 1 352.862 4.154 20 5 FIBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000130653273 1121563948 /nfs/dbraw/zinc/56/39/48/1121563948.db2.gz GBUMIEQOIKCNRX-QGZVFWFLSA-N 1 1 358.442 4.059 20 5 FIBDMO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000130653273 1121563955 /nfs/dbraw/zinc/56/39/55/1121563955.db2.gz GBUMIEQOIKCNRX-QGZVFWFLSA-N 1 1 358.442 4.059 20 5 FIBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000074315442 1121951459 /nfs/dbraw/zinc/95/14/59/1121951459.db2.gz BNTXLKBRNPICAB-SFHVURJKSA-N 1 1 373.500 4.192 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1nc(-c2ccncc2)cs1 ZINC000542705222 1122301175 /nfs/dbraw/zinc/30/11/75/1122301175.db2.gz RYYPITXOJOQZTA-CYBMUJFWSA-N 1 1 354.435 4.273 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000556119093 1122670181 /nfs/dbraw/zinc/67/01/81/1122670181.db2.gz ORJUNGUSBAPFCH-NBHGPNQESA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000556119093 1122670185 /nfs/dbraw/zinc/67/01/85/1122670185.db2.gz ORJUNGUSBAPFCH-NBHGPNQESA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1ccccc1C[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000007680837 1122691959 /nfs/dbraw/zinc/69/19/59/1122691959.db2.gz ITHPILZMQJHAFH-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccccc1C[N@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000007680837 1122691964 /nfs/dbraw/zinc/69/19/64/1122691964.db2.gz ITHPILZMQJHAFH-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133426 1123160666 /nfs/dbraw/zinc/16/06/66/1123160666.db2.gz DVHASIMOUONSLP-PKOBYXMFSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133426 1123160670 /nfs/dbraw/zinc/16/06/70/1123160670.db2.gz DVHASIMOUONSLP-PKOBYXMFSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133426 1123160675 /nfs/dbraw/zinc/16/06/75/1123160675.db2.gz DVHASIMOUONSLP-PKOBYXMFSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133402 1123160905 /nfs/dbraw/zinc/16/09/05/1123160905.db2.gz DVHASIMOUONSLP-HKUYNNGSSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133402 1123160908 /nfs/dbraw/zinc/16/09/08/1123160908.db2.gz DVHASIMOUONSLP-HKUYNNGSSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133402 1123160910 /nfs/dbraw/zinc/16/09/10/1123160910.db2.gz DVHASIMOUONSLP-HKUYNNGSSA-N 1 1 353.466 4.076 20 5 FIBDMO CC[C@H]1CCC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC1 ZINC000609766767 1123825151 /nfs/dbraw/zinc/82/51/51/1123825151.db2.gz PABJCWCFZKRJNZ-LBPRGKRZSA-N 1 1 358.385 4.217 20 5 FIBDMO CC(=O)Nc1cccc2c1CC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C2 ZINC000615836112 1124128180 /nfs/dbraw/zinc/12/81/80/1124128180.db2.gz VOARVWIMSPMRLS-RVDMUPIBSA-N 1 1 365.433 4.015 20 5 FIBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)c1ccccc1 ZINC000428840038 1124511833 /nfs/dbraw/zinc/51/18/33/1124511833.db2.gz LNIMUJOCPKQSJP-HNNXBMFYSA-N 1 1 356.422 4.433 20 5 FIBDMO COc1cc(N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)ccc1[N+](=O)[O-] ZINC000301727439 1125143100 /nfs/dbraw/zinc/14/31/00/1125143100.db2.gz BHXAKHLCXDETEJ-CYBMUJFWSA-N 1 1 352.394 4.271 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(C(F)(F)F)c1 ZINC000301750039 1125188121 /nfs/dbraw/zinc/18/81/21/1125188121.db2.gz ALAZXKDLNQEAJQ-LRDDRELGSA-N 1 1 369.387 4.067 20 5 FIBDMO C[C@H](c1ccc(-n2cncn2)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182042431 1125215440 /nfs/dbraw/zinc/21/54/40/1125215440.db2.gz XDFBWCBALPWRCB-CYBMUJFWSA-N 1 1 371.828 4.022 20 5 FIBDMO C[C@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182042431 1125215455 /nfs/dbraw/zinc/21/54/55/1125215455.db2.gz XDFBWCBALPWRCB-CYBMUJFWSA-N 1 1 371.828 4.022 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000301776033 1125264911 /nfs/dbraw/zinc/26/49/11/1125264911.db2.gz LHHOMUROKYFGNW-IUODEOHRSA-N 1 1 369.387 4.067 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1)C(C)C ZINC000078148532 1125414980 /nfs/dbraw/zinc/41/49/80/1125414980.db2.gz OSVOKYJFBRUKNL-UHFFFAOYSA-N 1 1 367.449 4.028 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000096967812 209165294 /nfs/dbraw/zinc/16/52/94/209165294.db2.gz NIBMDRZBFHATFC-MRXNPFEDSA-N 1 1 367.449 4.142 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccccc1C)Cc1cccc([N+](=O)[O-])c1C ZINC000051452267 567961080 /nfs/dbraw/zinc/96/10/80/567961080.db2.gz ILFLGGXFACZQPD-UHFFFAOYSA-N 1 1 355.438 4.062 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1cccc([N+](=O)[O-])c1C ZINC000051452267 567961081 /nfs/dbraw/zinc/96/10/81/567961081.db2.gz ILFLGGXFACZQPD-UHFFFAOYSA-N 1 1 355.438 4.062 20 5 FIBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(C(F)(F)F)cc1 ZINC000302926249 568243964 /nfs/dbraw/zinc/24/39/64/568243964.db2.gz CYWWVYQUVUTLNE-UHFFFAOYSA-N 1 1 354.328 4.124 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)c1 ZINC000568998106 568265537 /nfs/dbraw/zinc/26/55/37/568265537.db2.gz YGMYVAPFVGRGBP-LRDDRELGSA-N 1 1 358.360 4.005 20 5 FIBDMO CC(=O)c1cc(NCc2ccc(-n3cc[nH+]c3C)c(F)c2)ccc1[N+](=O)[O-] ZINC000569511661 568404301 /nfs/dbraw/zinc/40/43/01/568404301.db2.gz KWZXACBVQAQUCT-UHFFFAOYSA-N 1 1 368.368 4.043 20 5 FIBDMO CC[C@H]1c2ccccc2CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000114563886 1125562212 /nfs/dbraw/zinc/56/22/12/1125562212.db2.gz OQMDYMVBAGJKSS-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000114563886 1125562218 /nfs/dbraw/zinc/56/22/18/1125562218.db2.gz OQMDYMVBAGJKSS-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000619722718 1125668541 /nfs/dbraw/zinc/66/85/41/1125668541.db2.gz UZGNKHJUQRPEIQ-HZPDHXFCSA-N 1 1 354.454 4.068 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000619722883 1125669701 /nfs/dbraw/zinc/66/97/01/1125669701.db2.gz PYWJBCZYFFEFIG-DOTOQJQBSA-N 1 1 354.454 4.068 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccc(Br)s1 ZINC000430192191 1079812415 /nfs/dbraw/zinc/81/24/15/1079812415.db2.gz AXNQHCCAWBDEQV-VIFPVBQESA-N 1 1 371.256 4.278 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1ccc([N+](=O)[O-])cc1OC)CCC2 ZINC000430199659 1079904855 /nfs/dbraw/zinc/90/48/55/1079904855.db2.gz DBPCNBQRCWWRNP-OAHLLOKOSA-N 1 1 361.467 4.132 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC)CCC2 ZINC000430199659 1079904856 /nfs/dbraw/zinc/90/48/56/1079904856.db2.gz DBPCNBQRCWWRNP-OAHLLOKOSA-N 1 1 361.467 4.132 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)c1cccc(Cl)c1F ZINC000430205124 1079930893 /nfs/dbraw/zinc/93/08/93/1079930893.db2.gz ILWOGAHFNVXREZ-UHFFFAOYSA-N 1 1 352.793 4.421 20 5 FIBDMO CC[C@H]1CC[N@H+]1Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000430207324 1079944879 /nfs/dbraw/zinc/94/48/79/1079944879.db2.gz QOBFPZNPQVGPRI-KRWDZBQOSA-N 1 1 356.422 4.167 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1F ZINC000127094032 1080190644 /nfs/dbraw/zinc/19/06/44/1080190644.db2.gz ITXSEXAKMZHUBJ-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO Cc1cccc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c1[N+](=O)[O-] ZINC000157753541 1080481082 /nfs/dbraw/zinc/48/10/82/1080481082.db2.gz GYJWHDSAFDXXOK-QGZVFWFLSA-N 1 1 373.497 4.020 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](CSc4ccccc4)C3)nc2c1 ZINC000177161294 1081199025 /nfs/dbraw/zinc/19/90/25/1081199025.db2.gz HXMHHJKYTBVAJD-AWEZNQCLSA-N 1 1 369.446 4.350 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3Cc3ccc(F)cc3)nc2c1 ZINC000083169072 1081267690 /nfs/dbraw/zinc/26/76/90/1081267690.db2.gz BJFRFINUERWDOP-HNNXBMFYSA-N 1 1 355.369 4.082 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000609195457 1081378179 /nfs/dbraw/zinc/37/81/79/1081378179.db2.gz YLOIDUDRSQRXAU-OAHLLOKOSA-N 1 1 358.385 4.215 20 5 FIBDMO C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000536021101 1081415712 /nfs/dbraw/zinc/41/57/12/1081415712.db2.gz AMXDDXQHPOGXQI-MRXNPFEDSA-N 1 1 351.328 4.212 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1n1ccnc1 ZINC000247262700 1081931247 /nfs/dbraw/zinc/93/12/47/1081931247.db2.gz XRZSJRUOAFZTHR-DNVCBOLYSA-N 1 1 366.421 4.134 20 5 FIBDMO CN(C)c1nc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)cs1 ZINC000610468044 1082221328 /nfs/dbraw/zinc/22/13/28/1082221328.db2.gz OXFHYAHDXQQBDF-UHFFFAOYSA-N 1 1 374.491 4.136 20 5 FIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000610476343 1082300243 /nfs/dbraw/zinc/30/02/43/1082300243.db2.gz OKXFMBDBWPSEGS-YLJYHZDGSA-N 1 1 358.413 4.334 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(C4CCCC4)CC3)n2)cc1 ZINC000610393442 1082549125 /nfs/dbraw/zinc/54/91/25/1082549125.db2.gz FAYULHRHLUMTBT-UHFFFAOYSA-N 1 1 356.426 4.047 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000051283948 1082985116 /nfs/dbraw/zinc/98/51/16/1082985116.db2.gz UUOVZXBBUZQXHE-SFHVURJKSA-N 1 1 356.422 4.258 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](c3ncc[nH]3)C2)s1 ZINC000510539747 1083149256 /nfs/dbraw/zinc/14/92/56/1083149256.db2.gz RFXSCFKZBLVHTF-CQSZACIVSA-N 1 1 368.462 4.426 20 5 FIBDMO CC[N@@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000535721648 1083609320 /nfs/dbraw/zinc/60/93/20/1083609320.db2.gz RQMNLZUKFFTYJO-CYBMUJFWSA-N 1 1 361.829 4.097 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)s1 ZINC000610808015 1083717411 /nfs/dbraw/zinc/71/74/11/1083717411.db2.gz PRJKUWMPGDURGZ-IAGOWNOFSA-N 1 1 357.479 4.147 20 5 FIBDMO COc1ccc(C[N@@H+]2CC[C@@](C)(F)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000535842688 1083799410 /nfs/dbraw/zinc/79/94/10/1083799410.db2.gz KYQIBPKKQPVEGY-HXUWFJFHSA-N 1 1 374.412 4.116 20 5 FIBDMO COc1ccc(C[N@H+]2CC[C@@](C)(F)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000535842688 1083799422 /nfs/dbraw/zinc/79/94/22/1083799422.db2.gz KYQIBPKKQPVEGY-HXUWFJFHSA-N 1 1 374.412 4.116 20 5 FIBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000612540007 1083901995 /nfs/dbraw/zinc/90/19/95/1083901995.db2.gz QGBCHCRTJYXEBB-KXBFYZLASA-N 1 1 362.376 4.225 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000612578183 1083923593 /nfs/dbraw/zinc/92/35/93/1083923593.db2.gz CVDYKUSSCMJAOA-RYUDHWBXSA-N 1 1 370.293 4.466 20 5 FIBDMO C[C@H](N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]21)c1ccccc1[N+](=O)[O-] ZINC000380523403 1084044993 /nfs/dbraw/zinc/04/49/93/1084044993.db2.gz CMAKKJQSTIGNCL-BVPXEZJJSA-N 1 1 365.477 4.156 20 5 FIBDMO Cn1ccnc1[C@H]([NH2+]CCCCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000611560401 1084048612 /nfs/dbraw/zinc/04/86/12/1084048612.db2.gz UTBRKCCFDNPTDU-HXUWFJFHSA-N 1 1 364.449 4.030 20 5 FIBDMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1 ZINC000612954727 1084227729 /nfs/dbraw/zinc/22/77/29/1084227729.db2.gz OLEPOMISZNOFBO-YPRXJGMQSA-N 1 1 374.466 4.171 20 5 FIBDMO Cc1c(C[N@H+](Cc2cccc(F)c2)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000071958738 1084413332 /nfs/dbraw/zinc/41/33/32/1084413332.db2.gz YCIDUGZPELOFFU-IBGZPJMESA-N 1 1 358.413 4.224 20 5 FIBDMO CC(=O)c1cc(N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000582139706 1084665757 /nfs/dbraw/zinc/66/57/57/1084665757.db2.gz XQEYNWIXBFGFAM-INIZCTEOSA-N 1 1 373.497 4.278 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](OC(F)F)C3)o2)cc1 ZINC000611609614 1085032338 /nfs/dbraw/zinc/03/23/38/1085032338.db2.gz TUGCNQHVQILKHA-CQSZACIVSA-N 1 1 352.337 4.058 20 5 FIBDMO Cc1c(C(=O)Nc2cccc3c2C[N@@H+](CC(C)C)C3)cccc1[N+](=O)[O-] ZINC000158373582 1085055928 /nfs/dbraw/zinc/05/59/28/1085055928.db2.gz VUVFIBXKEAKUHX-UHFFFAOYSA-N 1 1 353.422 4.127 20 5 FIBDMO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001167582230 1085103417 /nfs/dbraw/zinc/10/34/17/1085103417.db2.gz MSIBUXVPDPWZEG-NSHDSACASA-N 1 1 369.284 4.482 20 5 FIBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001167582230 1085103421 /nfs/dbraw/zinc/10/34/21/1085103421.db2.gz MSIBUXVPDPWZEG-NSHDSACASA-N 1 1 369.284 4.482 20 5 FIBDMO COc1cc(C[N@H+](C)Cc2sccc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000053781593 1085285577 /nfs/dbraw/zinc/28/55/77/1085285577.db2.gz VQPIALOPJDRPLE-UHFFFAOYSA-N 1 1 372.393 4.207 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2sccc2C)c([N+](=O)[O-])cc1OC(F)F ZINC000053781593 1085285584 /nfs/dbraw/zinc/28/55/84/1085285584.db2.gz VQPIALOPJDRPLE-UHFFFAOYSA-N 1 1 372.393 4.207 20 5 FIBDMO Cc1cc(N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549523606 1085327667 /nfs/dbraw/zinc/32/76/67/1085327667.db2.gz BIEYNNQGPYUEIO-CQSZACIVSA-N 1 1 371.403 4.090 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccn(-c3c(F)cccc3F)n2)cc1[N+](=O)[O-] ZINC000181764283 1085529379 /nfs/dbraw/zinc/52/93/79/1085529379.db2.gz ZPANEHSKKXUOGJ-ZDUSSCGKSA-N 1 1 372.375 4.218 20 5 FIBDMO CCC[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccccc1 ZINC000181778401 1085557851 /nfs/dbraw/zinc/55/78/51/1085557851.db2.gz QDYKMKJQUVCLFM-QGZVFWFLSA-N 1 1 352.394 4.276 20 5 FIBDMO Cc1ccccc1C[NH+]1CCC(N[C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000178646500 1085564300 /nfs/dbraw/zinc/56/43/00/1085564300.db2.gz OPMMWCLIOKUKBN-QGZVFWFLSA-N 1 1 353.466 4.218 20 5 FIBDMO C[C@@H](NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178651783 1085585005 /nfs/dbraw/zinc/58/50/05/1085585005.db2.gz FWVYRNZLRBPSEC-CVEARBPZSA-N 1 1 359.495 4.219 20 5 FIBDMO C[C@@H](NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178651783 1085585012 /nfs/dbraw/zinc/58/50/12/1085585012.db2.gz FWVYRNZLRBPSEC-CVEARBPZSA-N 1 1 359.495 4.219 20 5 FIBDMO CC[N@@H+](CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC1 ZINC000236879092 1085596323 /nfs/dbraw/zinc/59/63/23/1085596323.db2.gz JESZAMXTUHLUBM-UHFFFAOYSA-N 1 1 363.845 4.082 20 5 FIBDMO CCN(CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC1 ZINC000236879092 1085596336 /nfs/dbraw/zinc/59/63/36/1085596336.db2.gz JESZAMXTUHLUBM-UHFFFAOYSA-N 1 1 363.845 4.082 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H](OCC3CC3)C2)c1 ZINC000549556634 1085705986 /nfs/dbraw/zinc/70/59/86/1085705986.db2.gz ZXCOFXKNAVVBBM-OAHLLOKOSA-N 1 1 358.360 4.005 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H](OCC3CC3)C2)c1 ZINC000549556634 1085705994 /nfs/dbraw/zinc/70/59/94/1085705994.db2.gz ZXCOFXKNAVVBBM-OAHLLOKOSA-N 1 1 358.360 4.005 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](Cc4ccncc4)C3)o2)c1 ZINC000611983901 1085722376 /nfs/dbraw/zinc/72/23/76/1085722376.db2.gz VZOXQMBAVSDCEB-KRWDZBQOSA-N 1 1 363.417 4.314 20 5 FIBDMO CCC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000051379043 1085840050 /nfs/dbraw/zinc/84/00/50/1085840050.db2.gz CMLASWZFSQGZBA-UHFFFAOYSA-N 1 1 352.394 4.057 20 5 FIBDMO CCC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000051379043 1085840058 /nfs/dbraw/zinc/84/00/58/1085840058.db2.gz CMLASWZFSQGZBA-UHFFFAOYSA-N 1 1 352.394 4.057 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc(C)ccc1OC(F)F ZINC000178728819 1085966262 /nfs/dbraw/zinc/96/62/62/1085966262.db2.gz VFIYSXBCPFWPNS-GFCCVEGCSA-N 1 1 366.364 4.364 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@]3(CCOC3)C2)ccc1Oc1ccc(F)cc1 ZINC000093820519 1086204127 /nfs/dbraw/zinc/20/41/27/1086204127.db2.gz QTLZHXKVZIGFKZ-HXUWFJFHSA-N 1 1 372.396 4.139 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1csc(Br)c1 ZINC000541769632 1086352975 /nfs/dbraw/zinc/35/29/75/1086352975.db2.gz COMIYGJCVODLMO-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1csc(Br)c1 ZINC000541769632 1086352986 /nfs/dbraw/zinc/35/29/86/1086352986.db2.gz COMIYGJCVODLMO-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO C[C@H](c1cccc(Cl)c1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052162332 1086354051 /nfs/dbraw/zinc/35/40/51/1086354051.db2.gz GZZVCBCDEBNMSD-GFCCVEGCSA-N 1 1 362.813 4.308 20 5 FIBDMO C[C@H](c1cccc(Cl)c1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052162332 1086354067 /nfs/dbraw/zinc/35/40/67/1086354067.db2.gz GZZVCBCDEBNMSD-GFCCVEGCSA-N 1 1 362.813 4.308 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC([C@H]3CCCO3)CC2)c1 ZINC000549612693 1086548240 /nfs/dbraw/zinc/54/82/40/1086548240.db2.gz XAVZPSUEPDQCTQ-MRXNPFEDSA-N 1 1 358.360 4.005 20 5 FIBDMO CC[N@@H+](C)Cc1cccc(CNc2ccnc3c2cccc3[N+](=O)[O-])c1 ZINC000432338815 1086628959 /nfs/dbraw/zinc/62/89/59/1086628959.db2.gz XEBSZJRJRIKSCH-UHFFFAOYSA-N 1 1 350.422 4.207 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCc3ccc4cn[nH]c4c3)o2)c1 ZINC000585743484 1086678932 /nfs/dbraw/zinc/67/89/32/1086678932.db2.gz ZWJGBUZLEVITRX-UHFFFAOYSA-N 1 1 362.389 4.063 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@H]3[C@@H]3CCCO3)o2)c([N+](=O)[O-])c1 ZINC000585767817 1086695633 /nfs/dbraw/zinc/69/56/33/1086695633.db2.gz DZPKAGTWVINIFZ-PXNSSMCTSA-N 1 1 372.421 4.007 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000182072905 1086799670 /nfs/dbraw/zinc/79/96/70/1086799670.db2.gz ZTUOBPNARVXCFW-UHFFFAOYSA-N 1 1 367.405 4.054 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@@H+](Cc2ccco2)Cc2cccnc2)cc1 ZINC000182072905 1086799673 /nfs/dbraw/zinc/79/96/73/1086799673.db2.gz ZTUOBPNARVXCFW-UHFFFAOYSA-N 1 1 367.405 4.054 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000708585550 1087629356 /nfs/dbraw/zinc/62/93/56/1087629356.db2.gz HBSRQXWKLVEXOT-CRAIPNDOSA-N 1 1 373.884 4.106 20 5 FIBDMO CCOc1ccc([C@@H](C)N[C@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000504929167 1087996681 /nfs/dbraw/zinc/99/66/81/1087996681.db2.gz HBFPOYQAYCHVQN-RDTXWAMCSA-N 1 1 351.491 4.011 20 5 FIBDMO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1C(F)(F)F ZINC000176998712 1088162083 /nfs/dbraw/zinc/16/20/83/1088162083.db2.gz NWNDBEHYBXWJRY-UHFFFAOYSA-N 1 1 365.311 4.387 20 5 FIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccccc1C(F)(F)F ZINC000176998712 1088162095 /nfs/dbraw/zinc/16/20/95/1088162095.db2.gz NWNDBEHYBXWJRY-UHFFFAOYSA-N 1 1 365.311 4.387 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000122171859 1088242005 /nfs/dbraw/zinc/24/20/05/1088242005.db2.gz WVWRZNRDDRFPNH-SECBINFHSA-N 1 1 371.181 4.486 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H](c1ccc(F)cc1)C(C)C ZINC000434623077 1088843803 /nfs/dbraw/zinc/84/38/03/1088843803.db2.gz JMNZWKWZLNCIEB-HXUWFJFHSA-N 1 1 373.428 4.310 20 5 FIBDMO C[C@H]([NH2+]C[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853302 1088881880 /nfs/dbraw/zinc/88/18/80/1088881880.db2.gz WHHCHDLKXLQKPI-UWJYYQICSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H](NC[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853302 1088881904 /nfs/dbraw/zinc/88/19/04/1088881904.db2.gz WHHCHDLKXLQKPI-UWJYYQICSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H](NC[C@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853302 1088881927 /nfs/dbraw/zinc/88/19/27/1088881927.db2.gz WHHCHDLKXLQKPI-UWJYYQICSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H]([NH2+]C[C@]1(C)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853302 1088881948 /nfs/dbraw/zinc/88/19/48/1088881948.db2.gz WHHCHDLKXLQKPI-UWJYYQICSA-N 1 1 353.466 4.158 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c(C)c1 ZINC000434703599 1088952571 /nfs/dbraw/zinc/95/25/71/1088952571.db2.gz ALGYRNJKFRBRIY-INIZCTEOSA-N 1 1 355.438 4.152 20 5 FIBDMO Cc1ccc([C@@]2(C)CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000434752024 1089023038 /nfs/dbraw/zinc/02/30/38/1089023038.db2.gz KMKZNRHIFMDGDM-FQEVSTJZSA-N 1 1 351.406 4.208 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(Cc4cccc(F)c4)CC3)nc2c1 ZINC000434833502 1089063427 /nfs/dbraw/zinc/06/34/27/1089063427.db2.gz XDRCEOIRFOPQQX-UHFFFAOYSA-N 1 1 369.396 4.330 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[C@H]1c1ccccc1 ZINC000435027207 1089223253 /nfs/dbraw/zinc/22/32/53/1089223253.db2.gz LKKMAZCULYHXPA-RHSMWYFYSA-N 1 1 351.406 4.362 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Br)nc1 ZINC000290632933 1090144436 /nfs/dbraw/zinc/14/44/36/1090144436.db2.gz JBZOLODWMWZPMV-QWRGUYRKSA-N 1 1 350.216 4.164 20 5 FIBDMO CC[C@@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000105503893 1091031951 /nfs/dbraw/zinc/03/19/51/1091031951.db2.gz HYANGQPHWHKSCN-GFCCVEGCSA-N 1 1 370.272 4.363 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2ccc(SC)cc2)c([N+](=O)[O-])cc1F ZINC000500239156 1091127067 /nfs/dbraw/zinc/12/70/67/1091127067.db2.gz SPJVHBWEBQWWGP-NSHDSACASA-N 1 1 350.415 4.315 20 5 FIBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3ccc(C(F)(F)F)cc3)C2)cc1 ZINC000511685484 1091539534 /nfs/dbraw/zinc/53/95/34/1091539534.db2.gz TYNJSWPZSOKSHA-INIZCTEOSA-N 1 1 365.355 4.300 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@]3(CC=CCC3)C2)cccc1[N+](=O)[O-] ZINC000512213599 1091918511 /nfs/dbraw/zinc/91/85/11/1091918511.db2.gz ODHCDCKRBCFTSI-OXJNMPFZSA-N 1 1 357.454 4.053 20 5 FIBDMO C[NH+](C)Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1Cl ZINC000500756835 1092514055 /nfs/dbraw/zinc/51/40/55/1092514055.db2.gz DYJFPBRJXHYRTP-UHFFFAOYSA-N 1 1 368.220 4.216 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000279949708 1092657116 /nfs/dbraw/zinc/65/71/16/1092657116.db2.gz BPIFAOBRUHQVPN-GHMZBOCLSA-N 1 1 350.216 4.164 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccn(-c3ccc(F)cc3F)n2)cc1[N+](=O)[O-] ZINC000190326675 1093005194 /nfs/dbraw/zinc/00/51/94/1093005194.db2.gz DGSYGDMSCXGTJM-ZDUSSCGKSA-N 1 1 372.375 4.218 20 5 FIBDMO CCc1ccc([C@H]([NH2+]C[C@@H](O)CC(C)(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544355276 1093180015 /nfs/dbraw/zinc/18/00/15/1093180015.db2.gz MGYREZWSKIYAHY-QFBILLFUSA-N 1 1 360.454 4.226 20 5 FIBDMO C[C@@H](CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCCC[C@H]1C ZINC000522196444 1093200750 /nfs/dbraw/zinc/20/07/50/1093200750.db2.gz ZUDNFUTVYPFUEH-CABCVRRESA-N 1 1 374.510 4.071 20 5 FIBDMO C[C@H](CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCCC[C@H]1C ZINC000522196446 1093201030 /nfs/dbraw/zinc/20/10/30/1093201030.db2.gz ZUDNFUTVYPFUEH-HUUCEWRRSA-N 1 1 374.510 4.071 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](c4ccccc4)C3)n2)cc1 ZINC000433079031 1093205500 /nfs/dbraw/zinc/20/55/00/1093205500.db2.gz XQQQKWFMNSSQST-QGZVFWFLSA-N 1 1 364.405 4.024 20 5 FIBDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)on1 ZINC000509780192 1093282127 /nfs/dbraw/zinc/28/21/27/1093282127.db2.gz CJODGXVSAADYET-KRWDZBQOSA-N 1 1 353.378 4.488 20 5 FIBDMO CC1(C)C[C@@H]([NH2+]Cc2ccn(-c3ccccc3)n2)c2cc([N+](=O)[O-])ccc21 ZINC000433149756 1093335509 /nfs/dbraw/zinc/33/55/09/1093335509.db2.gz FBPFQQSXJJJBQF-HXUWFJFHSA-N 1 1 362.433 4.293 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000439329198 1093346559 /nfs/dbraw/zinc/34/65/59/1093346559.db2.gz WYZXJRUBZHUELM-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000439329198 1093346569 /nfs/dbraw/zinc/34/65/69/1093346569.db2.gz WYZXJRUBZHUELM-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000433286387 1093543247 /nfs/dbraw/zinc/54/32/47/1093543247.db2.gz IPKAUXSRKGOTGU-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](C)c1ccc(Cl)cc1 ZINC000433286387 1093543257 /nfs/dbraw/zinc/54/32/57/1093543257.db2.gz IPKAUXSRKGOTGU-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1c(Cl)cccc1[N+](=O)[O-] ZINC000397988080 1093805440 /nfs/dbraw/zinc/80/54/40/1093805440.db2.gz PEEVHPFSIHJGLR-DNVCBOLYSA-N 1 1 373.884 4.248 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000513247155 1094034300 /nfs/dbraw/zinc/03/43/00/1094034300.db2.gz KLJNWGKVBREEKH-YWZLYKJASA-N 1 1 367.449 4.315 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000513267017 1094040866 /nfs/dbraw/zinc/04/08/66/1094040866.db2.gz NJFIHXJWOODKLH-YWZLYKJASA-N 1 1 367.449 4.315 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513272320 1094043007 /nfs/dbraw/zinc/04/30/07/1094043007.db2.gz QNAGCWYQFRODRF-BEFAXECRSA-N 1 1 353.422 4.007 20 5 FIBDMO COc1ccccc1O[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000513406685 1094105580 /nfs/dbraw/zinc/10/55/80/1094105580.db2.gz WERYKRTZLKSINB-HZPDHXFCSA-N 1 1 356.422 4.208 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000280187061 1094300159 /nfs/dbraw/zinc/30/01/59/1094300159.db2.gz SAOOCJATJXHQGI-QWRGUYRKSA-N 1 1 350.216 4.164 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Nc2cccc(C)c2)CC1 ZINC000237095577 1094918065 /nfs/dbraw/zinc/91/80/65/1094918065.db2.gz WQIGBGGNMBIIOQ-UHFFFAOYSA-N 1 1 369.465 4.378 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(OCCc2ccccc2)CC1 ZINC000522660344 1095236715 /nfs/dbraw/zinc/23/67/15/1095236715.db2.gz PBJCGHPXFSBYSU-UHFFFAOYSA-N 1 1 374.868 4.472 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cc3cc(Br)ccc3[nH]2)cs1 ZINC000183818996 1096217976 /nfs/dbraw/zinc/21/79/76/1096217976.db2.gz ZQLLIXPRDBARTJ-UHFFFAOYSA-N 1 1 366.240 4.190 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000533438755 1099042184 /nfs/dbraw/zinc/04/21/84/1099042184.db2.gz OYDKAOHLGOBCOR-IRXDYDNUSA-N 1 1 367.449 4.028 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1C ZINC000533431991 1099052022 /nfs/dbraw/zinc/05/20/22/1099052022.db2.gz WQSZSDQDERGLNE-SFHVURJKSA-N 1 1 367.449 4.296 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1C ZINC000533431991 1099052035 /nfs/dbraw/zinc/05/20/35/1099052035.db2.gz WQSZSDQDERGLNE-SFHVURJKSA-N 1 1 367.449 4.296 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1nc2cccc(Cl)c2n1C ZINC000547831739 1099594845 /nfs/dbraw/zinc/59/48/45/1099594845.db2.gz FKYYIEBCVVPUAT-GFCCVEGCSA-N 1 1 358.829 4.294 20 5 FIBDMO COc1ccc(C[C@@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000516610745 1099654352 /nfs/dbraw/zinc/65/43/52/1099654352.db2.gz SVUAKFQJGDPERG-IBGZPJMESA-N 1 1 354.450 4.101 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1)C(C)C ZINC000508763129 1100016438 /nfs/dbraw/zinc/01/64/38/1100016438.db2.gz MGNHMLCYIDCVJB-UHFFFAOYSA-N 1 1 355.438 4.386 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)s1 ZINC000536692328 1100189306 /nfs/dbraw/zinc/18/93/06/1100189306.db2.gz DMESMSODKKHNIO-LSDHHAIUSA-N 1 1 358.463 4.182 20 5 FIBDMO Cc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000459642982 1100380714 /nfs/dbraw/zinc/38/07/14/1100380714.db2.gz CICGFMXFIIBIBZ-MRXNPFEDSA-N 1 1 372.387 4.084 20 5 FIBDMO Cc1c(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000459652490 1100394609 /nfs/dbraw/zinc/39/46/09/1100394609.db2.gz BXVUMPKFLVVZRQ-MRXNPFEDSA-N 1 1 372.387 4.084 20 5 FIBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000550000387 1100612955 /nfs/dbraw/zinc/61/29/55/1100612955.db2.gz QHYANIWNYDAONQ-KCJUWKMLSA-N 1 1 356.266 4.386 20 5 FIBDMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000550000387 1100612958 /nfs/dbraw/zinc/61/29/58/1100612958.db2.gz QHYANIWNYDAONQ-KCJUWKMLSA-N 1 1 356.266 4.386 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccccc1N(C)C(C)C ZINC000438344239 1100614701 /nfs/dbraw/zinc/61/47/01/1100614701.db2.gz GOBYWLAYMVKDAV-UHFFFAOYSA-N 1 1 357.454 4.128 20 5 FIBDMO CC[C@@H](CSC)[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000518011819 1100862471 /nfs/dbraw/zinc/86/24/71/1100862471.db2.gz VMCXFCSZGUKSQG-AWEZNQCLSA-N 1 1 351.497 4.292 20 5 FIBDMO C[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+]1CCC[C@@H](C)C1 ZINC000518031467 1100874595 /nfs/dbraw/zinc/87/45/95/1100874595.db2.gz VJAGHZJMENWWTM-IAGOWNOFSA-N 1 1 361.489 4.238 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCO[C@@H](c4ccccc4)C3)o2)c1 ZINC000506339000 1100894272 /nfs/dbraw/zinc/89/42/72/1100894272.db2.gz BUSAALASFGZVJT-OAQYLSRUSA-N 1 1 364.401 4.428 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCO[C@@H](c4ccccc4)C3)o2)c1 ZINC000506339000 1100894281 /nfs/dbraw/zinc/89/42/81/1100894281.db2.gz BUSAALASFGZVJT-OAQYLSRUSA-N 1 1 364.401 4.428 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@@H+](C4CCCC4)C3)s2)cc1 ZINC000518288134 1101068390 /nfs/dbraw/zinc/06/83/90/1101068390.db2.gz GSQXKFNEDBCQGY-MRXNPFEDSA-N 1 1 371.506 4.430 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@H+](C4CCCC4)C3)s2)cc1 ZINC000518288134 1101068397 /nfs/dbraw/zinc/06/83/97/1101068397.db2.gz GSQXKFNEDBCQGY-MRXNPFEDSA-N 1 1 371.506 4.430 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CNCCC[NH+]2CCCCC2)s1 ZINC000518769670 1101527651 /nfs/dbraw/zinc/52/76/51/1101527651.db2.gz OVLMBQOCAKIORP-UHFFFAOYSA-N 1 1 359.495 4.289 20 5 FIBDMO CCN1CCC([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000506661703 1101715316 /nfs/dbraw/zinc/71/53/16/1101715316.db2.gz OYFHUWGFFSQFAQ-UHFFFAOYSA-N 1 1 359.495 4.239 20 5 FIBDMO CC[NH+]1CCC(N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000506661703 1101715334 /nfs/dbraw/zinc/71/53/34/1101715334.db2.gz OYFHUWGFFSQFAQ-UHFFFAOYSA-N 1 1 359.495 4.239 20 5 FIBDMO CC1(C)C[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC2(CCCC2)O1 ZINC000190987976 1101736420 /nfs/dbraw/zinc/73/64/20/1101736420.db2.gz NDWOGKPYUYQKCL-UHFFFAOYSA-N 1 1 371.437 4.173 20 5 FIBDMO CC1(C)C[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC2(CCCC2)O1 ZINC000190987976 1101736434 /nfs/dbraw/zinc/73/64/34/1101736434.db2.gz NDWOGKPYUYQKCL-UHFFFAOYSA-N 1 1 371.437 4.173 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@H]1CC[C@H](O)CC1 ZINC000439787011 1101784290 /nfs/dbraw/zinc/78/42/90/1101784290.db2.gz KDHDSTYSTPMQKF-MQMHXKEQSA-N 1 1 364.829 4.244 20 5 FIBDMO C[N@@H+](CCCCc1ccccc1)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000052037732 1102238709 /nfs/dbraw/zinc/23/87/09/1102238709.db2.gz YAMBDQPWCPMICA-UHFFFAOYSA-N 1 1 366.421 4.100 20 5 FIBDMO CC(C)c1ccc(C(=O)N2CCC[C@@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000473614578 1102253532 /nfs/dbraw/zinc/25/35/32/1102253532.db2.gz ALEAWJZSRXPZRH-SOLBZPMBSA-N 1 1 373.497 4.196 20 5 FIBDMO CCC[N@@H+](C)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000532513483 1102447665 /nfs/dbraw/zinc/44/76/65/1102447665.db2.gz KNWPOMXPWARCMS-KRWDZBQOSA-N 1 1 361.829 4.270 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])ccc2OC(C)C)n1 ZINC000532538369 1102453702 /nfs/dbraw/zinc/45/37/02/1102453702.db2.gz TYVZPZARVZDHDG-LJQANCHMSA-N 1 1 355.438 4.423 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc([N+](=O)[O-])ccc2OC(C)C)n1 ZINC000532538369 1102453713 /nfs/dbraw/zinc/45/37/13/1102453713.db2.gz TYVZPZARVZDHDG-LJQANCHMSA-N 1 1 355.438 4.423 20 5 FIBDMO COCc1cccc(OCC2(C[N@@H+](C)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000537640817 1102578119 /nfs/dbraw/zinc/57/81/19/1102578119.db2.gz YJSYDDAFFRPRDL-UHFFFAOYSA-N 1 1 370.449 4.032 20 5 FIBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cn2ccccc2n1 ZINC000550900353 1102677964 /nfs/dbraw/zinc/67/79/64/1102677964.db2.gz NMLOFCLIDJKIFE-NSHDSACASA-N 1 1 364.327 4.112 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2nccn2CCc2ccccc2)cc1[N+](=O)[O-] ZINC000164271103 1102685627 /nfs/dbraw/zinc/68/56/27/1102685627.db2.gz YUZDUWMRSBYXMA-QGZVFWFLSA-N 1 1 364.449 4.193 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2ccc(OC(C)C)cc2)c([N+](=O)[O-])cc1F ZINC000184301724 1102804783 /nfs/dbraw/zinc/80/47/83/1102804783.db2.gz OOBGJXLNNNQUIS-ZDUSSCGKSA-N 1 1 362.401 4.381 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@H](c4cccc(F)c4)C3)c2c1 ZINC000729471009 1102868105 /nfs/dbraw/zinc/86/81/05/1102868105.db2.gz VVIYKSSHOPCIHZ-ZDUSSCGKSA-N 1 1 373.409 4.458 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@H](c4cccc(F)c4)C3)c2c1 ZINC000729471009 1102868129 /nfs/dbraw/zinc/86/81/29/1102868129.db2.gz VVIYKSSHOPCIHZ-ZDUSSCGKSA-N 1 1 373.409 4.458 20 5 FIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(-n2ccnc2)cc1 ZINC000506939956 1102975198 /nfs/dbraw/zinc/97/51/98/1102975198.db2.gz PSMUDPQSIFGBCU-UHFFFAOYSA-N 1 1 350.422 4.191 20 5 FIBDMO C[N@H+](Cc1ccc(OC(F)F)c(Cl)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507157380 1103157439 /nfs/dbraw/zinc/15/74/39/1103157439.db2.gz XEAKKSLLTCVZSM-UHFFFAOYSA-N 1 1 356.756 4.482 20 5 FIBDMO C[N@@H+](Cc1ccc(OC(F)F)c(Cl)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507157380 1103157452 /nfs/dbraw/zinc/15/74/52/1103157452.db2.gz XEAKKSLLTCVZSM-UHFFFAOYSA-N 1 1 356.756 4.482 20 5 FIBDMO Cc1ccccc1[C@@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000507163990 1103162781 /nfs/dbraw/zinc/16/27/81/1103162781.db2.gz IAOAPPGMJMMARQ-QGZVFWFLSA-N 1 1 367.449 4.030 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)s1 ZINC000551565889 1103367728 /nfs/dbraw/zinc/36/77/28/1103367728.db2.gz XOAVVAXNHITLAS-QZTJIDSGSA-N 1 1 358.463 4.467 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2ccc(C)s2)c([N+](=O)[O-])c1 ZINC000441394356 1104327892 /nfs/dbraw/zinc/32/78/92/1104327892.db2.gz ONBHCXCBWKVFRT-HNNXBMFYSA-N 1 1 362.451 4.189 20 5 FIBDMO COc1cccc([C@H](C)[NH+]2CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000441480051 1104861152 /nfs/dbraw/zinc/86/11/52/1104861152.db2.gz JFLFNZMDNKMCGH-DLBZAZTESA-N 1 1 369.465 4.043 20 5 FIBDMO CCC[C@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000120920591 1104919807 /nfs/dbraw/zinc/91/98/07/1104919807.db2.gz CFGUCXPQTNGTMC-FQEVSTJZSA-N 1 1 359.445 4.427 20 5 FIBDMO CC(C)C[N@H+](Cc1ccccc1F)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507767508 1104929354 /nfs/dbraw/zinc/92/93/54/1104929354.db2.gz RGHLKXVMQKRGOA-UHFFFAOYSA-N 1 1 374.412 4.259 20 5 FIBDMO CC(C)C[N@@H+](Cc1ccccc1F)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507767508 1104929356 /nfs/dbraw/zinc/92/93/56/1104929356.db2.gz RGHLKXVMQKRGOA-UHFFFAOYSA-N 1 1 374.412 4.259 20 5 FIBDMO CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](C)c1ccc(F)cc1 ZINC000053088884 1104958057 /nfs/dbraw/zinc/95/80/57/1104958057.db2.gz JGIIGDKVLNIDGL-CYBMUJFWSA-N 1 1 370.384 4.367 20 5 FIBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](C)c1ccc(F)cc1 ZINC000053088884 1104958060 /nfs/dbraw/zinc/95/80/60/1104958060.db2.gz JGIIGDKVLNIDGL-CYBMUJFWSA-N 1 1 370.384 4.367 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1c(F)cccc1OC(F)F ZINC000530524808 1107102599 /nfs/dbraw/zinc/10/25/99/1107102599.db2.gz XAEVNVCPGGOANV-LLVKDONJSA-N 1 1 354.328 4.495 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc4ccc(F)cc4o3)C2)cc1 ZINC000451545615 1107163438 /nfs/dbraw/zinc/16/34/38/1107163438.db2.gz HUVJWIGGXNTZON-AWEZNQCLSA-N 1 1 355.369 4.255 20 5 FIBDMO Cc1ccccc1NC(=O)[C@H](C)[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548444 1107167919 /nfs/dbraw/zinc/16/79/19/1107167919.db2.gz NGJKDNWLUPQIER-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccccc1NC(=O)[C@H](C)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548444 1107167930 /nfs/dbraw/zinc/16/79/30/1107167930.db2.gz NGJKDNWLUPQIER-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cccc(C)c1NC(=O)C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451551718 1107171696 /nfs/dbraw/zinc/17/16/96/1107171696.db2.gz USRLNMBALDEIJV-GOSISDBHSA-N 1 1 367.449 4.030 20 5 FIBDMO Cc1cccc(C)c1NC(=O)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451551718 1107171704 /nfs/dbraw/zinc/17/17/04/1107171704.db2.gz USRLNMBALDEIJV-GOSISDBHSA-N 1 1 367.449 4.030 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H]2[C@@H]3CC[C@@H](C3)[C@@]2(C)C1 ZINC000452044520 1107442052 /nfs/dbraw/zinc/44/20/52/1107442052.db2.gz JCAXLKYKWSTQGN-JQPRRKSFSA-N 1 1 368.437 4.074 20 5 FIBDMO C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1c1cccc(F)c1 ZINC000531104750 1107537262 /nfs/dbraw/zinc/53/72/62/1107537262.db2.gz UYGSNDBOHLYKLA-YJYMSZOUSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1c1cccc(F)c1 ZINC000531104750 1107537270 /nfs/dbraw/zinc/53/72/70/1107537270.db2.gz UYGSNDBOHLYKLA-YJYMSZOUSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000531105574 1107538170 /nfs/dbraw/zinc/53/81/70/1107538170.db2.gz SNJTYWKQHSGDDT-GFCCVEGCSA-N 1 1 368.359 4.036 20 5 FIBDMO COC[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccc(F)cc1 ZINC000531206071 1107647495 /nfs/dbraw/zinc/64/74/95/1107647495.db2.gz GSDNMJSOHIYBTP-LJQANCHMSA-N 1 1 370.380 4.471 20 5 FIBDMO CC(C)[C@H](C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)N1CCCC1 ZINC000520207392 1108020258 /nfs/dbraw/zinc/02/02/58/1108020258.db2.gz URLOEBLIBCPPDI-IBGZPJMESA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1cc(C)cc([C@@H]2CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)c1 ZINC000444684699 1108088837 /nfs/dbraw/zinc/08/88/37/1108088837.db2.gz LEXGGGXGAWEPFT-OAHLLOKOSA-N 1 1 350.422 4.077 20 5 FIBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000523441380 1108225683 /nfs/dbraw/zinc/22/56/83/1108225683.db2.gz PQRNOKOLCDOHCY-OAHLLOKOSA-N 1 1 366.421 4.016 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000523444066 1108227170 /nfs/dbraw/zinc/22/71/70/1108227170.db2.gz MSLBKUMCILPVBV-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000523444066 1108227177 /nfs/dbraw/zinc/22/71/77/1108227177.db2.gz MSLBKUMCILPVBV-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO C[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000453228661 1108301348 /nfs/dbraw/zinc/30/13/48/1108301348.db2.gz AUWHDDGCRKYSTL-VHHKXPHXSA-N 1 1 365.477 4.441 20 5 FIBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000523860062 1108609986 /nfs/dbraw/zinc/60/99/86/1108609986.db2.gz ACYNVDXNMZQWIW-HNNXBMFYSA-N 1 1 358.442 4.293 20 5 FIBDMO C[C@@H]1SCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000524035666 1108765209 /nfs/dbraw/zinc/76/52/09/1108765209.db2.gz AEPBTNDZKJWZHG-HNAYVOBHSA-N 1 1 358.463 4.152 20 5 FIBDMO CC(C)(C)OC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Br)CC1 ZINC001168144674 1108830963 /nfs/dbraw/zinc/83/09/63/1108830963.db2.gz FMNDSEWSHFIBJG-UHFFFAOYSA-N 1 1 371.275 4.137 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H](CO)c1c(Cl)cccc1Cl ZINC000475633957 1108951291 /nfs/dbraw/zinc/95/12/91/1108951291.db2.gz HYGCVPZNCAXMQQ-CSPWOOARSA-N 1 1 367.232 4.238 20 5 FIBDMO COc1ccc(OCC[N@@H+](Cc2ccc(F)cc2)C(C)C)c([N+](=O)[O-])c1 ZINC000441272616 1109544476 /nfs/dbraw/zinc/54/44/76/1109544476.db2.gz AITKPYUYYOQTMN-UHFFFAOYSA-N 1 1 362.401 4.032 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000447557630 1109580442 /nfs/dbraw/zinc/58/04/42/1109580442.db2.gz MUNWMPUMPGKHKR-CQSZACIVSA-N 1 1 355.438 4.118 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1cccs1 ZINC000026231505 1109889633 /nfs/dbraw/zinc/88/96/33/1109889633.db2.gz OJKXSZMGGBWMMI-MRXNPFEDSA-N 1 1 359.451 4.130 20 5 FIBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000449496992 1110093253 /nfs/dbraw/zinc/09/32/53/1110093253.db2.gz QPSLVGCXWLVQPX-IFXJQAMLSA-N 1 1 374.437 4.110 20 5 FIBDMO CC(C)(C)c1ncc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449498484 1110093760 /nfs/dbraw/zinc/09/37/60/1110093760.db2.gz KSMDTTWZQUEGMS-QGZVFWFLSA-N 1 1 354.454 4.062 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCSC[C@@H]3C3CC3)cs2)c1 ZINC000449527557 1110100160 /nfs/dbraw/zinc/10/01/60/1110100160.db2.gz JIOBEARWRMFCKA-MRXNPFEDSA-N 1 1 361.492 4.046 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCSC[C@@H]3C3CC3)cs2)c1 ZINC000449527557 1110100162 /nfs/dbraw/zinc/10/01/62/1110100162.db2.gz JIOBEARWRMFCKA-MRXNPFEDSA-N 1 1 361.492 4.046 20 5 FIBDMO C[C@@H](Nc1nccc2c1cccc2[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000450433747 1110297169 /nfs/dbraw/zinc/29/71/69/1110297169.db2.gz LLHLLSGIKOVXPX-HUUCEWRRSA-N 1 1 354.454 4.208 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(CCc3ccccc3)n2)cc1[N+](=O)[O-] ZINC000450690260 1110330723 /nfs/dbraw/zinc/33/07/23/1110330723.db2.gz YPSZXZRBQKLMBC-QGZVFWFLSA-N 1 1 364.449 4.193 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@H]([N@@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000470177259 1111306577 /nfs/dbraw/zinc/30/65/77/1111306577.db2.gz BJVJSUSZGDOKFM-UXSNQMCBSA-N 1 1 357.498 4.335 20 5 FIBDMO C[C@@H]1CCC[C@@H](CC[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552042455 1111554977 /nfs/dbraw/zinc/55/49/77/1111554977.db2.gz GONRTSQOSRRXNL-JTDSTZFVSA-N 1 1 356.470 4.224 20 5 FIBDMO Cn1ccnc1[C@H]([NH2+]CCCC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000552253633 1111645873 /nfs/dbraw/zinc/64/58/73/1111645873.db2.gz MSRFJYMIXGRDJD-LJQANCHMSA-N 1 1 356.470 4.368 20 5 FIBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000478046788 1111664233 /nfs/dbraw/zinc/66/42/33/1111664233.db2.gz OKWBGFVZSGAFLU-OAHLLOKOSA-N 1 1 368.359 4.037 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccc2)C2(CO)CCC2)c(Cl)c1 ZINC000552316731 1111675699 /nfs/dbraw/zinc/67/56/99/1111675699.db2.gz KWXOARQQLBHRSF-GOSISDBHSA-N 1 1 360.841 4.242 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000480204260 1112330485 /nfs/dbraw/zinc/33/04/85/1112330485.db2.gz SSYLIEVEGLALSP-UKRRQHHQSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000480204260 1112330490 /nfs/dbraw/zinc/33/04/90/1112330490.db2.gz SSYLIEVEGLALSP-UKRRQHHQSA-N 1 1 373.840 4.065 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c(Cl)ccc2cccnc21 ZINC000554846206 1112520190 /nfs/dbraw/zinc/52/01/90/1112520190.db2.gz NGQHNSBLNJEHCC-UHFFFAOYSA-N 1 1 355.825 4.471 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)c1OC ZINC000554848961 1112528114 /nfs/dbraw/zinc/52/81/14/1112528114.db2.gz NEOFJZCXVVLOTD-UHFFFAOYSA-N 1 1 356.422 4.085 20 5 FIBDMO COc1ccccc1O[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000554873670 1112540174 /nfs/dbraw/zinc/54/01/74/1112540174.db2.gz PDEDTLRHGODNGH-OTIVFRFGSA-N 1 1 368.433 4.160 20 5 FIBDMO CC[C@@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1cccc([N+](=O)[O-])c1 ZINC000480693462 1112548846 /nfs/dbraw/zinc/54/88/46/1112548846.db2.gz IKSJOEDHYIGELQ-OAHLLOKOSA-N 1 1 358.829 4.376 20 5 FIBDMO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1nc(C(F)(F)F)cs1 ZINC000486801497 1113652816 /nfs/dbraw/zinc/65/28/16/1113652816.db2.gz UMPLOFNGPYDKLE-OAQKJQOQSA-N 1 1 357.357 4.434 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490090408 1114216988 /nfs/dbraw/zinc/21/69/88/1114216988.db2.gz UPTTYKHASFTVKT-INIZCTEOSA-N 1 1 358.463 4.218 20 5 FIBDMO O=[N+]([O-])c1cccnc1NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1 ZINC000029622149 1114340074 /nfs/dbraw/zinc/34/00/74/1114340074.db2.gz YLFNGSFMUGDEEL-HNNXBMFYSA-N 1 1 364.808 4.031 20 5 FIBDMO COc1cc(C[N@@H+](C(C)C)C2CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000491093698 1114372447 /nfs/dbraw/zinc/37/24/47/1114372447.db2.gz WMCXHNYPRZWPHB-UHFFFAOYSA-N 1 1 372.412 4.400 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OCC(F)F ZINC000491095631 1114373304 /nfs/dbraw/zinc/37/33/04/1114373304.db2.gz ZUODJRRRWWCVLY-TZMCWYRMSA-N 1 1 370.396 4.012 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@@H+]2Cn2c3cc([N+](=O)[O-])ccc3oc2=S)n1 ZINC000164831319 1114591151 /nfs/dbraw/zinc/59/11/51/1114591151.db2.gz RANGRODESDGHJY-OAHLLOKOSA-N 1 1 370.434 4.370 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cn2c3cc([N+](=O)[O-])ccc3oc2=S)n1 ZINC000164831319 1114591153 /nfs/dbraw/zinc/59/11/53/1114591153.db2.gz RANGRODESDGHJY-OAHLLOKOSA-N 1 1 370.434 4.370 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC(c3cccnc3)CC2)c1 ZINC000590168678 1114902812 /nfs/dbraw/zinc/90/28/12/1114902812.db2.gz TZUHANDPZCFHRF-UHFFFAOYSA-N 1 1 365.355 4.388 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000573046421 1115003208 /nfs/dbraw/zinc/00/32/08/1115003208.db2.gz ZLBDKVFQWRUARH-IAGOWNOFSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000573046420 1115003362 /nfs/dbraw/zinc/00/33/62/1115003362.db2.gz ZLBDKVFQWRUARH-DLBZAZTESA-N 1 1 367.449 4.110 20 5 FIBDMO COc1ccccc1C1([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000592145730 1115209584 /nfs/dbraw/zinc/20/95/84/1115209584.db2.gz YVDVPLNESYCLTE-UHFFFAOYSA-N 1 1 366.339 4.401 20 5 FIBDMO C[C@H]1CC2(C[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CCOCC2 ZINC000592185024 1115222087 /nfs/dbraw/zinc/22/20/87/1115222087.db2.gz UDNZNWRVIWYKLZ-LBPRGKRZSA-N 1 1 358.360 4.005 20 5 FIBDMO CC(=O)Nc1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3C)cc2)cc1[N+](=O)[O-] ZINC000592985989 1115278528 /nfs/dbraw/zinc/27/85/28/1115278528.db2.gz JWTSHAQROZJHMF-CQSZACIVSA-N 1 1 353.422 4.205 20 5 FIBDMO Cc1ccc(C[NH2+][C@H](CO)c2cccc(Cl)c2Cl)cc1[N+](=O)[O-] ZINC000595000155 1115506508 /nfs/dbraw/zinc/50/65/08/1115506508.db2.gz JHUHKQPNEFWEBC-CQSZACIVSA-N 1 1 355.221 4.033 20 5 FIBDMO CCOc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)CCO2 ZINC000595031676 1115510264 /nfs/dbraw/zinc/51/02/64/1115510264.db2.gz BJMFZCOWVMYHFG-ACJLOTCBSA-N 1 1 372.421 4.177 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC000595037867 1115510907 /nfs/dbraw/zinc/51/09/07/1115510907.db2.gz IZOAMBGDPOUCBV-SNVBAGLBSA-N 1 1 370.327 4.195 20 5 FIBDMO COc1ccccc1-c1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)on1 ZINC000595102781 1115516133 /nfs/dbraw/zinc/51/61/33/1115516133.db2.gz JRRLKEOZTAPIDV-AWEZNQCLSA-N 1 1 367.405 4.418 20 5 FIBDMO COc1cc(C[N@H+]2C[C@H](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000575026887 1115529995 /nfs/dbraw/zinc/52/99/95/1115529995.db2.gz FCZCDGDHHFVNIU-PBHICJAKSA-N 1 1 356.422 4.195 20 5 FIBDMO CC(C)n1cc(C2=CCC[N@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)nn1 ZINC000595518286 1115539864 /nfs/dbraw/zinc/53/98/64/1115539864.db2.gz UNRRMYFZJVKNSF-OAHLLOKOSA-N 1 1 355.442 4.008 20 5 FIBDMO CC[C@@H](CC(F)F)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000595562764 1115540784 /nfs/dbraw/zinc/54/07/84/1115540784.db2.gz LOMCIDZBGFMZBH-XIRDDKMYSA-N 1 1 370.440 4.382 20 5 FIBDMO Cc1noc(C[NH2+][C@@](C)(Cc2ccccc2)c2ccccc2)c1[N+](=O)[O-] ZINC000595543928 1115542095 /nfs/dbraw/zinc/54/20/95/1115542095.db2.gz SHWKTRXKZBUASI-FQEVSTJZSA-N 1 1 351.406 4.139 20 5 FIBDMO C[C@H]([NH2+][C@H](CO)c1cccc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000595827443 1115564895 /nfs/dbraw/zinc/56/48/95/1115564895.db2.gz BXPAMCPWFBUBCQ-ZUZCIYMTSA-N 1 1 355.221 4.286 20 5 FIBDMO C[C@H]([NH2+][C@@H](CO)c1cccc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000595827441 1115564982 /nfs/dbraw/zinc/56/49/82/1115564982.db2.gz BXPAMCPWFBUBCQ-BONVTDFDSA-N 1 1 355.221 4.286 20 5 FIBDMO COc1ccccc1[C@H]1CCC[N@@H+]1Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761289933 1115755789 /nfs/dbraw/zinc/75/57/89/1115755789.db2.gz INEKDBOHECHPOR-GOSISDBHSA-N 1 1 366.421 4.056 20 5 FIBDMO COc1ccccc1[C@H]1CCC[N@H+]1Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761289933 1115755791 /nfs/dbraw/zinc/75/57/91/1115755791.db2.gz INEKDBOHECHPOR-GOSISDBHSA-N 1 1 366.421 4.056 20 5 FIBDMO CCc1ccc([C@H](NC[C@H]2CCCC[N@@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599072035 1115787134 /nfs/dbraw/zinc/78/71/34/1115787134.db2.gz WZELYUUUCZYSPF-IIBYNOLFSA-N 1 1 371.481 4.161 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)cc1F ZINC000599444408 1115815460 /nfs/dbraw/zinc/81/54/60/1115815460.db2.gz VTQFDSUESGWESZ-WGSAOQKQSA-N 1 1 372.440 4.348 20 5 FIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000603838682 1115818351 /nfs/dbraw/zinc/81/83/51/1115818351.db2.gz BFBPTYXDICRODY-SFHVURJKSA-N 1 1 356.422 4.339 20 5 FIBDMO C[C@H](C[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000599633226 1115832528 /nfs/dbraw/zinc/83/25/28/1115832528.db2.gz OFVJRMROLDMXSC-CQSZACIVSA-N 1 1 358.442 4.293 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000604435462 1115865413 /nfs/dbraw/zinc/86/54/13/1115865413.db2.gz BUQUNDKWDCGPKF-MRXNPFEDSA-N 1 1 355.438 4.233 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+](Cc2ccc(F)cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000063483169 1116073727 /nfs/dbraw/zinc/07/37/27/1116073727.db2.gz FUVAJTSWXUKXTR-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)no1)Cc1ccccc1[N+](=O)[O-] ZINC000608780197 1116128370 /nfs/dbraw/zinc/12/83/70/1116128370.db2.gz KEUJCWLAVJKPCZ-UHFFFAOYSA-N 1 1 369.396 4.454 20 5 FIBDMO CC[N@@H+](CCc1cccs1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534849042 1116242449 /nfs/dbraw/zinc/24/24/49/1116242449.db2.gz ZZDSGBUCPUJTAG-UHFFFAOYSA-N 1 1 357.435 4.376 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3C3CCOCC3)o2)cc1 ZINC000539669158 1116363404 /nfs/dbraw/zinc/36/34/04/1116363404.db2.gz LWRJYMQHGDSTKY-LJQANCHMSA-N 1 1 356.422 4.246 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]4COCC[C@H]43)s2)cc1 ZINC000539891331 1116395871 /nfs/dbraw/zinc/39/58/71/1116395871.db2.gz LMZKIIOOZBJTGN-MAUKXSAKSA-N 1 1 358.463 4.324 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)o1 ZINC000539897041 1117739880 /nfs/dbraw/zinc/73/98/80/1117739880.db2.gz XWYSYPLQAJPZBQ-HOTGVXAUSA-N 1 1 356.422 4.103 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@@H+](CC3CCCC3)C2)o1 ZINC000462735485 1117741621 /nfs/dbraw/zinc/74/16/21/1117741621.db2.gz BKBVWUDKFFVVFW-QGZVFWFLSA-N 1 1 369.465 4.209 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCN(CC3CCCC3)C2)o1 ZINC000462735485 1117741623 /nfs/dbraw/zinc/74/16/23/1117741623.db2.gz BKBVWUDKFFVVFW-QGZVFWFLSA-N 1 1 369.465 4.209 20 5 FIBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1)Cc1ccccc1 ZINC000462930582 1117866758 /nfs/dbraw/zinc/86/67/58/1117866758.db2.gz JFTLOMXNPQLHRG-UHFFFAOYSA-N 1 1 365.380 4.130 20 5 FIBDMO C[C@@H]([NH2+]Cc1nn(-c2ccccc2)c2c1CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000540188289 1117920572 /nfs/dbraw/zinc/92/05/72/1117920572.db2.gz IPTPMZHVPPSLNM-OAHLLOKOSA-N 1 1 362.433 4.120 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](n4cccn4)C3)o2)c(Cl)c1 ZINC000463038120 1117932044 /nfs/dbraw/zinc/93/20/44/1117932044.db2.gz XGIPVUSGBQEQJE-CQSZACIVSA-N 1 1 372.812 4.152 20 5 FIBDMO CSc1cc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)ccn1 ZINC000540809542 1118257665 /nfs/dbraw/zinc/25/76/65/1118257665.db2.gz NPLBWBGDOUBVRC-UHFFFAOYSA-N 1 1 372.475 4.125 20 5 FIBDMO CC[C@H]([NH2+][C@@H](C(=O)N(CC)CC)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000090068655 1118323695 /nfs/dbraw/zinc/32/36/95/1118323695.db2.gz RCHDVLAWAFCTCW-VQTJNVASSA-N 1 1 369.465 4.245 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]CCc2ccccc2O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541543886 1118549368 /nfs/dbraw/zinc/54/93/68/1118549368.db2.gz UMIIVWOHSYUHOL-NRFANRHFSA-N 1 1 366.417 4.378 20 5 FIBDMO CCc1ccc([C@H]([NH2+][C@H](C)Cc2cc(C)[nH]n2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541564647 1118556789 /nfs/dbraw/zinc/55/67/89/1118556789.db2.gz AONUZFYZJMJYFV-ZUOKHONESA-N 1 1 368.437 4.092 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C[C@H](C)Sc2sccc21 ZINC000541569815 1118567131 /nfs/dbraw/zinc/56/71/31/1118567131.db2.gz PXEGTTWAKJEWEN-IINYFYTJSA-N 1 1 350.465 4.380 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000541701956 1118616545 /nfs/dbraw/zinc/61/65/45/1118616545.db2.gz ZTWZRZBPLQGYGD-FXAWDEMLSA-N 1 1 374.412 4.095 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](CSc3ccccc3)C2)cc1 ZINC000464762044 1118684523 /nfs/dbraw/zinc/68/45/23/1118684523.db2.gz ICZDEOLPKNFHMV-INIZCTEOSA-N 1 1 358.463 4.088 20 5 FIBDMO Cc1ccc(CC[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H]2CCCO2)cc1 ZINC000464781922 1118693067 /nfs/dbraw/zinc/69/30/67/1118693067.db2.gz WYQBQCFYFPJCFA-SFHVURJKSA-N 1 1 360.479 4.188 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@H](C)C[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000464849742 1118722001 /nfs/dbraw/zinc/72/20/01/1118722001.db2.gz IHBZLVCYRBGHFR-GOEBONIOSA-N 1 1 360.410 4.048 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C)C[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000464849744 1118722170 /nfs/dbraw/zinc/72/21/70/1118722170.db2.gz IHBZLVCYRBGHFR-ZBFHGGJFSA-N 1 1 360.410 4.048 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1)CCC2 ZINC000492702222 1119168618 /nfs/dbraw/zinc/16/86/18/1119168618.db2.gz KHSDLWJCXSXXNR-HNNXBMFYSA-N 1 1 361.467 4.132 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000492912790 1119212590 /nfs/dbraw/zinc/21/25/90/1119212590.db2.gz QCGWLFRTFLOPAQ-KKSFZXQISA-N 1 1 352.434 4.138 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000492912790 1119212596 /nfs/dbraw/zinc/21/25/96/1119212596.db2.gz QCGWLFRTFLOPAQ-KKSFZXQISA-N 1 1 352.434 4.138 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000493179057 1119331584 /nfs/dbraw/zinc/33/15/84/1119331584.db2.gz GINWDOJXVZUHQJ-SFHVURJKSA-N 1 1 360.841 4.120 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000493179057 1119331588 /nfs/dbraw/zinc/33/15/88/1119331588.db2.gz GINWDOJXVZUHQJ-SFHVURJKSA-N 1 1 360.841 4.120 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000761512881 1119405946 /nfs/dbraw/zinc/40/59/46/1119405946.db2.gz YWUWQRXCGVMUAN-XKQJLSEDSA-N 1 1 352.862 4.274 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccs2)C[C@H]2CCCO2)cc1Cl ZINC000761506035 1119406532 /nfs/dbraw/zinc/40/65/32/1119406532.db2.gz MUTOGTASSSSBFB-CQSZACIVSA-N 1 1 366.870 4.491 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)cc1Cl ZINC000761506035 1119406535 /nfs/dbraw/zinc/40/65/35/1119406535.db2.gz MUTOGTASSSSBFB-CQSZACIVSA-N 1 1 366.870 4.491 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000494262286 1119814616 /nfs/dbraw/zinc/81/46/16/1119814616.db2.gz NDOGBYRROSUPBF-SSZFMOIBSA-N 1 1 367.449 4.267 20 5 FIBDMO CCc1ccc([C@H]([NH2+]CC2([C@@H](O)C(C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542494065 1120066007 /nfs/dbraw/zinc/06/60/07/1120066007.db2.gz JQLGZMWTDKDPEI-UXHICEINSA-N 1 1 372.465 4.226 20 5 FIBDMO O=C(Nc1ccccc1)C1CC[NH+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174811622 1121034428 /nfs/dbraw/zinc/03/44/28/1121034428.db2.gz RBSPKJYHXFNHTO-UHFFFAOYSA-N 1 1 373.840 4.099 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000301143486 1121475046 /nfs/dbraw/zinc/47/50/46/1121475046.db2.gz DLEKBYLYMMNUIB-SECBINFHSA-N 1 1 374.750 4.374 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000917134003 1122190850 /nfs/dbraw/zinc/19/08/50/1122190850.db2.gz LSXHFQMDVPPMAB-MRXNPFEDSA-N 1 1 365.433 4.464 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000301551231 1122219899 /nfs/dbraw/zinc/21/98/99/1122219899.db2.gz QRKNULZEKKYDQI-VQIMIIECSA-N 1 1 369.465 4.206 20 5 FIBDMO COc1ccc(C[N@@H+](C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000273411197 1122254190 /nfs/dbraw/zinc/25/41/90/1122254190.db2.gz IIGGXFAZOKPLHQ-PXNSSMCTSA-N 1 1 374.412 4.095 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000542709034 1122311119 /nfs/dbraw/zinc/31/11/19/1122311119.db2.gz GECWAOKPVYBTOW-ICSRJNTNSA-N 1 1 358.413 4.394 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccccc3F)CC2)ccc1Br ZINC000130534155 1122422920 /nfs/dbraw/zinc/42/29/20/1122422920.db2.gz BCNHQFKKHADEIF-UHFFFAOYSA-N 1 1 365.202 4.275 20 5 FIBDMO O=[N+]([O-])c1ccc(CSC[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)cc1 ZINC000556339603 1122822676 /nfs/dbraw/zinc/82/26/76/1122822676.db2.gz BBDVCEJXGWSLOF-HXUWFJFHSA-N 1 1 372.490 4.119 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCSC[C@@H]2c2ccccc2)cc1 ZINC000609672574 1123790117 /nfs/dbraw/zinc/79/01/17/1123790117.db2.gz QENWJEGHRXULCY-LJQANCHMSA-N 1 1 358.463 4.154 20 5 FIBDMO COc1cc(C[N@H+]2CCCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000609766971 1123825447 /nfs/dbraw/zinc/82/54/47/1123825447.db2.gz AEFMABHVXIFSNC-CYBMUJFWSA-N 1 1 358.385 4.215 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@@H+]4CCCC[C@@H]34)s2)cc1 ZINC000238003739 1124224473 /nfs/dbraw/zinc/22/44/73/1124224473.db2.gz GSGRQPUHVODOTB-ROUUACIJSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@H+]4CCCC[C@@H]34)s2)cc1 ZINC000238003739 1124224480 /nfs/dbraw/zinc/22/44/80/1124224480.db2.gz GSGRQPUHVODOTB-ROUUACIJSA-N 1 1 357.479 4.040 20 5 FIBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542853564 1124466634 /nfs/dbraw/zinc/46/66/34/1124466634.db2.gz GCMNJFTXCYWSCT-FOIQADDNSA-N 1 1 354.454 4.007 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2nc(C)cc(C)c2[N+](=O)[O-])cc1 ZINC000542865590 1124524053 /nfs/dbraw/zinc/52/40/53/1124524053.db2.gz NCAHHWPNEWUUMQ-CQSZACIVSA-N 1 1 351.410 4.274 20 5 FIBDMO CC(=O)c1ccc(N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000301678225 1124954424 /nfs/dbraw/zinc/95/44/24/1124954424.db2.gz RNYWHKGHFFIEDV-INIZCTEOSA-N 1 1 373.497 4.278 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000489005475 1125057002 /nfs/dbraw/zinc/05/70/02/1125057002.db2.gz QEOZCDAWNYDGBM-GDBMZVCRSA-N 1 1 359.401 4.042 20 5 FIBDMO C[N@H+]1CCC[C@H](CNc2ncc(Cl)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301753108 1125209422 /nfs/dbraw/zinc/20/94/22/1125209422.db2.gz VYIZDQRIITWQKY-ABAIWWIYSA-N 1 1 366.874 4.200 20 5 FIBDMO Cc1cc(NC2CC[NH+](Cc3ccc(F)c(F)c3)CC2)ccc1[N+](=O)[O-] ZINC000108096468 222409864 /nfs/dbraw/zinc/40/98/64/222409864.db2.gz JCRXRPNYTFCSDT-UHFFFAOYSA-N 1 1 361.392 4.258 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1F ZINC000182007318 568388398 /nfs/dbraw/zinc/38/83/98/568388398.db2.gz ZFUAZSCTCTWSNV-ZDUSSCGKSA-N 1 1 362.401 4.381 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000619722886 1125669853 /nfs/dbraw/zinc/66/98/53/1125669853.db2.gz PYWJBCZYFFEFIG-WBVHZDCISA-N 1 1 354.454 4.068 20 5 FIBDMO Cc1nn(-c2ccccc2)c(C)c1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000577561764 1079595694 /nfs/dbraw/zinc/59/56/94/1079595694.db2.gz BZQHHXWJTMITAW-UHFFFAOYSA-N 1 1 364.449 4.072 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(c3ccsc3)CC2)cccc1[N+](=O)[O-] ZINC000186940567 1079746985 /nfs/dbraw/zinc/74/69/85/1079746985.db2.gz VEDPJWJVMQHJIM-AWEZNQCLSA-N 1 1 373.478 4.171 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@H]3c3ccncc3)o2)c1 ZINC000154036992 1079927527 /nfs/dbraw/zinc/92/75/27/1079927527.db2.gz YLRNIFWFLDCBQJ-GOSISDBHSA-N 1 1 364.405 4.024 20 5 FIBDMO CC[C@H]1CC[N@H+]1Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000430207832 1079953837 /nfs/dbraw/zinc/95/38/37/1079953837.db2.gz RSOUBWLUJTZOSR-KRWDZBQOSA-N 1 1 356.422 4.167 20 5 FIBDMO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430210379 1079963579 /nfs/dbraw/zinc/96/35/79/1079963579.db2.gz DBFWJJAZBKVKMM-GOSISDBHSA-N 1 1 358.438 4.489 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000430214055 1079988187 /nfs/dbraw/zinc/98/81/87/1079988187.db2.gz DTLJXZSXXDZBTO-HNNXBMFYSA-N 1 1 354.328 4.387 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccc(OC(C)C)c(OC)c1 ZINC000430229477 1080035253 /nfs/dbraw/zinc/03/52/53/1080035253.db2.gz VTIMHJRURRPGAH-AWEZNQCLSA-N 1 1 374.437 4.250 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(Br)ccc1F ZINC000126944302 1080035665 /nfs/dbraw/zinc/03/56/65/1080035665.db2.gz WLHXTUBGFQEZDB-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO CC(C)C[C@@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000246962160 1080653169 /nfs/dbraw/zinc/65/31/69/1080653169.db2.gz CIBVFPHXWYPYTA-CABCVRRESA-N 1 1 358.442 4.464 20 5 FIBDMO CCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1OC ZINC001167216964 1080858715 /nfs/dbraw/zinc/85/87/15/1080858715.db2.gz CJXYQBJNVDQFIE-MRXNPFEDSA-N 1 1 358.438 4.455 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000610001986 1081372381 /nfs/dbraw/zinc/37/23/81/1081372381.db2.gz ROEIIVKIJFVSAX-CVEARBPZSA-N 1 1 368.433 4.148 20 5 FIBDMO CC1CCC(OC2CC[NH+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)CC1 ZINC001167364283 1081729208 /nfs/dbraw/zinc/72/92/08/1081729208.db2.gz YYHJIBHXOZCFMA-UHFFFAOYSA-N 1 1 350.434 4.294 20 5 FIBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](CCc2ccc(Cl)cc2)CC2CC2)c1 ZINC001167376300 1081812320 /nfs/dbraw/zinc/81/23/20/1081812320.db2.gz IQWCQTKDXRTBPT-HXUWFJFHSA-N 1 1 374.868 4.236 20 5 FIBDMO CC[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC001167380733 1081853482 /nfs/dbraw/zinc/85/34/82/1081853482.db2.gz ILVSWLBYIGOOTH-STQMWFEESA-N 1 1 353.850 4.087 20 5 FIBDMO CC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC001167380733 1081853488 /nfs/dbraw/zinc/85/34/88/1081853488.db2.gz ILVSWLBYIGOOTH-STQMWFEESA-N 1 1 353.850 4.087 20 5 FIBDMO Cc1ccc(C[N@@H+](CC(C)C)C[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001167439536 1082235978 /nfs/dbraw/zinc/23/59/78/1082235978.db2.gz ZCIPTLVTAFVZHA-HXUWFJFHSA-N 1 1 360.429 4.234 20 5 FIBDMO COc1cc(C[N@@H+]2CCCCC[C@H]2c2ccncc2)c([N+](=O)[O-])cc1OC ZINC000157016518 1082426745 /nfs/dbraw/zinc/42/67/45/1082426745.db2.gz OCNQAKDYVZUJBJ-KRWDZBQOSA-N 1 1 371.437 4.124 20 5 FIBDMO COc1cc(C[N@H+]2CCCCC[C@H]2c2ccncc2)c([N+](=O)[O-])cc1OC ZINC000157016518 1082426746 /nfs/dbraw/zinc/42/67/46/1082426746.db2.gz OCNQAKDYVZUJBJ-KRWDZBQOSA-N 1 1 371.437 4.124 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cc(Br)ccc1F ZINC000581558518 1082662334 /nfs/dbraw/zinc/66/23/34/1082662334.db2.gz SLCXAWDPSMTSBY-OAHLLOKOSA-N 1 1 365.202 4.274 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1 ZINC000055910980 1082926615 /nfs/dbraw/zinc/92/66/15/1082926615.db2.gz DEQDJMMAOPOAAV-IBGZPJMESA-N 1 1 354.406 4.107 20 5 FIBDMO C[N@@H+](CCCCc1ccccc1)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000053085916 1083664030 /nfs/dbraw/zinc/66/40/30/1083664030.db2.gz BIFKDEPGYGUMBC-UHFFFAOYSA-N 1 1 366.421 4.100 20 5 FIBDMO CCCO[C@@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000364529491 1083665292 /nfs/dbraw/zinc/66/52/92/1083665292.db2.gz PKLPVYJSMZWINS-GOSISDBHSA-N 1 1 373.453 4.073 20 5 FIBDMO Cc1ccc(-c2nc(C[N@H+](C)CCc3cccc([N+](=O)[O-])c3)co2)cc1 ZINC000548928212 1083783562 /nfs/dbraw/zinc/78/35/62/1083783562.db2.gz LBZURSVGSAOTPF-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO Cc1ccc(-c2nc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)co2)cc1 ZINC000548928212 1083783570 /nfs/dbraw/zinc/78/35/70/1083783570.db2.gz LBZURSVGSAOTPF-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO COc1ccc(C(=O)C2CC[NH+](Cc3ccc(C)c([N+](=O)[O-])c3)CC2)cc1 ZINC000179880944 1083803607 /nfs/dbraw/zinc/80/36/07/1083803607.db2.gz REGJRXPUGFJZQS-UHFFFAOYSA-N 1 1 368.433 4.007 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCc3sc(Br)cc3C2)cc1 ZINC000610990049 1083937139 /nfs/dbraw/zinc/93/71/39/1083937139.db2.gz DXSMHJVLNMBDBB-UHFFFAOYSA-N 1 1 367.268 4.020 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3sc(Br)cc3C2)cc1 ZINC000610990049 1083937143 /nfs/dbraw/zinc/93/71/43/1083937143.db2.gz DXSMHJVLNMBDBB-UHFFFAOYSA-N 1 1 367.268 4.020 20 5 FIBDMO Cn1ccnc1[C@H]([NH2+]CCCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000611560405 1084046527 /nfs/dbraw/zinc/04/65/27/1084046527.db2.gz VTABMUIEGOSHGG-HXUWFJFHSA-N 1 1 364.449 4.030 20 5 FIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1C(F)(F)F ZINC000065532982 1084251943 /nfs/dbraw/zinc/25/19/43/1084251943.db2.gz AROHEJUIVKFMHD-UHFFFAOYSA-N 1 1 354.328 4.124 20 5 FIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C[C@@H]1CCCOC1 ZINC000119701520 1084358093 /nfs/dbraw/zinc/35/80/93/1084358093.db2.gz ZDLWJEFFFDHUNI-ZDUSSCGKSA-N 1 1 364.829 4.367 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1sccc1Br ZINC000511079973 1084670413 /nfs/dbraw/zinc/67/04/13/1084670413.db2.gz HIEZRBKLIJWJSH-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1sccc1Br ZINC000511079973 1084670421 /nfs/dbraw/zinc/67/04/21/1084670421.db2.gz HIEZRBKLIJWJSH-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000551737502 1084707950 /nfs/dbraw/zinc/70/79/50/1084707950.db2.gz KCQVFWYXXQAPRD-AWEZNQCLSA-N 1 1 361.392 4.146 20 5 FIBDMO CCc1ccc([C@@H](NCC[C@H]2CCC[N@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000414178950 1084745183 /nfs/dbraw/zinc/74/51/83/1084745183.db2.gz KNJKWGUZCHQFIS-IERDGZPVSA-N 1 1 371.481 4.161 20 5 FIBDMO CCc1ccc([C@@H](NCC[C@H]2CCC[N@@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000414178950 1084745192 /nfs/dbraw/zinc/74/51/92/1084745192.db2.gz KNJKWGUZCHQFIS-IERDGZPVSA-N 1 1 371.481 4.161 20 5 FIBDMO Cc1c(C[NH2+][C@@H](c2ccc(F)cc2)c2cccnc2)cccc1[N+](=O)[O-] ZINC000478491903 1084953732 /nfs/dbraw/zinc/95/37/32/1084953732.db2.gz PPPLQAJONIRTQL-FQEVSTJZSA-N 1 1 351.381 4.317 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175910844 1085031812 /nfs/dbraw/zinc/03/18/12/1085031812.db2.gz GGJXWJLSDJASDK-FUHIMQAGSA-N 1 1 353.466 4.299 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175910844 1085031819 /nfs/dbraw/zinc/03/18/19/1085031819.db2.gz GGJXWJLSDJASDK-FUHIMQAGSA-N 1 1 353.466 4.299 20 5 FIBDMO Cc1ccc(C[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-] ZINC000127816282 1085114010 /nfs/dbraw/zinc/11/40/10/1085114010.db2.gz KHEPOCTVIYYOGE-MRXNPFEDSA-N 1 1 351.406 4.424 20 5 FIBDMO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000181757990 1085396348 /nfs/dbraw/zinc/39/63/48/1085396348.db2.gz QBBHVBLKUANREM-NSHDSACASA-N 1 1 373.796 4.284 20 5 FIBDMO CCC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000480080051 1085412284 /nfs/dbraw/zinc/41/22/84/1085412284.db2.gz FWOPIMWLZYSZQU-PXNSSMCTSA-N 1 1 353.422 4.045 20 5 FIBDMO CCC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000480080049 1085412896 /nfs/dbraw/zinc/41/28/96/1085412896.db2.gz FWOPIMWLZYSZQU-FXAWDEMLSA-N 1 1 353.422 4.045 20 5 FIBDMO CC[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[C@@H]1c1ccccc1 ZINC001167601539 1085422799 /nfs/dbraw/zinc/42/27/99/1085422799.db2.gz DHHDGDUOQIJPIH-QAPCUYQASA-N 1 1 364.449 4.487 20 5 FIBDMO CCC(=O)c1ccc(N[C@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000480112557 1085424885 /nfs/dbraw/zinc/42/48/85/1085424885.db2.gz UKPCNIBPDADFRY-GDBMZVCRSA-N 1 1 359.470 4.252 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc(F)cc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000178649026 1085563317 /nfs/dbraw/zinc/56/33/17/1085563317.db2.gz QUGQAQKSVSJTPS-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO COC(=O)c1ccc(Cl)c(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000511190211 1085566874 /nfs/dbraw/zinc/56/68/74/1085566874.db2.gz XTAKIPLRIHJHMP-UHFFFAOYSA-N 1 1 362.813 4.060 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000109103710 1085588820 /nfs/dbraw/zinc/58/88/20/1085588820.db2.gz YPRAGBWHRAJQJX-MRXNPFEDSA-N 1 1 355.438 4.233 20 5 FIBDMO Cc1nn(-c2ccccc2C)c(C)c1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000065603854 1085659596 /nfs/dbraw/zinc/65/95/96/1085659596.db2.gz KBZKCYHAJYJTSH-UHFFFAOYSA-N 1 1 364.449 4.338 20 5 FIBDMO Cc1nn(-c2ccccc2C)c(C)c1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000065603854 1085659599 /nfs/dbraw/zinc/65/95/99/1085659599.db2.gz KBZKCYHAJYJTSH-UHFFFAOYSA-N 1 1 364.449 4.338 20 5 FIBDMO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000178654939 1085679332 /nfs/dbraw/zinc/67/93/32/1085679332.db2.gz AUWHDDGCRKYSTL-OAIAAZCPSA-N 1 1 365.477 4.441 20 5 FIBDMO COc1cccc([C@H]2C[C@H](C)C[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000612137845 1085783309 /nfs/dbraw/zinc/78/33/09/1085783309.db2.gz XQAMPDBIJMEVLT-SCLBCKFNSA-N 1 1 367.405 4.328 20 5 FIBDMO COc1cccc([C@H]2C[C@H](C)C[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000612137845 1085783314 /nfs/dbraw/zinc/78/33/14/1085783314.db2.gz XQAMPDBIJMEVLT-SCLBCKFNSA-N 1 1 367.405 4.328 20 5 FIBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1c1ccccc1 ZINC000582878290 1085869634 /nfs/dbraw/zinc/86/96/34/1085869634.db2.gz OTKHWMIMVJSMJG-OXQOHEQNSA-N 1 1 367.449 4.049 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(Br)s1 ZINC000178728798 1085966211 /nfs/dbraw/zinc/96/62/11/1085966211.db2.gz DTVGWLQVMRQXGI-SECBINFHSA-N 1 1 371.256 4.278 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccccc1OC(F)(F)F ZINC000178728458 1085966661 /nfs/dbraw/zinc/96/66/61/1085966661.db2.gz VZLBELPTTWAMSA-LLVKDONJSA-N 1 1 370.327 4.353 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2CCc2ccccc2)c2c(c1)COCO2 ZINC000052106016 1086206118 /nfs/dbraw/zinc/20/61/18/1086206118.db2.gz VOTVCVUJSFQRSS-IBGZPJMESA-N 1 1 368.433 4.059 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H](CCO)c2ccc(Cl)c(Cl)c2)cs1 ZINC000512178167 1086894111 /nfs/dbraw/zinc/89/41/11/1086894111.db2.gz IFTMFWGOPVJMJU-ZDUSSCGKSA-N 1 1 361.250 4.176 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@H](CC(F)(F)F)C3)o2)c1 ZINC000278564200 1087098510 /nfs/dbraw/zinc/09/85/10/1087098510.db2.gz BQGIICUCDMDCCN-GFCCVEGCSA-N 1 1 369.343 4.067 20 5 FIBDMO Cc1c([C@@H](C)[NH2+]Cc2c(F)cccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000090177318 1087410753 /nfs/dbraw/zinc/41/07/53/1087410753.db2.gz NUMPTOYDTGCIAH-LLVKDONJSA-N 1 1 354.328 4.495 20 5 FIBDMO C[C@@H](c1ccccc1Cl)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000409854750 1087611477 /nfs/dbraw/zinc/61/14/77/1087611477.db2.gz KTHWVXZRDOYRFC-ZDUSSCGKSA-N 1 1 361.829 4.270 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCc2c1c(Br)ccc2F ZINC000180414345 1087903819 /nfs/dbraw/zinc/90/38/19/1087903819.db2.gz WQSUWLLIFCJGAH-AWEZNQCLSA-N 1 1 365.202 4.274 20 5 FIBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1occc1C ZINC000412028769 1087961906 /nfs/dbraw/zinc/96/19/06/1087961906.db2.gz SOLIUVLTQPPORU-UHFFFAOYSA-N 1 1 355.394 4.216 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc([C@H]3CCC[N@@H+](Cc4ccccc4)C3)n2)c1 ZINC000504969837 1088016007 /nfs/dbraw/zinc/01/60/07/1088016007.db2.gz SKIBHDPTFZUNGD-KRWDZBQOSA-N 1 1 364.405 4.024 20 5 FIBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000181127318 1088254752 /nfs/dbraw/zinc/25/47/52/1088254752.db2.gz YNVQXNRUVSUVRL-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402697 1088643861 /nfs/dbraw/zinc/64/38/61/1088643861.db2.gz UCZSZLWUZPEMMY-HKUYNNGSSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402697 1088643878 /nfs/dbraw/zinc/64/38/78/1088643878.db2.gz UCZSZLWUZPEMMY-HKUYNNGSSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H]([NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402697 1088643886 /nfs/dbraw/zinc/64/38/86/1088643886.db2.gz UCZSZLWUZPEMMY-HKUYNNGSSA-N 1 1 353.466 4.158 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000414550357 1088822569 /nfs/dbraw/zinc/82/25/69/1088822569.db2.gz IUDPPKPYWQUGPR-HXUWFJFHSA-N 1 1 352.434 4.257 20 5 FIBDMO C[C@]12CC[N@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@H]1C2(F)F ZINC000430107239 1088994630 /nfs/dbraw/zinc/99/46/30/1088994630.db2.gz RNFOTFOWCMMWGM-ZBFHGGJFSA-N 1 1 365.405 4.195 20 5 FIBDMO C[C@]12CC[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@H]1C2(F)F ZINC000430107239 1088994635 /nfs/dbraw/zinc/99/46/35/1088994635.db2.gz RNFOTFOWCMMWGM-ZBFHGGJFSA-N 1 1 365.405 4.195 20 5 FIBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000434892613 1089099573 /nfs/dbraw/zinc/09/95/73/1089099573.db2.gz TUFWBPLJRIEKSB-CZUORRHYSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000434892613 1089099589 /nfs/dbraw/zinc/09/95/89/1089099589.db2.gz TUFWBPLJRIEKSB-CZUORRHYSA-N 1 1 373.840 4.065 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000549171149 1089110169 /nfs/dbraw/zinc/11/01/69/1089110169.db2.gz IKBWKZJFPYLZLK-OAHLLOKOSA-N 1 1 358.360 4.158 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000549171149 1089110177 /nfs/dbraw/zinc/11/01/77/1089110177.db2.gz IKBWKZJFPYLZLK-OAHLLOKOSA-N 1 1 358.360 4.158 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000434901352 1089118248 /nfs/dbraw/zinc/11/82/48/1089118248.db2.gz VDGKKKVSTCGSAF-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC[C@H](C4CCC4)C3)o2)cc1 ZINC000430126357 1089366264 /nfs/dbraw/zinc/36/62/64/1089366264.db2.gz NZRGYIBHBLHYAK-QGZVFWFLSA-N 1 1 356.422 4.103 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H](CN1CCCC1)c1ccccc1 ZINC000515072350 1089771843 /nfs/dbraw/zinc/77/18/43/1089771843.db2.gz JFNYBMXVMDLFFB-WOJBJXKFSA-N 1 1 351.450 4.009 20 5 FIBDMO CCC[N@@H+]1CC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236810994 1090174591 /nfs/dbraw/zinc/17/45/91/1090174591.db2.gz BGKGWZKBZYCYGA-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CCC[N@H+]1CC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236810994 1090174602 /nfs/dbraw/zinc/17/46/02/1090174602.db2.gz BGKGWZKBZYCYGA-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CCN(Cc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000110265483 1090369629 /nfs/dbraw/zinc/36/96/29/1090369629.db2.gz DUOCUOHNQXIJPK-MAUKXSAKSA-N 1 1 359.495 4.314 20 5 FIBDMO COc1ccc(OCC[N@@H+]2CC[C@@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000511613425 1090756108 /nfs/dbraw/zinc/75/61/08/1090756108.db2.gz XGZRJWWBXYOFAL-MRXNPFEDSA-N 1 1 362.813 4.083 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@@H]2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000511613425 1090756115 /nfs/dbraw/zinc/75/61/15/1090756115.db2.gz XGZRJWWBXYOFAL-MRXNPFEDSA-N 1 1 362.813 4.083 20 5 FIBDMO O=C(CC[N@@H+](C1CC1)[C@@H]1CCc2ccccc21)Nc1ccccc1[N+](=O)[O-] ZINC000500138434 1091064947 /nfs/dbraw/zinc/06/49/47/1091064947.db2.gz LNVZKKNBGIWVSN-LJQANCHMSA-N 1 1 365.433 4.075 20 5 FIBDMO CC(=O)c1ccc(N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000053580486 1091205803 /nfs/dbraw/zinc/20/58/03/1091205803.db2.gz XVYFNEZWRCHHDQ-KDOFPFPSSA-N 1 1 353.422 4.045 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000107657819 1091785705 /nfs/dbraw/zinc/78/57/05/1091785705.db2.gz URCZDPZBQYBLHH-WCQYABFASA-N 1 1 363.767 4.306 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@]3(CC=CCC3)C2)cccc1[N+](=O)[O-] ZINC000512213600 1091918290 /nfs/dbraw/zinc/91/82/90/1091918290.db2.gz ODHCDCKRBCFTSI-OXQOHEQNSA-N 1 1 357.454 4.053 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000512215537 1091920699 /nfs/dbraw/zinc/92/06/99/1091920699.db2.gz WVWUWBRYSVHDHX-OAHLLOKOSA-N 1 1 355.221 4.115 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512291428 1092014260 /nfs/dbraw/zinc/01/42/60/1092014260.db2.gz JJNUDTJRWOSJIY-HNNXBMFYSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512291428 1092014269 /nfs/dbraw/zinc/01/42/69/1092014269.db2.gz JJNUDTJRWOSJIY-HNNXBMFYSA-N 1 1 353.422 4.067 20 5 FIBDMO C[C@H]1C[C@@]1([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(Cl)cc1 ZINC000500463126 1092103856 /nfs/dbraw/zinc/10/38/56/1092103856.db2.gz NWTCPZXFBUMPBK-BUXKBTBVSA-N 1 1 374.824 4.140 20 5 FIBDMO Cc1ccc(Br)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000438921313 1092566383 /nfs/dbraw/zinc/56/63/83/1092566383.db2.gz UVAJZNYXTGJIAE-UHFFFAOYSA-N 1 1 353.191 4.095 20 5 FIBDMO CC[NH+](CC)[C@@H](CNCc1ccc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000544353642 1093169899 /nfs/dbraw/zinc/16/98/99/1093169899.db2.gz KJAPWMRVUXYNCG-INIZCTEOSA-N 1 1 351.834 4.014 20 5 FIBDMO CC1(C)C[C@H]([NH2+]Cc2cn3cc(Cl)ccc3n2)c2cc([N+](=O)[O-])ccc21 ZINC000433150539 1093332054 /nfs/dbraw/zinc/33/20/54/1093332054.db2.gz LUCUINMXAHDBKA-KRWDZBQOSA-N 1 1 370.840 4.408 20 5 FIBDMO CC(C)c1ccc(C(=O)N[C@@H](C)[C@@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000474173357 1093552797 /nfs/dbraw/zinc/55/27/97/1093552797.db2.gz UCGYAXDLNRGLDT-DOTOQJQBSA-N 1 1 373.497 4.101 20 5 FIBDMO CC(C)c1nc2n(n1)CCC[C@H]2[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433305513 1093560411 /nfs/dbraw/zinc/56/04/11/1093560411.db2.gz PRUAPRTWVFIBGB-SJORKVTESA-N 1 1 369.469 4.157 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccccc1)C(C)(C)C ZINC000474265657 1093630813 /nfs/dbraw/zinc/63/08/13/1093630813.db2.gz LEPGEVSVHDYBDO-UHFFFAOYSA-N 1 1 355.438 4.142 20 5 FIBDMO CC(C)[N@H+](Cc1ccccn1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000576294919 1093716728 /nfs/dbraw/zinc/71/67/28/1093716728.db2.gz QFIOJRRVBLDENL-UHFFFAOYSA-N 1 1 353.344 4.419 20 5 FIBDMO CC(C)[N@@H+](Cc1ccccn1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000576294919 1093716732 /nfs/dbraw/zinc/71/67/32/1093716732.db2.gz QFIOJRRVBLDENL-UHFFFAOYSA-N 1 1 353.344 4.419 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc(CNc2c(C)cc([N+](=O)[O-])cc2Cl)cn1 ZINC000302835544 1093761299 /nfs/dbraw/zinc/76/12/99/1093761299.db2.gz VOLJYCNQYBOCJO-UHFFFAOYSA-N 1 1 357.801 4.058 20 5 FIBDMO CC(=O)c1ccc(NCc2ccccc2C[N@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000052243835 1093777061 /nfs/dbraw/zinc/77/70/61/1093777061.db2.gz NCJOROUGVPZFMM-UHFFFAOYSA-N 1 1 355.438 4.250 20 5 FIBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000513129235 1093868658 /nfs/dbraw/zinc/86/86/58/1093868658.db2.gz WNSCAYJXYICMPV-QGZVFWFLSA-N 1 1 354.406 4.012 20 5 FIBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000513129235 1093868661 /nfs/dbraw/zinc/86/86/61/1093868661.db2.gz WNSCAYJXYICMPV-QGZVFWFLSA-N 1 1 354.406 4.012 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000182330009 1093883098 /nfs/dbraw/zinc/88/30/98/1093883098.db2.gz BBGNBPXTWFCUCY-KGLIPLIRSA-N 1 1 352.394 4.365 20 5 FIBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473512387 1093905569 /nfs/dbraw/zinc/90/55/69/1093905569.db2.gz HSSHTZPEROQQEL-IRXDYDNUSA-N 1 1 368.481 4.234 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Br)cc2Cl)cc1 ZINC000131426296 1094030722 /nfs/dbraw/zinc/03/07/22/1094030722.db2.gz HUTIOOVWGXATHD-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000513440872 1094127496 /nfs/dbraw/zinc/12/74/96/1094127496.db2.gz YLELTWYYFXKICZ-ZVVFDCPKSA-N 1 1 352.390 4.174 20 5 FIBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@H+]1CCc2sccc2C1 ZINC000025500280 1094326932 /nfs/dbraw/zinc/32/69/32/1094326932.db2.gz ODMIYKOQASMKFE-CYBMUJFWSA-N 1 1 368.462 4.063 20 5 FIBDMO COc1cc(C[NH2+][C@@H](CC(F)F)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000420990466 1095216520 /nfs/dbraw/zinc/21/65/20/1095216520.db2.gz FTRGVJUPPVQBAV-AWEZNQCLSA-N 1 1 354.328 4.229 20 5 FIBDMO CC(C)[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)c1ccsc1 ZINC000420997629 1095235255 /nfs/dbraw/zinc/23/52/55/1095235255.db2.gz ADKBITHCCUSMOM-ZDUSSCGKSA-N 1 1 362.451 4.494 20 5 FIBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)c1ccsc1 ZINC000420997629 1095235265 /nfs/dbraw/zinc/23/52/65/1095235265.db2.gz ADKBITHCCUSMOM-ZDUSSCGKSA-N 1 1 362.451 4.494 20 5 FIBDMO CC(C)C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCc2cccnc21 ZINC000127045695 1095410171 /nfs/dbraw/zinc/41/01/71/1095410171.db2.gz TUDFZYNYGFAYMT-WOJBJXKFSA-N 1 1 369.465 4.059 20 5 FIBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000444243278 1095902956 /nfs/dbraw/zinc/90/29/56/1095902956.db2.gz PSESOXOIVAKFOO-GOSISDBHSA-N 1 1 369.465 4.103 20 5 FIBDMO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502938419 1095981217 /nfs/dbraw/zinc/98/12/17/1095981217.db2.gz HQAQPSPWOFFEIT-INIZCTEOSA-N 1 1 355.438 4.224 20 5 FIBDMO Cc1c(C[NH2+]Cc2cccc(F)c2Br)cccc1[N+](=O)[O-] ZINC000231885940 1096126203 /nfs/dbraw/zinc/12/62/03/1096126203.db2.gz PHIGNBXSOPTVPJ-UHFFFAOYSA-N 1 1 353.191 4.095 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(OCC(F)F)cc2)c(Cl)c1 ZINC000183799955 1096196435 /nfs/dbraw/zinc/19/64/35/1096196435.db2.gz VZBALSAJMYEQIY-UHFFFAOYSA-N 1 1 356.756 4.182 20 5 FIBDMO COCC[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccco1 ZINC000503953335 1096611864 /nfs/dbraw/zinc/61/18/64/1096611864.db2.gz SYYIEIDGHJJNNT-INIZCTEOSA-N 1 1 356.378 4.315 20 5 FIBDMO C[N@@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000425459350 1098713013 /nfs/dbraw/zinc/71/30/13/1098713013.db2.gz PDMZUKKCSRWGNC-UHFFFAOYSA-N 1 1 363.202 4.367 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccccc1C ZINC000533243389 1098909693 /nfs/dbraw/zinc/90/96/93/1098909693.db2.gz CFEHUGCNKXSSKK-FQEVSTJZSA-N 1 1 367.449 4.377 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1OC ZINC000533250727 1098912266 /nfs/dbraw/zinc/91/22/66/1098912266.db2.gz KQYNCOFBIRZFRX-OAHLLOKOSA-N 1 1 371.437 4.015 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1OC ZINC000533250727 1098912269 /nfs/dbraw/zinc/91/22/69/1098912269.db2.gz KQYNCOFBIRZFRX-OAHLLOKOSA-N 1 1 371.437 4.015 20 5 FIBDMO CC(C)[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1cccc(F)c1 ZINC000533250475 1098912424 /nfs/dbraw/zinc/91/24/24/1098912424.db2.gz NAFCJTXXTMDUQE-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO CC(C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1cccc(F)c1 ZINC000533250475 1098912428 /nfs/dbraw/zinc/91/24/28/1098912428.db2.gz NAFCJTXXTMDUQE-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO CCN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000505790632 1098913655 /nfs/dbraw/zinc/91/36/55/1098913655.db2.gz ODYPRGROIRYNKV-FUHWJXTLSA-N 1 1 371.456 4.391 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H]3c3ccccn3)o2)c1 ZINC000533347899 1098968668 /nfs/dbraw/zinc/96/86/68/1098968668.db2.gz IINWOOPQDWQISO-SFHVURJKSA-N 1 1 364.405 4.024 20 5 FIBDMO Cn1c2ccccc2nc1[C@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000533387670 1099017417 /nfs/dbraw/zinc/01/74/17/1099017417.db2.gz KNSOLTPVZHAWNU-HXUWFJFHSA-N 1 1 364.449 4.251 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425556539 1099031813 /nfs/dbraw/zinc/03/18/13/1099031813.db2.gz UPPBKSLAGCSYFB-KRWDZBQOSA-N 1 1 350.846 4.029 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@H+](C)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000508672103 1099457372 /nfs/dbraw/zinc/45/73/72/1099457372.db2.gz UWAATRIVOIPGJH-UHFFFAOYSA-N 1 1 362.433 4.390 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000508672103 1099457380 /nfs/dbraw/zinc/45/73/80/1099457380.db2.gz UWAATRIVOIPGJH-UHFFFAOYSA-N 1 1 362.433 4.390 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCO2 ZINC000506098428 1100092470 /nfs/dbraw/zinc/09/24/70/1100092470.db2.gz CYNGKMDUASFBHE-CJISVDGZSA-N 1 1 366.417 4.216 20 5 FIBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000536658448 1100113548 /nfs/dbraw/zinc/11/35/48/1100113548.db2.gz AFJUUUKJYSLQQI-HNAYVOBHSA-N 1 1 357.454 4.017 20 5 FIBDMO CCN1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000536658448 1100113591 /nfs/dbraw/zinc/11/35/91/1100113591.db2.gz AFJUUUKJYSLQQI-HNAYVOBHSA-N 1 1 357.454 4.017 20 5 FIBDMO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000536658448 1100113596 /nfs/dbraw/zinc/11/35/96/1100113596.db2.gz AFJUUUKJYSLQQI-HNAYVOBHSA-N 1 1 357.454 4.017 20 5 FIBDMO CC[N@@H+](CCCO)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000536682286 1100167304 /nfs/dbraw/zinc/16/73/04/1100167304.db2.gz CEXCHTZJUCZERB-UHFFFAOYSA-N 1 1 364.829 4.245 20 5 FIBDMO COc1cc(C[N@@H+](C)C2CCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000536677596 1100169085 /nfs/dbraw/zinc/16/90/85/1100169085.db2.gz BLPPSMIHKGWJHT-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)s1 ZINC000536692324 1100188774 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1 1 357.454 4.159 20 5 FIBDMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]2CCCc2ccccc2)c1 ZINC001168153013 1101476375 /nfs/dbraw/zinc/47/63/75/1101476375.db2.gz DGHSRYKOCJYPJT-PZJWPPBQSA-N 1 1 354.450 4.116 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3c3ncc[nH]3)s2)cc1 ZINC000437977983 1101911292 /nfs/dbraw/zinc/91/12/92/1101911292.db2.gz LGYJHJRZDBQRIJ-MRXNPFEDSA-N 1 1 354.435 4.384 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3c3ncc[nH]3)s2)cc1 ZINC000437977983 1101911294 /nfs/dbraw/zinc/91/12/94/1101911294.db2.gz LGYJHJRZDBQRIJ-MRXNPFEDSA-N 1 1 354.435 4.384 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccccc1C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506791747 1102120153 /nfs/dbraw/zinc/12/01/53/1102120153.db2.gz ZWBKEPHLEFJNJR-UHFFFAOYSA-N 1 1 355.438 4.062 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506791747 1102120163 /nfs/dbraw/zinc/12/01/63/1102120163.db2.gz ZWBKEPHLEFJNJR-UHFFFAOYSA-N 1 1 355.438 4.062 20 5 FIBDMO CC[C@@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1nccs1 ZINC000080264541 1102307120 /nfs/dbraw/zinc/30/71/20/1102307120.db2.gz HZYJRHLUQJGLOK-LLVKDONJSA-N 1 1 356.245 4.055 20 5 FIBDMO COc1ccc(C[N@@H+](C)C2CCC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000537633178 1102329682 /nfs/dbraw/zinc/32/96/82/1102329682.db2.gz FFVKTYPOYQDBTH-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000532475468 1102418647 /nfs/dbraw/zinc/41/86/47/1102418647.db2.gz NZWNHUUYMGXZSK-HXUWFJFHSA-N 1 1 367.449 4.377 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](c3nc4c(s3)CCCC4)C2)cs1 ZINC000532639749 1102642636 /nfs/dbraw/zinc/64/26/36/1102642636.db2.gz IWEGHGQYWFZDLR-ZDUSSCGKSA-N 1 1 363.508 4.371 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3nc4c(s3)CCCC4)C2)cs1 ZINC000532639749 1102642643 /nfs/dbraw/zinc/64/26/43/1102642643.db2.gz IWEGHGQYWFZDLR-ZDUSSCGKSA-N 1 1 363.508 4.371 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000537649709 1102705079 /nfs/dbraw/zinc/70/50/79/1102705079.db2.gz XNKBXGVQESSSGS-SFHVURJKSA-N 1 1 370.449 4.032 20 5 FIBDMO COc1cc(C[NH2+][C@H](C)c2cccc(OC(F)F)c2)c([N+](=O)[O-])cc1F ZINC000184302165 1102805409 /nfs/dbraw/zinc/80/54/09/1102805409.db2.gz UZDZMIDIFSFZRH-SNVBAGLBSA-N 1 1 370.327 4.195 20 5 FIBDMO COc1cc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)c([N+](=O)[O-])cc1F ZINC000184310129 1102836892 /nfs/dbraw/zinc/83/68/92/1102836892.db2.gz YWAPSUOXLNEFMX-UHFFFAOYSA-N 1 1 354.328 4.046 20 5 FIBDMO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cc(Cl)ccc1Cl ZINC000426721869 1102940990 /nfs/dbraw/zinc/94/09/90/1102940990.db2.gz DPSUADJSZDBCCI-SNVBAGLBSA-N 1 1 368.220 4.191 20 5 FIBDMO COc1cc(C[NH+]2C3CCC2CC3)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000536633456 1103007487 /nfs/dbraw/zinc/00/74/87/1103007487.db2.gz ZOFJYXZOGDIZIA-UHFFFAOYSA-N 1 1 368.433 4.309 20 5 FIBDMO CCC[C@H](C)[N@@H+](C)Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000506994295 1103019022 /nfs/dbraw/zinc/01/90/22/1103019022.db2.gz FEWGGQJDVFCFNI-NSHDSACASA-N 1 1 364.364 4.165 20 5 FIBDMO CC(=O)c1ccc(N[C@@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000507003702 1103043330 /nfs/dbraw/zinc/04/33/30/1103043330.db2.gz XVYFNEZWRCHHDQ-KBXCAEBGSA-N 1 1 353.422 4.045 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cnc3ccc(Cl)cn23)C2CC2)c1 ZINC000507158203 1103158829 /nfs/dbraw/zinc/15/88/29/1103158829.db2.gz ZRRQXIVMJGXRGJ-UHFFFAOYSA-N 1 1 356.813 4.061 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cnc3ccc(Cl)cn23)C2CC2)c1 ZINC000507158203 1103158831 /nfs/dbraw/zinc/15/88/31/1103158831.db2.gz ZRRQXIVMJGXRGJ-UHFFFAOYSA-N 1 1 356.813 4.061 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1c[nH]nc1-c1ccccc1F)C1CC1 ZINC000507166088 1103165442 /nfs/dbraw/zinc/16/54/42/1103165442.db2.gz CEGLKFYICSSNDB-UHFFFAOYSA-N 1 1 366.396 4.289 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1c[nH]nc1-c1ccccc1F)C1CC1 ZINC000507166088 1103165449 /nfs/dbraw/zinc/16/54/49/1103165449.db2.gz CEGLKFYICSSNDB-UHFFFAOYSA-N 1 1 366.396 4.289 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cnc(-c3ccncc3)s2)C2CC2)c1 ZINC000507154053 1103171119 /nfs/dbraw/zinc/17/11/19/1103171119.db2.gz GWIGRUGDSOFMTA-UHFFFAOYSA-N 1 1 366.446 4.278 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cnc(-c3ccncc3)s2)C2CC2)c1 ZINC000507154053 1103171121 /nfs/dbraw/zinc/17/11/21/1103171121.db2.gz GWIGRUGDSOFMTA-UHFFFAOYSA-N 1 1 366.446 4.278 20 5 FIBDMO COCCOc1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507170979 1103189106 /nfs/dbraw/zinc/18/91/06/1103189106.db2.gz RIGMUTWCESBADA-UHFFFAOYSA-N 1 1 358.438 4.031 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cnc3ccc(Cl)cn23)C2CC2)cc1 ZINC000507169565 1103189732 /nfs/dbraw/zinc/18/97/32/1103189732.db2.gz WQPFKKOUWZFLGK-UHFFFAOYSA-N 1 1 356.813 4.061 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cnc3ccc(Cl)cn23)C2CC2)cc1 ZINC000507169565 1103189738 /nfs/dbraw/zinc/18/97/38/1103189738.db2.gz WQPFKKOUWZFLGK-UHFFFAOYSA-N 1 1 356.813 4.061 20 5 FIBDMO COCCOc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000507172613 1103191164 /nfs/dbraw/zinc/19/11/64/1103191164.db2.gz GATCXTGNINTUBF-UHFFFAOYSA-N 1 1 358.438 4.031 20 5 FIBDMO Cc1ccc([C@H](CC(=O)OC(C)C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000538269335 1104091635 /nfs/dbraw/zinc/09/16/35/1104091635.db2.gz VPCRLWAJSDLWDF-SFHVURJKSA-N 1 1 356.422 4.076 20 5 FIBDMO Cc1[nH+]cn(-c2ccc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)cc2)c1C ZINC000461104387 1104102698 /nfs/dbraw/zinc/10/26/98/1104102698.db2.gz AGFOMNJJPJEHIH-UHFFFAOYSA-N 1 1 351.366 4.041 20 5 FIBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000441463402 1104795256 /nfs/dbraw/zinc/79/52/56/1104795256.db2.gz FIULONBKFRERPN-MBNYWOFBSA-N 1 1 370.396 4.358 20 5 FIBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)c1ccc(F)cc1 ZINC000053087908 1104958102 /nfs/dbraw/zinc/95/81/02/1104958102.db2.gz CFZTUIGKLDILOR-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)c1ccc(F)cc1 ZINC000053087908 1104958103 /nfs/dbraw/zinc/95/81/03/1104958103.db2.gz CFZTUIGKLDILOR-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO CC(C)c1nnc([C@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000536495858 1105220969 /nfs/dbraw/zinc/22/09/69/1105220969.db2.gz CHWGLOJMRBOINK-LBPRGKRZSA-N 1 1 371.466 4.416 20 5 FIBDMO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000508016238 1105301089 /nfs/dbraw/zinc/30/10/89/1105301089.db2.gz OPJCUQNFZXVYFZ-NEPJUHHUSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@@H]1CO[C@@H](C)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000508016238 1105301095 /nfs/dbraw/zinc/30/10/95/1105301095.db2.gz OPJCUQNFZXVYFZ-NEPJUHHUSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544773 1107164503 /nfs/dbraw/zinc/16/45/03/1107164503.db2.gz FSUFXUXHDXSAMQ-UKRRQHHQSA-N 1 1 358.442 4.216 20 5 FIBDMO C[C@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544773 1107164510 /nfs/dbraw/zinc/16/45/10/1107164510.db2.gz FSUFXUXHDXSAMQ-UKRRQHHQSA-N 1 1 358.442 4.216 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nc(-c4ccccc4)no3)C2)cc1 ZINC000451569214 1107184673 /nfs/dbraw/zinc/18/46/73/1107184673.db2.gz OJOWWCNBSZJBCZ-QGZVFWFLSA-N 1 1 364.405 4.024 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc(-c4ccccc4)no3)C2)cc1 ZINC000451569214 1107184681 /nfs/dbraw/zinc/18/46/81/1107184681.db2.gz OJOWWCNBSZJBCZ-QGZVFWFLSA-N 1 1 364.405 4.024 20 5 FIBDMO Cn1c2ccc(Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])cc2[nH+]c1C1CC1 ZINC000301878745 1107194293 /nfs/dbraw/zinc/19/42/93/1107194293.db2.gz OLDVSHSOIBKMHG-UHFFFAOYSA-N 1 1 353.338 4.011 20 5 FIBDMO CCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1ccccc1OC ZINC000444610617 1108017831 /nfs/dbraw/zinc/01/78/31/1108017831.db2.gz OWTMDRPXLGCGBA-CQSZACIVSA-N 1 1 368.437 4.453 20 5 FIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)c1ccccc1OC ZINC000444610617 1108017844 /nfs/dbraw/zinc/01/78/44/1108017844.db2.gz OWTMDRPXLGCGBA-CQSZACIVSA-N 1 1 368.437 4.453 20 5 FIBDMO CCC[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(F)cc1F ZINC000444680460 1108083016 /nfs/dbraw/zinc/08/30/16/1108083016.db2.gz PHVLMDXLRHFBPX-HNNXBMFYSA-N 1 1 360.364 4.380 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000531702719 1108084626 /nfs/dbraw/zinc/08/46/26/1108084626.db2.gz OUUSFNKCRVEKOM-JENIJYKNSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000531702719 1108084640 /nfs/dbraw/zinc/08/46/40/1108084640.db2.gz OUUSFNKCRVEKOM-JENIJYKNSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1c(-c2noc([C@H]3CCC[N@@H+]3Cc3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000453255139 1108327840 /nfs/dbraw/zinc/32/78/40/1108327840.db2.gz LJVDXUVSYGONPN-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1c(-c2noc([C@H]3CCC[N@H+]3Cc3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000453255139 1108327851 /nfs/dbraw/zinc/32/78/51/1108327851.db2.gz LJVDXUVSYGONPN-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)C1=CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000453393827 1108522387 /nfs/dbraw/zinc/52/23/87/1108522387.db2.gz ILMDEZMNZCTWHP-GOSISDBHSA-N 1 1 354.454 4.144 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000525145235 1109277482 /nfs/dbraw/zinc/27/74/82/1109277482.db2.gz IJPCCKWJKDKKCW-INIZCTEOSA-N 1 1 367.449 4.387 20 5 FIBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000525271826 1109318959 /nfs/dbraw/zinc/31/89/59/1109318959.db2.gz WJIGIGNRWSNDMT-IBGZPJMESA-N 1 1 370.449 4.223 20 5 FIBDMO COc1ccc(C[N@H+]2CC[C@H](CSc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000525266900 1109324559 /nfs/dbraw/zinc/32/45/59/1109324559.db2.gz VOZCYENHYOAVNF-INIZCTEOSA-N 1 1 358.463 4.218 20 5 FIBDMO Cc1cnccc1OC1CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000447089556 1109433729 /nfs/dbraw/zinc/43/37/29/1109433729.db2.gz VRXFZVBBOZPBIV-UHFFFAOYSA-N 1 1 369.465 4.465 20 5 FIBDMO CCC[N@H+](Cc1ccc(F)cc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000508591093 1109486499 /nfs/dbraw/zinc/48/64/99/1109486499.db2.gz ZFWIWTDCSWJCNB-UHFFFAOYSA-N 1 1 360.385 4.013 20 5 FIBDMO CCC[N@@H+](Cc1ccc(F)cc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000508591093 1109486504 /nfs/dbraw/zinc/48/65/04/1109486504.db2.gz ZFWIWTDCSWJCNB-UHFFFAOYSA-N 1 1 360.385 4.013 20 5 FIBDMO COc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1 ZINC000525707228 1109487423 /nfs/dbraw/zinc/48/74/23/1109487423.db2.gz BALAAOSUJZHFQY-ACJLOTCBSA-N 1 1 361.467 4.160 20 5 FIBDMO CC[C@@H]([NH2+]Cc1ccn(-c2ccc(OC)cc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000121726030 1109522974 /nfs/dbraw/zinc/52/29/74/1109522974.db2.gz HPDDOBKICJZHDF-HXUWFJFHSA-N 1 1 366.421 4.030 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H](CN1CCCC1)c1ccccc1)CCC2 ZINC000447534036 1109570569 /nfs/dbraw/zinc/57/05/69/1109570569.db2.gz ZJVOOHDAIKQWEB-YADHBBJMSA-N 1 1 365.477 4.399 20 5 FIBDMO Cc1c(C[N@@H+](Cc2ccc(F)cc2)C2CCOCC2)cccc1[N+](=O)[O-] ZINC000429723370 1109606427 /nfs/dbraw/zinc/60/64/27/1109606427.db2.gz KJLRGGZTYIDUKF-UHFFFAOYSA-N 1 1 358.413 4.224 20 5 FIBDMO COc1cc(C[N@H+]2CCC2(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000538738054 1111271833 /nfs/dbraw/zinc/27/18/33/1111271833.db2.gz VBMLJMTZMGZSQD-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](COC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000539088873 1111426052 /nfs/dbraw/zinc/42/60/52/1111426052.db2.gz BTSLLDJGVSLLBD-DYVFJYSZSA-N 1 1 362.401 4.171 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)[C@@H](C)c1ccc(F)cc1 ZINC000552830248 1111818167 /nfs/dbraw/zinc/81/81/67/1111818167.db2.gz ZYIMXFQBZGEFSR-HNNXBMFYSA-N 1 1 373.428 4.454 20 5 FIBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000479396444 1112011928 /nfs/dbraw/zinc/01/19/28/1112011928.db2.gz PXIHMXZNIILVSF-HNNXBMFYSA-N 1 1 371.485 4.106 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000479511288 1112055296 /nfs/dbraw/zinc/05/52/96/1112055296.db2.gz IZIDBORLDLLQPR-MNOVXSKESA-N 1 1 350.216 4.164 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000480204257 1112330586 /nfs/dbraw/zinc/33/05/86/1112330586.db2.gz SSYLIEVEGLALSP-DZGCQCFKSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000480204257 1112330592 /nfs/dbraw/zinc/33/05/92/1112330592.db2.gz SSYLIEVEGLALSP-DZGCQCFKSA-N 1 1 373.840 4.065 20 5 FIBDMO CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000554887964 1112547618 /nfs/dbraw/zinc/54/76/18/1112547618.db2.gz NFDGPHLGBRHFPA-LJQANCHMSA-N 1 1 360.479 4.308 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccc(-n2cccn2)c(F)c1 ZINC000555619424 1112950765 /nfs/dbraw/zinc/95/07/65/1112950765.db2.gz NUWDNRNCFUYYIB-LBPRGKRZSA-N 1 1 374.803 4.424 20 5 FIBDMO C[C@@H](Nc1ccc([NH+]2CCCCC2)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000007003249 1113187958 /nfs/dbraw/zinc/18/79/58/1113187958.db2.gz AWULIRWTEHFXRP-OAHLLOKOSA-N 1 1 368.437 4.024 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000482697826 1113334705 /nfs/dbraw/zinc/33/47/05/1113334705.db2.gz WJYGMSIRVVESSF-LSDHHAIUSA-N 1 1 350.422 4.158 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000490029414 1114204864 /nfs/dbraw/zinc/20/48/64/1114204864.db2.gz JWNJZOWXUYFNEI-QUCCMNQESA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490029414 1114204876 /nfs/dbraw/zinc/20/48/76/1114204876.db2.gz JWNJZOWXUYFNEI-QUCCMNQESA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490029414 1114204878 /nfs/dbraw/zinc/20/48/78/1114204878.db2.gz JWNJZOWXUYFNEI-QUCCMNQESA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](CC(=O)Nc3c(C)cccc3[N+](=O)[O-])C2)cc1 ZINC000490039210 1114207018 /nfs/dbraw/zinc/20/70/18/1114207018.db2.gz JBTIZPKKAHKUIU-FUHWJXTLSA-N 1 1 367.449 4.028 20 5 FIBDMO COC[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490059076 1114212087 /nfs/dbraw/zinc/21/20/87/1114212087.db2.gz KNDSICSYIZOPRX-QGZVFWFLSA-N 1 1 364.829 4.076 20 5 FIBDMO COC[C@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490059076 1114212090 /nfs/dbraw/zinc/21/20/90/1114212090.db2.gz KNDSICSYIZOPRX-QGZVFWFLSA-N 1 1 364.829 4.076 20 5 FIBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490082818 1114216662 /nfs/dbraw/zinc/21/66/62/1114216662.db2.gz SZKFQDOAIUZMLB-KRWDZBQOSA-N 1 1 369.465 4.185 20 5 FIBDMO CC[C@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CCCC1 ZINC000490171809 1114229649 /nfs/dbraw/zinc/22/96/49/1114229649.db2.gz ILTLODXSYOQTJD-CTNGQTDRSA-N 1 1 353.466 4.148 20 5 FIBDMO COc1cc(C[N@@H+]([C@H](C)C2CC2)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000491116987 1114375825 /nfs/dbraw/zinc/37/58/25/1114375825.db2.gz WHTPLLHVSJICLM-LLVKDONJSA-N 1 1 370.396 4.010 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000165629319 1114855605 /nfs/dbraw/zinc/85/56/05/1114855605.db2.gz PUXPTQPTUVWKAY-IBGZPJMESA-N 1 1 371.412 4.208 20 5 FIBDMO COc1ccc(-c2ccc(C[NH+]3CC(CC(F)(F)F)C3)o2)c([N+](=O)[O-])c1 ZINC000590969244 1114998570 /nfs/dbraw/zinc/99/85/70/1114998570.db2.gz ZQWMTJMUNYZCHG-UHFFFAOYSA-N 1 1 370.327 4.248 20 5 FIBDMO Cc1cccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)c1 ZINC000592131260 1115205402 /nfs/dbraw/zinc/20/54/02/1115205402.db2.gz VGXKQYSMTNVJRY-MXVIHJGJSA-N 1 1 354.450 4.209 20 5 FIBDMO CC[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1csc(C)c1 ZINC000592186222 1115219887 /nfs/dbraw/zinc/21/98/87/1115219887.db2.gz AYEAKYFFFWMWSU-HNNXBMFYSA-N 1 1 358.423 4.256 20 5 FIBDMO C[C@@H]1CC2(C[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CCOCC2 ZINC000592185023 1115222037 /nfs/dbraw/zinc/22/20/37/1115222037.db2.gz UDNZNWRVIWYKLZ-GFCCVEGCSA-N 1 1 358.360 4.005 20 5 FIBDMO C[C@H]1CC2(C[N@H+]1Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)CCOCC2 ZINC000592529173 1115241231 /nfs/dbraw/zinc/24/12/31/1115241231.db2.gz YLMMOMZSHNPAOT-HNNXBMFYSA-N 1 1 356.422 4.246 20 5 FIBDMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000157742409 1115292581 /nfs/dbraw/zinc/29/25/81/1115292581.db2.gz HPRVIUVCIWWVPG-LLVKDONJSA-N 1 1 350.850 4.359 20 5 FIBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](c1ccccc1)[N@@H+]1CC[C@@H]2C[C@@H]21 ZINC000761078981 1115490766 /nfs/dbraw/zinc/49/07/66/1115490766.db2.gz APESQQFZWHKOLY-SKDZVZGDSA-N 1 1 371.824 4.022 20 5 FIBDMO O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](c1ccccc1)[N@H+]1CC[C@@H]2C[C@@H]21 ZINC000761078981 1115490768 /nfs/dbraw/zinc/49/07/68/1115490768.db2.gz APESQQFZWHKOLY-SKDZVZGDSA-N 1 1 371.824 4.022 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(F)c2OC(F)F)cc1[N+](=O)[O-] ZINC000594941862 1115501653 /nfs/dbraw/zinc/50/16/53/1115501653.db2.gz VKWXYIFTYHQBTK-LLVKDONJSA-N 1 1 354.328 4.495 20 5 FIBDMO COc1cc(C[NH2+]Cc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OC ZINC000594985944 1115505748 /nfs/dbraw/zinc/50/57/48/1115505748.db2.gz QKUZGBJKVNCMSB-UHFFFAOYSA-N 1 1 371.220 4.209 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(Br)s1 ZINC000595010529 1115508024 /nfs/dbraw/zinc/50/80/24/1115508024.db2.gz XNSLYIUHJICABG-SECBINFHSA-N 1 1 371.256 4.278 20 5 FIBDMO CCCC(=O)Nc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595009250 1115508177 /nfs/dbraw/zinc/50/81/77/1115508177.db2.gz GLDAZBFSBWMPRI-CQSZACIVSA-N 1 1 371.437 4.193 20 5 FIBDMO C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000595298054 1115521663 /nfs/dbraw/zinc/52/16/63/1115521663.db2.gz NTSLCQPKSSNVJN-YLJYHZDGSA-N 1 1 358.413 4.334 20 5 FIBDMO C[C@](CO)([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000595520061 1115539960 /nfs/dbraw/zinc/53/99/60/1115539960.db2.gz MGUVYVNKKDMOMA-MRXNPFEDSA-N 1 1 373.211 4.038 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595746525 1115561133 /nfs/dbraw/zinc/56/11/33/1115561133.db2.gz BIYDAIYRFRSDKV-XKGZKEIXSA-N 1 1 354.450 4.062 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C2CCC2)C1 ZINC000595838766 1115563771 /nfs/dbraw/zinc/56/37/71/1115563771.db2.gz WATDTMOTTAKMJM-CJNGLKHVSA-N 1 1 356.426 4.218 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000593126925 1115567338 /nfs/dbraw/zinc/56/73/38/1115567338.db2.gz YENGQHCWIJKMPR-UFYCRDLUSA-N 1 1 368.433 4.098 20 5 FIBDMO Cc1cc([N@H+]2CCCC[C@H]2C)ccc1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596161184 1115577787 /nfs/dbraw/zinc/57/77/87/1115577787.db2.gz FCIAUPQPUVVRRA-CQSZACIVSA-N 1 1 368.437 4.125 20 5 FIBDMO Cc1cc([N@@H+]2CCCC[C@H]2C)ccc1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596161184 1115577791 /nfs/dbraw/zinc/57/77/91/1115577791.db2.gz FCIAUPQPUVVRRA-CQSZACIVSA-N 1 1 368.437 4.125 20 5 FIBDMO Cc1cc([NH+]2CCCCCC2)ccc1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596229715 1115579626 /nfs/dbraw/zinc/57/96/26/1115579626.db2.gz DTYYRFKIATYVAW-UHFFFAOYSA-N 1 1 368.437 4.126 20 5 FIBDMO Cc1cc(CNc2ccnc3cc([N+](=O)[O-])ccc32)cc(N2CCCC2)[nH+]1 ZINC000593473908 1115691410 /nfs/dbraw/zinc/69/14/10/1115691410.db2.gz VUCMOSRWQYVUAS-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO COc1ccccc1[C@@H]1CCC[N@@H+]1Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761289939 1115755782 /nfs/dbraw/zinc/75/57/82/1115755782.db2.gz INEKDBOHECHPOR-SFHVURJKSA-N 1 1 366.421 4.056 20 5 FIBDMO COc1ccccc1[C@@H]1CCC[N@H+]1Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761289939 1115755784 /nfs/dbraw/zinc/75/57/84/1115755784.db2.gz INEKDBOHECHPOR-SFHVURJKSA-N 1 1 366.421 4.056 20 5 FIBDMO CCOc1cc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(F)cc1OC ZINC000598964346 1115771951 /nfs/dbraw/zinc/77/19/51/1115771951.db2.gz GHEQSGXMMQJZPC-CYBMUJFWSA-N 1 1 362.401 4.300 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1nc2ccccc2n1C(F)F ZINC000603421438 1115772352 /nfs/dbraw/zinc/77/23/52/1115772352.db2.gz DOCKGOBPXGMYLP-GFCCVEGCSA-N 1 1 360.364 4.499 20 5 FIBDMO CC(C)O[C@H]1CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000593660832 1115775971 /nfs/dbraw/zinc/77/59/71/1115775971.db2.gz SKXYWJPWRGQXNY-KRWDZBQOSA-N 1 1 361.467 4.108 20 5 FIBDMO CC(C)O[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000593660832 1115775975 /nfs/dbraw/zinc/77/59/75/1115775975.db2.gz SKXYWJPWRGQXNY-KRWDZBQOSA-N 1 1 361.467 4.108 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cc(-c2ccccc2)n(C)n1 ZINC000599024997 1115778002 /nfs/dbraw/zinc/77/80/02/1115778002.db2.gz WDPPDISUHJVAFJ-GJZGRUSLSA-N 1 1 350.422 4.407 20 5 FIBDMO Cc1c(C[NH2+][C@@H](C)c2cc(-c3ccccc3)n(C)n2)cccc1[N+](=O)[O-] ZINC000599043852 1115780154 /nfs/dbraw/zinc/78/01/54/1115780154.db2.gz NCJSJIRZBGTELJ-HNNXBMFYSA-N 1 1 350.422 4.155 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](Cc1ccccc1)c1nccn1C ZINC000593723251 1115805149 /nfs/dbraw/zinc/80/51/49/1115805149.db2.gz UNNBXVPPWVKKOL-JXFKEZNVSA-N 1 1 364.449 4.271 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccnc2C(F)(F)F)C2CC2)c1 ZINC000599312464 1115805952 /nfs/dbraw/zinc/80/59/52/1115805952.db2.gz UICHRTYGPOAADD-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccnc2C(F)(F)F)C2CC2)c1 ZINC000599312464 1115805953 /nfs/dbraw/zinc/80/59/53/1115805953.db2.gz UICHRTYGPOAADD-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000603838680 1115818105 /nfs/dbraw/zinc/81/81/05/1115818105.db2.gz BFBPTYXDICRODY-GOSISDBHSA-N 1 1 356.422 4.339 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000603839053 1115818615 /nfs/dbraw/zinc/81/86/15/1115818615.db2.gz KJJDJGKWRDOPDO-IBGZPJMESA-N 1 1 356.422 4.258 20 5 FIBDMO CC1CC[NH+]([C@H](CNCc2cccc([N+](=O)[O-])c2)c2ccccc2)CC1 ZINC000604282931 1115861443 /nfs/dbraw/zinc/86/14/43/1115861443.db2.gz PBSDGUOCBVMBKD-OAQYLSRUSA-N 1 1 353.466 4.158 20 5 FIBDMO Cc1c(C[N@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000604276803 1115861478 /nfs/dbraw/zinc/86/14/78/1115861478.db2.gz UVDMOIGQLMMIJS-TXEJJXNPSA-N 1 1 370.293 4.466 20 5 FIBDMO Cc1c(C[N@@H+]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000604276803 1115861483 /nfs/dbraw/zinc/86/14/83/1115861483.db2.gz UVDMOIGQLMMIJS-TXEJJXNPSA-N 1 1 370.293 4.466 20 5 FIBDMO Cc1c(C[N@H+](C)Cc2ccc(Br)cc2F)cccc1[N+](=O)[O-] ZINC000604438940 1115865741 /nfs/dbraw/zinc/86/57/41/1115865741.db2.gz HYHPFLYKODDZNC-UHFFFAOYSA-N 1 1 367.218 4.437 20 5 FIBDMO Cc1c(C[N@@H+](C)Cc2ccc(Br)cc2F)cccc1[N+](=O)[O-] ZINC000604438940 1115865742 /nfs/dbraw/zinc/86/57/42/1115865742.db2.gz HYHPFLYKODDZNC-UHFFFAOYSA-N 1 1 367.218 4.437 20 5 FIBDMO CCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1ccccc1F ZINC000604493441 1115867809 /nfs/dbraw/zinc/86/78/09/1115867809.db2.gz YXKKDDQILJIMMO-UHFFFAOYSA-N 1 1 373.428 4.283 20 5 FIBDMO CCc1csc(CC2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)n1 ZINC000594019050 1115961968 /nfs/dbraw/zinc/96/19/68/1115961968.db2.gz DPVXMJDUWJTUNJ-UHFFFAOYSA-N 1 1 351.497 4.130 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(OC(C)(C)C)cc1 ZINC000608782030 1116128451 /nfs/dbraw/zinc/12/84/51/1116128451.db2.gz HOOHTXPHBBOTMI-UHFFFAOYSA-N 1 1 358.438 4.461 20 5 FIBDMO CN(C)C1(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCCCC1 ZINC000608835475 1116130976 /nfs/dbraw/zinc/13/09/76/1116130976.db2.gz KYVCRXILUGIMSH-UHFFFAOYSA-N 1 1 357.454 4.209 20 5 FIBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836909 1116131285 /nfs/dbraw/zinc/13/12/85/1116131285.db2.gz YIYBXRFQESDIMK-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CN1CCC[C@@H](C)C1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836909 1116131287 /nfs/dbraw/zinc/13/12/87/1116131287.db2.gz YIYBXRFQESDIMK-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)c2C1 ZINC000608968865 1116138726 /nfs/dbraw/zinc/13/87/26/1116138726.db2.gz XGHKZFDTVNCICI-UHFFFAOYSA-N 1 1 364.405 4.054 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)c2C1 ZINC000608968865 1116138727 /nfs/dbraw/zinc/13/87/27/1116138727.db2.gz XGHKZFDTVNCICI-UHFFFAOYSA-N 1 1 364.405 4.054 20 5 FIBDMO O=[N+]([O-])c1cc(CN2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)cs1 ZINC000534963864 1116258221 /nfs/dbraw/zinc/25/82/21/1116258221.db2.gz PPXYWVAACFIWJZ-UHFFFAOYSA-N 1 1 371.506 4.144 20 5 FIBDMO CCC[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C[C@@H]1CCCCO1 ZINC000089912260 1116351840 /nfs/dbraw/zinc/35/18/40/1116351840.db2.gz YZYIRMVOOMYVJF-SFHVURJKSA-N 1 1 359.426 4.031 20 5 FIBDMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089910130 1116351969 /nfs/dbraw/zinc/35/19/69/1116351969.db2.gz GDTJWQBWVOVCQQ-AWEZNQCLSA-N 1 1 367.405 4.018 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCS[C@@H]4CCCC[C@@H]43)co2)cc1 ZINC000089909230 1116352287 /nfs/dbraw/zinc/35/22/87/1116352287.db2.gz AKORIOXFAPTPML-DLBZAZTESA-N 1 1 359.451 4.110 20 5 FIBDMO COc1cc(NCc2ccccc2C[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000462786497 1117771150 /nfs/dbraw/zinc/77/11/50/1117771150.db2.gz YMEOAPGASKONOI-MRXNPFEDSA-N 1 1 369.465 4.447 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000463486906 1118179405 /nfs/dbraw/zinc/17/94/05/1118179405.db2.gz NCHDTZJCZOFLRY-KRWDZBQOSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(OC)c(F)cc2[N+](=O)[O-])cc1 ZINC000463486906 1118179409 /nfs/dbraw/zinc/17/94/09/1118179409.db2.gz NCHDTZJCZOFLRY-KRWDZBQOSA-N 1 1 360.385 4.088 20 5 FIBDMO Cc1cccc([C@@H]2CCCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1C ZINC000464771302 1118681298 /nfs/dbraw/zinc/68/12/98/1118681298.db2.gz CZGZJRCPXSUQJK-IBGZPJMESA-N 1 1 367.449 4.038 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](CSc3ccccc3)C2)cc1 ZINC000464762045 1118684191 /nfs/dbraw/zinc/68/41/91/1118684191.db2.gz ICZDEOLPKNFHMV-MRXNPFEDSA-N 1 1 358.463 4.088 20 5 FIBDMO C[C@@H](c1ccc(F)c(F)c1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000464783189 1118692860 /nfs/dbraw/zinc/69/28/60/1118692860.db2.gz HLEJNTJWVDULOL-ZDUSSCGKSA-N 1 1 362.376 4.477 20 5 FIBDMO CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464836322 1118710233 /nfs/dbraw/zinc/71/02/33/1118710233.db2.gz KFFMYBPLEOMWIX-QGZVFWFLSA-N 1 1 373.884 4.202 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@H](C)C[C@H]2c2ccc(C)o2)c([N+](=O)[O-])c1 ZINC000464841789 1118717734 /nfs/dbraw/zinc/71/77/34/1118717734.db2.gz XZHYATMQYGIAAY-YOEHRIQHSA-N 1 1 374.437 4.357 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@H]1Cn1cnc2ccccc21 ZINC000491841757 1118986483 /nfs/dbraw/zinc/98/64/83/1118986483.db2.gz CAXYKABYTZPEBP-AWEZNQCLSA-N 1 1 370.840 4.263 20 5 FIBDMO CC(C)c1ccc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000030959016 1119198195 /nfs/dbraw/zinc/19/81/95/1119198195.db2.gz DYSIXASJKJJVCJ-UHFFFAOYSA-N 1 1 355.438 4.179 20 5 FIBDMO C[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C[N@@H+]1Cc1ccccc1 ZINC000761526505 1119409915 /nfs/dbraw/zinc/40/99/15/1119409915.db2.gz FDENJPUGQSEMJT-YOEHRIQHSA-N 1 1 359.857 4.001 20 5 FIBDMO C[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C[N@H+]1Cc1ccccc1 ZINC000761526505 1119409916 /nfs/dbraw/zinc/40/99/16/1119409916.db2.gz FDENJPUGQSEMJT-YOEHRIQHSA-N 1 1 359.857 4.001 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526566 1119410023 /nfs/dbraw/zinc/41/00/23/1119410023.db2.gz OWFKQDGSUPXMCJ-DNVCBOLYSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526566 1119410027 /nfs/dbraw/zinc/41/00/27/1119410027.db2.gz OWFKQDGSUPXMCJ-DNVCBOLYSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000487739873 1119528135 /nfs/dbraw/zinc/52/81/35/1119528135.db2.gz NGKTWONDUXUHEI-CQSZACIVSA-N 1 1 368.462 4.088 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494292844 1119822723 /nfs/dbraw/zinc/82/27/23/1119822723.db2.gz JWUPQYGASIGIEU-REZBVGGZSA-N 1 1 367.449 4.266 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494292844 1119822730 /nfs/dbraw/zinc/82/27/30/1119822730.db2.gz JWUPQYGASIGIEU-REZBVGGZSA-N 1 1 367.449 4.266 20 5 FIBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cccc(F)c1 ZINC000609193583 1119841024 /nfs/dbraw/zinc/84/10/24/1119841024.db2.gz OHWMESIIOZCPJE-UHFFFAOYSA-N 1 1 369.396 4.454 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccc(F)cc1F ZINC000609193380 1119841251 /nfs/dbraw/zinc/84/12/51/1119841251.db2.gz DPTQNXFKCMTJPU-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO CCCCCC[N@H+](C)Cc1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000762307050 1120862283 /nfs/dbraw/zinc/86/22/83/1120862283.db2.gz DASROYPAAWRSPA-UHFFFAOYSA-N 1 1 371.441 4.062 20 5 FIBDMO CCCCCC[N@@H+](C)Cc1nc(Cc2c[nH]c3ccc([N+](=O)[O-])cc23)no1 ZINC000762307050 1120862290 /nfs/dbraw/zinc/86/22/90/1120862290.db2.gz DASROYPAAWRSPA-UHFFFAOYSA-N 1 1 371.441 4.062 20 5 FIBDMO Cc1nn(-c2ccc(Cl)cc2)c(C)c1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000237724064 1120982534 /nfs/dbraw/zinc/98/25/34/1120982534.db2.gz UYBRDRGQVNMQBF-UHFFFAOYSA-N 1 1 370.840 4.341 20 5 FIBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)c1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000272492203 1121095344 /nfs/dbraw/zinc/09/53/44/1121095344.db2.gz FDOMOLACAVKADC-KRWDZBQOSA-N 1 1 370.478 4.047 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)[C@H](C)c1ccc(F)cc1 ZINC000552830249 1121297299 /nfs/dbraw/zinc/29/72/99/1121297299.db2.gz ZYIMXFQBZGEFSR-OAHLLOKOSA-N 1 1 373.428 4.454 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2ccco2)C[C@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000153775093 1121344945 /nfs/dbraw/zinc/34/49/45/1121344945.db2.gz UEMQTKXZIQUCJT-IBGZPJMESA-N 1 1 372.446 4.294 20 5 FIBDMO Cc1ccc(C[N@H+](Cc2ccco2)C[C@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000153775093 1121344953 /nfs/dbraw/zinc/34/49/53/1121344953.db2.gz UEMQTKXZIQUCJT-IBGZPJMESA-N 1 1 372.446 4.294 20 5 FIBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2c3ccccc3ncc2[N+](=O)[O-])C1 ZINC000488076394 1121408845 /nfs/dbraw/zinc/40/88/45/1121408845.db2.gz MXWSYTOVEQVWRQ-DLBZAZTESA-N 1 1 368.481 4.234 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cnc(-c3ccccn3)s2)C2CC2)cc1 ZINC000154274442 1122095107 /nfs/dbraw/zinc/09/51/07/1122095107.db2.gz RUOLGYPRAJDNJV-UHFFFAOYSA-N 1 1 366.446 4.278 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cnc(-c3ccccn3)s2)C2CC2)cc1 ZINC000154274442 1122095115 /nfs/dbraw/zinc/09/51/15/1122095115.db2.gz RUOLGYPRAJDNJV-UHFFFAOYSA-N 1 1 366.446 4.278 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1c[nH]nc1-c1cccs1)C1CC1 ZINC000154305666 1122212411 /nfs/dbraw/zinc/21/24/11/1122212411.db2.gz AMDPFRUURJTRCK-UHFFFAOYSA-N 1 1 354.435 4.211 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1c[nH]nc1-c1cccs1)C1CC1 ZINC000154305666 1122212416 /nfs/dbraw/zinc/21/24/16/1122212416.db2.gz AMDPFRUURJTRCK-UHFFFAOYSA-N 1 1 354.435 4.211 20 5 FIBDMO C[C@@H](C1CC1)[N@H+](Cc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917436407 1122303395 /nfs/dbraw/zinc/30/33/95/1122303395.db2.gz CHKKEBYDNZVNSQ-HNNXBMFYSA-N 1 1 350.422 4.203 20 5 FIBDMO CC[N@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000194702126 1122733929 /nfs/dbraw/zinc/73/39/29/1122733929.db2.gz GFABPDZBQMYLLP-NSHDSACASA-N 1 1 367.858 4.159 20 5 FIBDMO CC[N@@H+](Cc1cccs1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000194702126 1122733931 /nfs/dbraw/zinc/73/39/31/1122733931.db2.gz GFABPDZBQMYLLP-NSHDSACASA-N 1 1 367.858 4.159 20 5 FIBDMO Cn1ccc(C[NH2+]Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n1 ZINC000498377374 1122759977 /nfs/dbraw/zinc/75/99/77/1122759977.db2.gz ZLAKTEODTMTIJA-UHFFFAOYSA-N 1 1 372.812 4.064 20 5 FIBDMO CC(C)[N@H+](CC(=O)Nc1ccccc1Cl)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350562 1123705906 /nfs/dbraw/zinc/70/59/06/1123705906.db2.gz YDVYJPAUNMCNHY-UHFFFAOYSA-N 1 1 361.829 4.097 20 5 FIBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1Cl)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350562 1123705908 /nfs/dbraw/zinc/70/59/08/1123705908.db2.gz YDVYJPAUNMCNHY-UHFFFAOYSA-N 1 1 361.829 4.097 20 5 FIBDMO CC(C)[N@H+](CC(=O)Nc1cccc(Cl)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350509 1123706307 /nfs/dbraw/zinc/70/63/07/1123706307.db2.gz WVGSYXJBYBODRN-UHFFFAOYSA-N 1 1 361.829 4.097 20 5 FIBDMO CC(C)[N@@H+](CC(=O)Nc1cccc(Cl)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350509 1123706310 /nfs/dbraw/zinc/70/63/10/1123706310.db2.gz WVGSYXJBYBODRN-UHFFFAOYSA-N 1 1 361.829 4.097 20 5 FIBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000609600772 1123764907 /nfs/dbraw/zinc/76/49/07/1123764907.db2.gz QWUUFEJQRNSMOY-GASCZTMLSA-N 1 1 374.510 4.071 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)c2C1 ZINC000609857871 1123862244 /nfs/dbraw/zinc/86/22/44/1123862244.db2.gz STRGYIJBZTXLSB-UHFFFAOYSA-N 1 1 359.813 4.226 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3)c2C1 ZINC000609857871 1123862247 /nfs/dbraw/zinc/86/22/47/1123862247.db2.gz STRGYIJBZTXLSB-UHFFFAOYSA-N 1 1 359.813 4.226 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+]Cc2ncc[nH]2)cc1 ZINC000610150874 1123946476 /nfs/dbraw/zinc/94/64/76/1123946476.db2.gz CWHMPQZIQAWWCB-UHFFFAOYSA-N 1 1 358.785 4.053 20 5 FIBDMO Cn1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(-c2ccccc2)n1 ZINC000179694816 1124032787 /nfs/dbraw/zinc/03/27/87/1124032787.db2.gz WNLZTNKSZPCATF-UHFFFAOYSA-N 1 1 362.433 4.160 20 5 FIBDMO CC(=O)Nc1cccc2c1CC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C2 ZINC000615836111 1124128276 /nfs/dbraw/zinc/12/82/76/1124128276.db2.gz VOARVWIMSPMRLS-PTNGSMBKSA-N 1 1 365.433 4.015 20 5 FIBDMO CO[C@]1(C(F)(F)F)CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000615842165 1124134641 /nfs/dbraw/zinc/13/46/41/1124134641.db2.gz FEGMVQOEJMOUPX-LRFDDAOPSA-N 1 1 358.360 4.041 20 5 FIBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273515511 1124188759 /nfs/dbraw/zinc/18/87/59/1124188759.db2.gz PEBMNOMFBMILEL-HZPDHXFCSA-N 1 1 350.415 4.148 20 5 FIBDMO COc1cc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1C ZINC000113329483 1125151805 /nfs/dbraw/zinc/15/18/05/1125151805.db2.gz MIENXKFTNGALRL-UHFFFAOYSA-N 1 1 369.446 4.325 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000181921029 1125184762 /nfs/dbraw/zinc/18/47/62/1125184762.db2.gz IXVALTOOLZIFCJ-NSHDSACASA-N 1 1 365.227 4.217 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000301750336 1125208980 /nfs/dbraw/zinc/20/89/80/1125208980.db2.gz UJPFVKKKRCNMDE-LBPRGKRZSA-N 1 1 366.874 4.029 20 5 FIBDMO O=[N+]([O-])c1cccc2c(NC[C@@H]3CC[N@@H+](Cc4ccccc4)C3)ccnc21 ZINC000312697203 1125453812 /nfs/dbraw/zinc/45/38/12/1125453812.db2.gz RDDXIHDLYNNGBE-KRWDZBQOSA-N 1 1 362.433 4.077 20 5 FIBDMO Cc1ccc(C(=O)C2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000054317702 211927303 /nfs/dbraw/zinc/92/73/03/211927303.db2.gz LPBOQONKRRDMBU-UHFFFAOYSA-N 1 1 352.434 4.307 20 5 FIBDMO Cc1c(C[NH2+]Cc2cc(F)ccc2Br)cccc1[N+](=O)[O-] ZINC000038039262 211365381 /nfs/dbraw/zinc/36/53/81/211365381.db2.gz JFVSBSHSYJFBGS-UHFFFAOYSA-N 1 1 353.191 4.095 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@H]3c3ccccc3)n2)cc1 ZINC000568576685 568058557 /nfs/dbraw/zinc/05/85/57/568058557.db2.gz RUAATJIIYYJMIH-SFHVURJKSA-N 1 1 364.405 4.372 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@H]3c3ccccc3)n2)cc1 ZINC000568576685 568058558 /nfs/dbraw/zinc/05/85/58/568058558.db2.gz RUAATJIIYYJMIH-SFHVURJKSA-N 1 1 364.405 4.372 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481696852 568092041 /nfs/dbraw/zinc/09/20/41/568092041.db2.gz VZNFHZDGPLAPRV-NRFANRHFSA-N 1 1 368.433 4.015 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481696852 568092042 /nfs/dbraw/zinc/09/20/42/568092042.db2.gz VZNFHZDGPLAPRV-NRFANRHFSA-N 1 1 368.433 4.015 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481715109 568094108 /nfs/dbraw/zinc/09/41/08/568094108.db2.gz WRFMFPATUWFOEK-KKSFZXQISA-N 1 1 352.434 4.486 20 5 FIBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000569072543 568270518 /nfs/dbraw/zinc/27/05/18/568270518.db2.gz CARPSGBYEOJLFO-QGZVFWFLSA-N 1 1 369.465 4.103 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ncc(-c2ccccc2)n1C ZINC000453080012 568389433 /nfs/dbraw/zinc/38/94/33/568389433.db2.gz YONLSXPMWVPLPZ-GJZGRUSLSA-N 1 1 350.422 4.407 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H](n3cc(Cl)cn3)C2)o1 ZINC000569894946 568434606 /nfs/dbraw/zinc/43/46/06/568434606.db2.gz HJORACAPZZWCJO-AWEZNQCLSA-N 1 1 372.812 4.152 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)o1 ZINC000569894946 568434608 /nfs/dbraw/zinc/43/46/08/568434608.db2.gz HJORACAPZZWCJO-AWEZNQCLSA-N 1 1 372.812 4.152 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](C(F)(F)F)C4(CCC4)C3)nc2c1 ZINC000570178454 568459424 /nfs/dbraw/zinc/45/94/24/568459424.db2.gz GCUFLWDEYNZZOW-CQSZACIVSA-N 1 1 369.343 4.291 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](C(F)(F)F)C4(CCC4)C3)nc2c1 ZINC000570178454 568459425 /nfs/dbraw/zinc/45/94/25/568459425.db2.gz GCUFLWDEYNZZOW-CQSZACIVSA-N 1 1 369.343 4.291 20 5 FIBDMO Cn1ccnc1[C@H]([NH2+]CCCCC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000570189382 568460182 /nfs/dbraw/zinc/46/01/82/568460182.db2.gz PFNAWDNCCGQYPK-LJQANCHMSA-N 1 1 356.470 4.368 20 5 FIBDMO COc1ccc(C(=O)C2CC[NH+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000014327145 1079714804 /nfs/dbraw/zinc/71/48/04/1079714804.db2.gz GJQHZJPLMSBXBP-OAHLLOKOSA-N 1 1 368.433 4.259 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(c4ccsc4)CC3)n2)cc1 ZINC000186947240 1079749443 /nfs/dbraw/zinc/74/94/43/1079749443.db2.gz HGVHPWNKTLIYCP-UHFFFAOYSA-N 1 1 370.434 4.086 20 5 FIBDMO CSC[C@@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000430200792 1079916911 /nfs/dbraw/zinc/91/69/11/1079916911.db2.gz XLDGQQWGOGVVHB-CYBMUJFWSA-N 1 1 363.508 4.293 20 5 FIBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836910 1079969724 /nfs/dbraw/zinc/96/97/24/1079969724.db2.gz YIYBXRFQESDIMK-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CN1CCC[C@H](C)C1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836910 1079969728 /nfs/dbraw/zinc/96/97/28/1079969728.db2.gz YIYBXRFQESDIMK-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO COc1ccc(C[C@@H]2CCC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1 ZINC000610215679 1079984657 /nfs/dbraw/zinc/98/46/57/1079984657.db2.gz UVEOKJLQMROOFV-INIZCTEOSA-N 1 1 358.413 4.197 20 5 FIBDMO CCCOc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000430226535 1080024275 /nfs/dbraw/zinc/02/42/75/1080024275.db2.gz NGGJWAUXUJZLSL-AWEZNQCLSA-N 1 1 374.437 4.252 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCN(c2ccc3ccccc3n2)CC1 ZINC000471199567 1080243647 /nfs/dbraw/zinc/24/36/47/1080243647.db2.gz QAXQYCYUYVIJDK-MRXNPFEDSA-N 1 1 362.433 4.026 20 5 FIBDMO Cc1cccc(C[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC(C)C)c1 ZINC001167199030 1080829465 /nfs/dbraw/zinc/82/94/65/1080829465.db2.gz CYFUDZQPPFTUNO-UHFFFAOYSA-N 1 1 369.465 4.308 20 5 FIBDMO CC[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(OC)c(OC)c1 ZINC000510257353 1080932376 /nfs/dbraw/zinc/93/23/76/1080932376.db2.gz QDFTUPWSUYNJQU-MRXNPFEDSA-N 1 1 366.364 4.131 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000255073946 1081097229 /nfs/dbraw/zinc/09/72/29/1081097229.db2.gz HFLNQNALOWIKEZ-YTFAOPSNSA-N 1 1 358.463 4.258 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCCC4(CCOCC4)C3)o2)c1 ZINC000560543428 1081427280 /nfs/dbraw/zinc/42/72/80/1081427280.db2.gz GMAXZBXFOQKNIG-UHFFFAOYSA-N 1 1 356.422 4.247 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H](Cc3ccccc3)C2)cc1 ZINC001167333538 1081456047 /nfs/dbraw/zinc/45/60/47/1081456047.db2.gz XNBNWSPBNBWETA-IBGZPJMESA-N 1 1 354.450 4.318 20 5 FIBDMO CC[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001167376287 1081812252 /nfs/dbraw/zinc/81/22/52/1081812252.db2.gz IBWRHGDLDZJIHD-STQMWFEESA-N 1 1 353.850 4.087 20 5 FIBDMO CC[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001167376287 1081812259 /nfs/dbraw/zinc/81/22/59/1081812259.db2.gz IBWRHGDLDZJIHD-STQMWFEESA-N 1 1 353.850 4.087 20 5 FIBDMO Cc1c(CN[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000379652726 1081842986 /nfs/dbraw/zinc/84/29/86/1081842986.db2.gz XUNUPXPIQXZDGJ-OXJNMPFZSA-N 1 1 353.466 4.046 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2F)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582441 1082573931 /nfs/dbraw/zinc/57/39/31/1082573931.db2.gz HXOIGVKTJSVRTE-YVEFUNNKSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582441 1082573935 /nfs/dbraw/zinc/57/39/35/1082573935.db2.gz HXOIGVKTJSVRTE-YVEFUNNKSA-N 1 1 355.369 4.458 20 5 FIBDMO Cc1ccc(C[C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610581803 1082578203 /nfs/dbraw/zinc/57/82/03/1082578203.db2.gz NVMQDVWGQKQDEZ-INIZCTEOSA-N 1 1 351.406 4.252 20 5 FIBDMO COc1ccc(C[N@@H+](C)C[C@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000051132258 1082736410 /nfs/dbraw/zinc/73/64/10/1082736410.db2.gz UJHYDMFCVYLCPC-WIYYLYMNSA-N 1 1 370.449 4.203 20 5 FIBDMO Cc1ccc([C@@H]2CCCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC001167482242 1082878956 /nfs/dbraw/zinc/87/89/56/1082878956.db2.gz HPFAXDCIPIUWAC-IBGZPJMESA-N 1 1 367.449 4.459 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510473143 1082967139 /nfs/dbraw/zinc/96/71/39/1082967139.db2.gz PSOOYRPPTNTGGI-YJBOKZPZSA-N 1 1 350.422 4.261 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+](C)CCCCO)cc2[N+](=O)[O-])cc1 ZINC000471823753 1083066111 /nfs/dbraw/zinc/06/61/11/1083066111.db2.gz ZASYQCWSRKJSAW-UHFFFAOYSA-N 1 1 360.479 4.259 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610580902 1083208020 /nfs/dbraw/zinc/20/80/20/1083208020.db2.gz WTKPPIZCELHIJO-KRWDZBQOSA-N 1 1 353.378 4.082 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610580902 1083208023 /nfs/dbraw/zinc/20/80/23/1083208023.db2.gz WTKPPIZCELHIJO-KRWDZBQOSA-N 1 1 353.378 4.082 20 5 FIBDMO C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H]1c1cccc(F)c1 ZINC000610582288 1083213076 /nfs/dbraw/zinc/21/30/76/1083213076.db2.gz BMMGTKLCKQXPQU-BLVKFPJESA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H]1c1cccc(F)c1 ZINC000610582288 1083213080 /nfs/dbraw/zinc/21/30/80/1083213080.db2.gz BMMGTKLCKQXPQU-BLVKFPJESA-N 1 1 355.369 4.458 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)o2)cc1 ZINC000535809812 1083698151 /nfs/dbraw/zinc/69/81/51/1083698151.db2.gz JUXGRVNFKIFBJB-IRXDYDNUSA-N 1 1 356.422 4.103 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCCN(Cc2ccccc2)C1 ZINC000610805870 1083717785 /nfs/dbraw/zinc/71/77/85/1083717785.db2.gz HDNZQVZRVRWYIP-AZUAARDMSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000610805870 1083717798 /nfs/dbraw/zinc/71/77/98/1083717798.db2.gz HDNZQVZRVRWYIP-AZUAARDMSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000610805870 1083717806 /nfs/dbraw/zinc/71/78/06/1083717806.db2.gz HDNZQVZRVRWYIP-AZUAARDMSA-N 1 1 367.493 4.466 20 5 FIBDMO O=[N+]([O-])c1sccc1N1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000610808053 1083717831 /nfs/dbraw/zinc/71/78/31/1083717831.db2.gz YBNIISUKXWAFJG-IRXDYDNUSA-N 1 1 357.479 4.147 20 5 FIBDMO CCc1ccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407807 1083776135 /nfs/dbraw/zinc/77/61/35/1083776135.db2.gz NSDZXTJWUFYITN-HGHGUNKESA-N 1 1 369.465 4.056 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(OCC(F)(F)F)cc1 ZINC000511059543 1084517109 /nfs/dbraw/zinc/51/71/09/1084517109.db2.gz NGWSEHHZURJTKS-UHFFFAOYSA-N 1 1 368.355 4.210 20 5 FIBDMO CCOc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1OCC ZINC000511061760 1084530705 /nfs/dbraw/zinc/53/07/05/1084530705.db2.gz BGYQVGYSYFYQTE-UHFFFAOYSA-N 1 1 358.438 4.067 20 5 FIBDMO Cc1ccc(-c2nnc([C@H](C)[N@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511073808 1084613631 /nfs/dbraw/zinc/61/36/31/1084613631.db2.gz MPNPUCDZTXOART-HNNXBMFYSA-N 1 1 366.421 4.189 20 5 FIBDMO Cc1ccc(-c2nnc([C@H](C)[N@@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511073808 1084613640 /nfs/dbraw/zinc/61/36/40/1084613640.db2.gz MPNPUCDZTXOART-HNNXBMFYSA-N 1 1 366.421 4.189 20 5 FIBDMO O=C(C[NH+]1CCC(C2CCCC2)CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001167550477 1084672933 /nfs/dbraw/zinc/67/29/33/1084672933.db2.gz VFSWEVKJRMSFCZ-UHFFFAOYSA-N 1 1 365.861 4.089 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511089682 1084750335 /nfs/dbraw/zinc/75/03/35/1084750335.db2.gz GIESVONBVRRNAD-QGZVFWFLSA-N 1 1 369.465 4.022 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@@H](C)[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000511089682 1084750340 /nfs/dbraw/zinc/75/03/40/1084750340.db2.gz GIESVONBVRRNAD-QGZVFWFLSA-N 1 1 369.465 4.022 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2ccccc2F)o1 ZINC000511095958 1084808764 /nfs/dbraw/zinc/80/87/64/1084808764.db2.gz MQABUCMYJGGFBP-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2ccccc2F)o1 ZINC000511095958 1084808771 /nfs/dbraw/zinc/80/87/71/1084808771.db2.gz MQABUCMYJGGFBP-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO Cc1cccc(C(=O)Nc2cccc3c2C[N@@H+](CC(C)C)C3)c1[N+](=O)[O-] ZINC000158296327 1084992325 /nfs/dbraw/zinc/99/23/25/1084992325.db2.gz ZBKSWKKCYWYTSN-UHFFFAOYSA-N 1 1 353.422 4.127 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000479096581 1085088229 /nfs/dbraw/zinc/08/82/29/1085088229.db2.gz GQAMPMJHZIQBOP-KBXCAEBGSA-N 1 1 364.405 4.023 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1csc([N+](=O)[O-])c1 ZINC000111040188 1085148517 /nfs/dbraw/zinc/14/85/17/1085148517.db2.gz HZVJVIKSQKFUBR-UHFFFAOYSA-N 1 1 374.441 4.250 20 5 FIBDMO CC[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc(C)cc1 ZINC000181701924 1085206666 /nfs/dbraw/zinc/20/66/66/1085206666.db2.gz RELBFSGIKKWEOE-KRWDZBQOSA-N 1 1 352.394 4.194 20 5 FIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C(F)F)C2)cc1OC ZINC000611668749 1085285700 /nfs/dbraw/zinc/28/57/00/1085285700.db2.gz TXIFBMMHDLJAOL-STQMWFEESA-N 1 1 372.412 4.115 20 5 FIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C(F)F)C2)cc1OC ZINC000611668749 1085285708 /nfs/dbraw/zinc/28/57/08/1085285708.db2.gz TXIFBMMHDLJAOL-STQMWFEESA-N 1 1 372.412 4.115 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2cc(F)ccc2F)CC1 ZINC001167631629 1085848980 /nfs/dbraw/zinc/84/89/80/1085848980.db2.gz WLMLPZZWZZVUGA-AWEZNQCLSA-N 1 1 361.392 4.065 20 5 FIBDMO CCC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000178729598 1085991934 /nfs/dbraw/zinc/99/19/34/1085991934.db2.gz FOANSCJDKUAKDT-KRWDZBQOSA-N 1 1 359.382 4.143 20 5 FIBDMO Cc1noc([C@@H]2CCC[N@@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n1 ZINC000582991895 1085995547 /nfs/dbraw/zinc/99/55/47/1085995547.db2.gz JKWCXPUPLZESPB-INIZCTEOSA-N 1 1 370.434 4.352 20 5 FIBDMO Cc1noc([C@@H]2CCC[N@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n1 ZINC000582991895 1085995551 /nfs/dbraw/zinc/99/55/51/1085995551.db2.gz JKWCXPUPLZESPB-INIZCTEOSA-N 1 1 370.434 4.352 20 5 FIBDMO C[C@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000514894153 1086331518 /nfs/dbraw/zinc/33/15/18/1086331518.db2.gz OVNRPDPMSIRTQU-STQMWFEESA-N 1 1 368.462 4.255 20 5 FIBDMO CCc1ccc([C@@H](NCC2CC[NH+](CC)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000583228266 1086437768 /nfs/dbraw/zinc/43/77/68/1086437768.db2.gz ICACWLXJDAFYNI-NRFANRHFSA-N 1 1 371.481 4.161 20 5 FIBDMO CCc1ccc([C@H](NCC2CC[NH+](CC)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000583228267 1086438278 /nfs/dbraw/zinc/43/82/78/1086438278.db2.gz ICACWLXJDAFYNI-OAQYLSRUSA-N 1 1 371.481 4.161 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@]4(C3)CCCOC4)s2)cc1 ZINC000585767997 1086694146 /nfs/dbraw/zinc/69/41/46/1086694146.db2.gz QEYDGPOESNMCMC-LJQANCHMSA-N 1 1 358.463 4.326 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@@H]3CCCO3)o2)c([N+](=O)[O-])c1 ZINC000585767818 1086695129 /nfs/dbraw/zinc/69/51/29/1086695129.db2.gz DZPKAGTWVINIFZ-XLIONFOSSA-N 1 1 372.421 4.007 20 5 FIBDMO CC[NH+](CC)CC1CCN(c2cc(C)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000543959892 1086867106 /nfs/dbraw/zinc/86/71/06/1086867106.db2.gz DXZNAXIKHCXKSB-UHFFFAOYSA-N 1 1 356.470 4.010 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000472357976 1087783038 /nfs/dbraw/zinc/78/30/38/1087783038.db2.gz DGLLIFQKGSXHGF-XOBRGWDASA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000472357976 1087783049 /nfs/dbraw/zinc/78/30/49/1087783049.db2.gz DGLLIFQKGSXHGF-XOBRGWDASA-N 1 1 371.412 4.064 20 5 FIBDMO CCOC(=O)c1oc2ccccc2c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180397240 1087896029 /nfs/dbraw/zinc/89/60/29/1087896029.db2.gz PSUAFAPWMCTDIU-CYBMUJFWSA-N 1 1 368.389 4.369 20 5 FIBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(C2CCC2)CC1 ZINC000504912338 1087981605 /nfs/dbraw/zinc/98/16/05/1087981605.db2.gz UYCUHODYXUQYKG-HNNXBMFYSA-N 1 1 363.527 4.072 20 5 FIBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000181127333 1088254612 /nfs/dbraw/zinc/25/46/12/1088254612.db2.gz YNVQXNRUVSUVRL-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO COc1cnccc1[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000189553416 1088493696 /nfs/dbraw/zinc/49/36/96/1088493696.db2.gz OTRWFMGWEKNNEH-CYBMUJFWSA-N 1 1 353.378 4.109 20 5 FIBDMO CC(C)c1ccc(C[NH+]2CCC(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000514105784 1088750794 /nfs/dbraw/zinc/75/07/94/1088750794.db2.gz UGYMQQIWHZEPMW-UHFFFAOYSA-N 1 1 362.470 4.272 20 5 FIBDMO C[C@H]1CC[N@@H+](C)CCN1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000514105440 1088753326 /nfs/dbraw/zinc/75/33/26/1088753326.db2.gz RHVOIWVSNOOUQR-HNNXBMFYSA-N 1 1 373.428 4.052 20 5 FIBDMO CC(C)[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000434622074 1088841337 /nfs/dbraw/zinc/84/13/37/1088841337.db2.gz AFBPQEPBMXXJGH-LJQANCHMSA-N 1 1 356.401 4.439 20 5 FIBDMO C[C@@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853293 1088885014 /nfs/dbraw/zinc/88/50/14/1088885014.db2.gz WHHCHDLKXLQKPI-DYESRHJHSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](NC[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853293 1088885039 /nfs/dbraw/zinc/88/50/39/1088885039.db2.gz WHHCHDLKXLQKPI-DYESRHJHSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](NC[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853293 1088885061 /nfs/dbraw/zinc/88/50/61/1088885061.db2.gz WHHCHDLKXLQKPI-DYESRHJHSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H]([NH2+]C[C@@]1(C)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853293 1088885086 /nfs/dbraw/zinc/88/50/86/1088885086.db2.gz WHHCHDLKXLQKPI-DYESRHJHSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[C@@H]1c1ccccc1 ZINC000435027211 1089222983 /nfs/dbraw/zinc/22/29/83/1089222983.db2.gz LKKMAZCULYHXPA-YOEHRIQHSA-N 1 1 351.406 4.362 20 5 FIBDMO C[C@]1(c2ccccc2)CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000435064076 1089255438 /nfs/dbraw/zinc/25/54/38/1089255438.db2.gz MGMGRWFWRBXKKE-FQEVSTJZSA-N 1 1 351.406 4.290 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2cncc3ccccc32)CC1 ZINC000472744039 1089260903 /nfs/dbraw/zinc/26/09/03/1089260903.db2.gz BKHWYPJJKMOHBR-INIZCTEOSA-N 1 1 362.433 4.026 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CCC[C@H](CO)C3)cc2[N+](=O)[O-])cc1 ZINC000435247620 1089450173 /nfs/dbraw/zinc/45/01/73/1089450173.db2.gz XJRWGQNRTCTXIB-KRWDZBQOSA-N 1 1 372.490 4.259 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@H+]3CCC[C@H](CO)C3)cc2[N+](=O)[O-])cc1 ZINC000435247620 1089450184 /nfs/dbraw/zinc/45/01/84/1089450184.db2.gz XJRWGQNRTCTXIB-KRWDZBQOSA-N 1 1 372.490 4.259 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cncc(Br)c1 ZINC000515339536 1089973265 /nfs/dbraw/zinc/97/32/65/1089973265.db2.gz KQLGHCIXPLXQGC-QWRGUYRKSA-N 1 1 350.216 4.164 20 5 FIBDMO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])o1 ZINC000500098156 1091037402 /nfs/dbraw/zinc/03/74/02/1091037402.db2.gz OOJQGVDENZEYAA-KDOFPFPSSA-N 1 1 371.437 4.298 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)c2ccc(Cl)c(F)c2)C2CC2)c1 ZINC000759850413 1091326307 /nfs/dbraw/zinc/32/63/07/1091326307.db2.gz HSTLBJXNMVNTIY-SFHVURJKSA-N 1 1 364.804 4.085 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCOc3c(Br)cccc32)cs1 ZINC000500384363 1091392914 /nfs/dbraw/zinc/39/29/14/1091392914.db2.gz ODFYTJOYRFWJRZ-GFCCVEGCSA-N 1 1 369.240 4.032 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000512197141 1091890993 /nfs/dbraw/zinc/89/09/93/1091890993.db2.gz SKDWRPUEZAHDHB-ZWQQMPCFSA-N 1 1 357.498 4.194 20 5 FIBDMO CC[C@@H]1C[C@@]1([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccc(C)c1 ZINC000500532868 1092195400 /nfs/dbraw/zinc/19/54/00/1092195400.db2.gz LUNJQUVNJLROHF-UTKZUKDTSA-N 1 1 368.433 4.185 20 5 FIBDMO C[C@@H](C[NH+](C)C)NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000521600838 1092779163 /nfs/dbraw/zinc/77/91/63/1092779163.db2.gz PODOQYYOGIQHHO-ZDUSSCGKSA-N 1 1 363.845 4.080 20 5 FIBDMO C[N@@H+](CCSc1ccc([N+](=O)[O-])c2cccnc12)Cc1ccccc1 ZINC000432943957 1092971984 /nfs/dbraw/zinc/97/19/84/1092971984.db2.gz KMVYPJOVLGLGIA-UHFFFAOYSA-N 1 1 353.447 4.367 20 5 FIBDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)on1 ZINC000509828669 1093465789 /nfs/dbraw/zinc/46/57/89/1093465789.db2.gz UWIFGELMTCYSQX-KRWDZBQOSA-N 1 1 353.378 4.488 20 5 FIBDMO Cc1ccc(C)c([C@@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000474212775 1093585381 /nfs/dbraw/zinc/58/53/81/1093585381.db2.gz ONBUNQIEEQHKEJ-FQEVSTJZSA-N 1 1 367.449 4.012 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCSC[C@H]3C3CCC3)o2)c1 ZINC000419375781 1093814039 /nfs/dbraw/zinc/81/40/39/1093814039.db2.gz RAFDJKKCUKWBBP-KRWDZBQOSA-N 1 1 373.478 4.010 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000052611823 1093837246 /nfs/dbraw/zinc/83/72/46/1093837246.db2.gz ASFYZFCRDFFMPN-CYBMUJFWSA-N 1 1 355.369 4.255 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](n3cccn3)C2)s1 ZINC000513123134 1093861370 /nfs/dbraw/zinc/86/13/70/1093861370.db2.gz RVRFOMBACXTDCO-OAHLLOKOSA-N 1 1 368.462 4.357 20 5 FIBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473520098 1093970897 /nfs/dbraw/zinc/97/08/97/1093970897.db2.gz IELYFTVCANHDKZ-CQSZACIVSA-N 1 1 368.462 4.088 20 5 FIBDMO COc1ccccc1O[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000513367755 1094083285 /nfs/dbraw/zinc/08/32/85/1094083285.db2.gz RLBSUETUUNWFKO-YJBOKZPZSA-N 1 1 356.422 4.208 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N(C)C)cc1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182743778 1094165243 /nfs/dbraw/zinc/16/52/43/1094165243.db2.gz IBAAJLVCJFZQBN-INIZCTEOSA-N 1 1 369.465 4.188 20 5 FIBDMO CCCn1nccc1C1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000501547884 1094760197 /nfs/dbraw/zinc/76/01/97/1094760197.db2.gz VYQHGOGUYBPLDV-UHFFFAOYSA-N 1 1 362.861 4.234 20 5 FIBDMO C[C@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000413233269 1094764984 /nfs/dbraw/zinc/76/49/84/1094764984.db2.gz CRUGBYBBHAQPMX-RYUDHWBXSA-N 1 1 372.391 4.074 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421007089 1095240763 /nfs/dbraw/zinc/24/07/63/1095240763.db2.gz KUGCDHGRMSCQOL-AWEZNQCLSA-N 1 1 361.467 4.375 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421007089 1095240775 /nfs/dbraw/zinc/24/07/75/1095240775.db2.gz KUGCDHGRMSCQOL-AWEZNQCLSA-N 1 1 361.467 4.375 20 5 FIBDMO CSc1ccccc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000281850535 1095716900 /nfs/dbraw/zinc/71/69/00/1095716900.db2.gz ZEMFYTQQECFBGO-LBPRGKRZSA-N 1 1 360.435 4.034 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c(C3CC3)nc3sccn23)c(Cl)c1 ZINC000183808894 1096210480 /nfs/dbraw/zinc/21/04/80/1096210480.db2.gz PTPAMDYCYVRPIT-UHFFFAOYSA-N 1 1 362.842 4.125 20 5 FIBDMO CCCOc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)ccc1OC ZINC000183808389 1096210730 /nfs/dbraw/zinc/21/07/30/1096210730.db2.gz HQCRBLRRBITKKU-UHFFFAOYSA-N 1 1 364.829 4.335 20 5 FIBDMO C[C@H](Nc1ccc([NH+]2CCCCC2)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000007003242 1096580928 /nfs/dbraw/zinc/58/09/28/1096580928.db2.gz AWULIRWTEHFXRP-HNNXBMFYSA-N 1 1 368.437 4.024 20 5 FIBDMO CC[C@H](c1ccccc1)[N@@H+](CC)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000532935219 1098628090 /nfs/dbraw/zinc/62/80/90/1098628090.db2.gz WEGKADBUJAAQRM-LJQANCHMSA-N 1 1 355.438 4.031 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000533020155 1098694880 /nfs/dbraw/zinc/69/48/80/1098694880.db2.gz CSIMOYVHBCUNFR-UHFFFAOYSA-N 1 1 368.824 4.414 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000533020155 1098694889 /nfs/dbraw/zinc/69/48/89/1098694889.db2.gz CSIMOYVHBCUNFR-UHFFFAOYSA-N 1 1 368.824 4.414 20 5 FIBDMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000425463209 1098740644 /nfs/dbraw/zinc/74/06/44/1098740644.db2.gz VTWIANMKUUVRIK-UHFFFAOYSA-N 1 1 365.202 4.275 20 5 FIBDMO CC(C)[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1cccs1 ZINC000533247337 1098911070 /nfs/dbraw/zinc/91/10/70/1098911070.db2.gz PVLRFRDPJNEONV-UHFFFAOYSA-N 1 1 367.858 4.159 20 5 FIBDMO CC(C)[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1cccs1 ZINC000533247337 1098911073 /nfs/dbraw/zinc/91/10/73/1098911073.db2.gz PVLRFRDPJNEONV-UHFFFAOYSA-N 1 1 367.858 4.159 20 5 FIBDMO CCN(Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000505790634 1098913316 /nfs/dbraw/zinc/91/33/16/1098913316.db2.gz ODYPRGROIRYNKV-WMZOPIPTSA-N 1 1 371.456 4.391 20 5 FIBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000533303367 1098955055 /nfs/dbraw/zinc/95/50/55/1098955055.db2.gz RIKOFMFWADKGLF-UKRRQHHQSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000533303367 1098955061 /nfs/dbraw/zinc/95/50/61/1098955061.db2.gz RIKOFMFWADKGLF-UKRRQHHQSA-N 1 1 373.840 4.065 20 5 FIBDMO COc1ccccc1C(C)(C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000533369937 1099003600 /nfs/dbraw/zinc/00/36/00/1099003600.db2.gz LFSZCQIPLOWQQB-UHFFFAOYSA-N 1 1 358.438 4.416 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](c1ccccc1)C(C)C ZINC000436466435 1099034293 /nfs/dbraw/zinc/03/42/93/1099034293.db2.gz QMYPZQQELFABCW-FQEVSTJZSA-N 1 1 355.438 4.171 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](c3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000533435035 1099054086 /nfs/dbraw/zinc/05/40/86/1099054086.db2.gz HYLFWBLEDRUPIH-HFTRVMKXSA-N 1 1 367.449 4.108 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](c3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000533435037 1099054644 /nfs/dbraw/zinc/05/46/44/1099054644.db2.gz HYLFWBLEDRUPIH-UWWQBHOKSA-N 1 1 367.449 4.108 20 5 FIBDMO Cc1noc(C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)n1 ZINC000428644072 1099958167 /nfs/dbraw/zinc/95/81/67/1099958167.db2.gz TVSKUOUHWMXXGG-KRWDZBQOSA-N 1 1 372.812 4.013 20 5 FIBDMO C[C@H]1CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC12CCC2 ZINC000536692952 1100191452 /nfs/dbraw/zinc/19/14/52/1100191452.db2.gz ISLKVEHKAISVKT-HNNXBMFYSA-N 1 1 355.438 4.304 20 5 FIBDMO CC1(C)Cc2ccsc2C[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459578417 1100324190 /nfs/dbraw/zinc/32/41/90/1100324190.db2.gz IFLFWPGICHCAIL-UHFFFAOYSA-N 1 1 370.434 4.043 20 5 FIBDMO CC1(C)Cc2ccsc2C[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459578417 1100324199 /nfs/dbraw/zinc/32/41/99/1100324199.db2.gz IFLFWPGICHCAIL-UHFFFAOYSA-N 1 1 370.434 4.043 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000459653838 1100396666 /nfs/dbraw/zinc/39/66/66/1100396666.db2.gz DMSAQAWKKGDCQQ-XJKSGUPXSA-N 1 1 372.387 4.337 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[NH+]1CCCC1 ZINC000518272421 1101055536 /nfs/dbraw/zinc/05/55/36/1101055536.db2.gz AVOWKPJJPLDMEC-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000459673169 1101312750 /nfs/dbraw/zinc/31/27/50/1101312750.db2.gz IYPHICAPMVVODH-QZTJIDSGSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](Cc1ccc(F)cc1)C1CCOCC1 ZINC000426390893 1101460884 /nfs/dbraw/zinc/46/08/84/1101460884.db2.gz MTDIFEXXEOCPSI-HYXAFXHYSA-N 1 1 370.424 4.428 20 5 FIBDMO COc1cc(C[NH2+][C@H](C)c2ccc(SC)cc2)c([N+](=O)[O-])cc1F ZINC000439472355 1101474315 /nfs/dbraw/zinc/47/43/15/1101474315.db2.gz SPJVHBWEBQWWGP-LLVKDONJSA-N 1 1 350.415 4.315 20 5 FIBDMO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H]1CC[C@H](O)CC1 ZINC000439794811 1101775934 /nfs/dbraw/zinc/77/59/34/1101775934.db2.gz SBRGDJKSWDCXMJ-QAQDUYKDSA-N 1 1 374.412 4.262 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+](Cc1cccs1)C[C@H]1CCCO1 ZINC000506710825 1101862218 /nfs/dbraw/zinc/86/22/18/1101862218.db2.gz JZSFURWFVKYOFY-RJIDQJRZSA-N 1 1 358.463 4.351 20 5 FIBDMO O=C(CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)Nc1ccccc1Cl ZINC000130367614 1101936441 /nfs/dbraw/zinc/93/64/41/1101936441.db2.gz LSQLIFXPRMLOQA-UHFFFAOYSA-N 1 1 373.840 4.241 20 5 FIBDMO CC(C)[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cccc(F)c1 ZINC000506791547 1102120014 /nfs/dbraw/zinc/12/00/14/1102120014.db2.gz WFVYOXCRSDPCHQ-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO CC(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cccc(F)c1 ZINC000506791547 1102120020 /nfs/dbraw/zinc/12/00/20/1102120020.db2.gz WFVYOXCRSDPCHQ-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)Cc3cccc(O)c3)o2)c([N+](=O)[O-])c1 ZINC000532502183 1102432322 /nfs/dbraw/zinc/43/23/22/1102432322.db2.gz PJWLFCNRCZWPQM-UHFFFAOYSA-N 1 1 368.389 4.201 20 5 FIBDMO CC(C)C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000532499778 1102441760 /nfs/dbraw/zinc/44/17/60/1102441760.db2.gz AZSCJNDZRGZDBM-UHFFFAOYSA-N 1 1 353.850 4.087 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@@H+]3CC[C@@H](c4cccc(F)c4)C3)c2c1 ZINC000729471007 1102866246 /nfs/dbraw/zinc/86/62/46/1102866246.db2.gz VVIYKSSHOPCIHZ-CYBMUJFWSA-N 1 1 373.409 4.458 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(=S)n(C[N@H+]3CC[C@@H](c4cccc(F)c4)C3)c2c1 ZINC000729471007 1102866262 /nfs/dbraw/zinc/86/62/62/1102866262.db2.gz VVIYKSSHOPCIHZ-CYBMUJFWSA-N 1 1 373.409 4.458 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cc(Br)ccc1F ZINC000550261303 1102881774 /nfs/dbraw/zinc/88/17/74/1102881774.db2.gz JVQQOVQQYBBWDK-UHFFFAOYSA-N 1 1 353.191 4.095 20 5 FIBDMO Cc1ccc([C@H]2CCC[N@@H+]2Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000532744882 1103159227 /nfs/dbraw/zinc/15/92/27/1103159227.db2.gz MQEKTIARXMFDFO-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000532744882 1103159230 /nfs/dbraw/zinc/15/92/30/1103159230.db2.gz MQEKTIARXMFDFO-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1ccc(-c2n[nH]cc2C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000507154980 1103171971 /nfs/dbraw/zinc/17/19/71/1103171971.db2.gz MHBLMGKEZJGYDE-UHFFFAOYSA-N 1 1 362.433 4.458 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2c[nH]nc2-c2ccccc2F)C2CC2)c1 ZINC000507172752 1103191278 /nfs/dbraw/zinc/19/12/78/1103191278.db2.gz HUNDSLHAAKEDKN-UHFFFAOYSA-N 1 1 366.396 4.289 20 5 FIBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1 ZINC000507201541 1103201096 /nfs/dbraw/zinc/20/10/96/1103201096.db2.gz GPDYNMKWCCTLRB-OAHLLOKOSA-N 1 1 356.422 4.271 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](CCc1nccs1)C(C)C ZINC000532818230 1103255588 /nfs/dbraw/zinc/25/55/88/1103255588.db2.gz NLUBMAKELLVUPH-UHFFFAOYSA-N 1 1 363.483 4.292 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]([C@H](C)c2ccco2)C2CC2)cccc1[N+](=O)[O-] ZINC000086235455 1103837414 /nfs/dbraw/zinc/83/74/14/1103837414.db2.gz FOOIESUQTCFVJA-CQSZACIVSA-N 1 1 357.410 4.050 20 5 FIBDMO Cc1c([C@H](C)[NH2+][C@@H](CO)c2cccc(Cl)c2F)cccc1[N+](=O)[O-] ZINC000467414315 1104061308 /nfs/dbraw/zinc/06/13/08/1104061308.db2.gz SRJCMWZUYXBCPA-NHYWBVRUSA-N 1 1 352.793 4.080 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2ccc(F)cc2F)CCCC1 ZINC000538233020 1104063812 /nfs/dbraw/zinc/06/38/12/1104063812.db2.gz MAHOFHBPLVRVNY-UHFFFAOYSA-N 1 1 362.376 4.441 20 5 FIBDMO Cc1[nH+]cn(-c2ccc(NC(=O)Nc3ccc([N+](=O)[O-])cc3F)cc2)c1C ZINC000461108007 1104086749 /nfs/dbraw/zinc/08/67/49/1104086749.db2.gz LGGJGKGRNZAPPC-UHFFFAOYSA-N 1 1 369.356 4.180 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000520525564 1104975255 /nfs/dbraw/zinc/97/52/55/1104975255.db2.gz QQEGRMZFGAAOPV-DGCLKSJQSA-N 1 1 358.385 4.215 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CCC[C@](C)(O)CC2)cc1[N+](=O)[O-] ZINC000475333062 1106736972 /nfs/dbraw/zinc/73/69/72/1106736972.db2.gz RUKLSKQTWNLJMI-NRFANRHFSA-N 1 1 369.465 4.100 20 5 FIBDMO C[C@@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000248753956 1107375572 /nfs/dbraw/zinc/37/55/72/1107375572.db2.gz CJPTVENTAJLCDW-RZXSNQJFSA-N 1 1 365.477 4.441 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2CC(N3CCCCC3)C2)s1 ZINC000475572501 1107778976 /nfs/dbraw/zinc/77/89/76/1107778976.db2.gz YYDKFTFQTXHHOT-UHFFFAOYSA-N 1 1 371.506 4.430 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@H](C)C1 ZINC000520204188 1108020161 /nfs/dbraw/zinc/02/01/61/1108020161.db2.gz UCXJLOWSNZYXMP-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C)C1 ZINC000520204188 1108020171 /nfs/dbraw/zinc/02/01/71/1108020171.db2.gz UCXJLOWSNZYXMP-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1c(C[NH2+][C@H](C)c2ncc(-c3ccccc3)n2C)cccc1[N+](=O)[O-] ZINC000453211484 1108258656 /nfs/dbraw/zinc/25/86/56/1108258656.db2.gz NKXILLZSKLMIFO-OAHLLOKOSA-N 1 1 350.422 4.155 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ncc(-c2ccccc2)n1C ZINC000453226764 1108299083 /nfs/dbraw/zinc/29/90/83/1108299083.db2.gz PCCHFBDQSVOANZ-LSDHHAIUSA-N 1 1 350.422 4.407 20 5 FIBDMO COCc1ccccc1/C=C(/C)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000508516296 1108378932 /nfs/dbraw/zinc/37/89/32/1108378932.db2.gz LTRDTJVXEONAEE-WJDWOHSUSA-N 1 1 352.434 4.203 20 5 FIBDMO COCc1ccccc1/C=C(/C)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000508516296 1108378948 /nfs/dbraw/zinc/37/89/48/1108378948.db2.gz LTRDTJVXEONAEE-WJDWOHSUSA-N 1 1 352.434 4.203 20 5 FIBDMO COc1ccc(CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC(C)C)cc1OC ZINC000523788925 1108520087 /nfs/dbraw/zinc/52/00/87/1108520087.db2.gz SHXFEUMESQPJNO-UHFFFAOYSA-N 1 1 372.465 4.313 20 5 FIBDMO Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)o1 ZINC000524752945 1109138275 /nfs/dbraw/zinc/13/82/75/1109138275.db2.gz MEELWDUPZIFESX-ACJLOTCBSA-N 1 1 372.421 4.336 20 5 FIBDMO Cc1ccc([C@@H]2C[C@H](C)CC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)o1 ZINC000524752945 1109138281 /nfs/dbraw/zinc/13/82/81/1109138281.db2.gz MEELWDUPZIFESX-ACJLOTCBSA-N 1 1 372.421 4.336 20 5 FIBDMO CC1(C)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1c1ccccc1 ZINC000441076140 1109324788 /nfs/dbraw/zinc/32/47/88/1109324788.db2.gz XLIJQQARLAGFHO-MRXNPFEDSA-N 1 1 351.406 4.362 20 5 FIBDMO COc1ccc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000525266901 1109324804 /nfs/dbraw/zinc/32/48/04/1109324804.db2.gz VOZCYENHYOAVNF-MRXNPFEDSA-N 1 1 358.463 4.218 20 5 FIBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000447406707 1109535657 /nfs/dbraw/zinc/53/56/57/1109535657.db2.gz WVWOGUUFNZHTGP-KRWDZBQOSA-N 1 1 369.465 4.103 20 5 FIBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccc(Cl)s1 ZINC000441254666 1109538387 /nfs/dbraw/zinc/53/83/87/1109538387.db2.gz ZOANTFBZWWLSBK-UHFFFAOYSA-N 1 1 370.858 4.219 20 5 FIBDMO COc1cc(C[N@@H+]2[C@H](C)C[C@@H]2C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000527238464 1109719929 /nfs/dbraw/zinc/71/99/29/1109719929.db2.gz DDXZTCJIRDDZNU-GASCZTMLSA-N 1 1 356.422 4.165 20 5 FIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@@H]1C ZINC000449492917 1110087772 /nfs/dbraw/zinc/08/77/72/1110087772.db2.gz CUQAUINPSIYPCN-SJCJKPOMSA-N 1 1 364.829 4.365 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnc([C@H]4CCCO4)s3)C2)cc1 ZINC000449495735 1110092552 /nfs/dbraw/zinc/09/25/52/1110092552.db2.gz DWPQQYQWCAGIOY-MAUKXSAKSA-N 1 1 373.478 4.282 20 5 FIBDMO CCO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C[C@H]1C ZINC000449496993 1110093685 /nfs/dbraw/zinc/09/36/85/1110093685.db2.gz QPSLVGCXWLVQPX-KUHUBIRLSA-N 1 1 374.437 4.110 20 5 FIBDMO Cc1ccc(C[NH2+][C@](C)(CO)c2cc(Cl)cc(Cl)c2)cc1[N+](=O)[O-] ZINC000449672435 1110142467 /nfs/dbraw/zinc/14/24/67/1110142467.db2.gz WEXWGGNZCGQCEB-QGZVFWFLSA-N 1 1 369.248 4.207 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H](CCCO)C3)o2)c(Cl)c1 ZINC000449790913 1110172704 /nfs/dbraw/zinc/17/27/04/1110172704.db2.gz MSTQFNIXQWNETP-ZDUSSCGKSA-N 1 1 364.829 4.103 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1)C1CC1 ZINC000539348794 1111528524 /nfs/dbraw/zinc/52/85/24/1111528524.db2.gz IXDTVSJBMJFUCL-HNNXBMFYSA-N 1 1 367.449 4.070 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])cc1)C1CC1 ZINC000539348797 1111528626 /nfs/dbraw/zinc/52/86/26/1111528626.db2.gz IXDTVSJBMJFUCL-OAHLLOKOSA-N 1 1 367.449 4.070 20 5 FIBDMO CCS[C@@H]1CCC[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552044580 1111555829 /nfs/dbraw/zinc/55/58/29/1111555829.db2.gz GWODRNJHBVCSPG-JQHSSLGASA-N 1 1 374.510 4.072 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3Cc4cccc(Cl)c4C3)o2)c1 ZINC000554285725 1112282943 /nfs/dbraw/zinc/28/29/43/1112282943.db2.gz NVXLLSUBSGDXQF-UHFFFAOYSA-N 1 1 369.808 4.462 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3Cc4cccc(Cl)c4C3)o2)c1 ZINC000554285725 1112282947 /nfs/dbraw/zinc/28/29/47/1112282947.db2.gz NVXLLSUBSGDXQF-UHFFFAOYSA-N 1 1 369.808 4.462 20 5 FIBDMO Cc1c([C@@H](C)NCCC[N@@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000480231099 1112342754 /nfs/dbraw/zinc/34/27/54/1112342754.db2.gz NDCOKWKTHZQLGW-QGZVFWFLSA-N 1 1 353.466 4.002 20 5 FIBDMO Cc1c([C@@H](C)NCCC[N@H+]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000480231099 1112342758 /nfs/dbraw/zinc/34/27/58/1112342758.db2.gz NDCOKWKTHZQLGW-QGZVFWFLSA-N 1 1 353.466 4.002 20 5 FIBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000480410272 1112416675 /nfs/dbraw/zinc/41/66/75/1112416675.db2.gz ZPRAFICGMAHQLM-RDJZCZTQSA-N 1 1 362.433 4.390 20 5 FIBDMO Cc1c([C@H](C)N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000482358515 1113231832 /nfs/dbraw/zinc/23/18/32/1113231832.db2.gz MPTUAIXPXLQLKQ-LNLFQRSKSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1c([C@H](C)N[C@H]2CC[N@H+]([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000482358515 1113231835 /nfs/dbraw/zinc/23/18/35/1113231835.db2.gz MPTUAIXPXLQLKQ-LNLFQRSKSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1nc2ccccc2n1C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000482893366 1113393446 /nfs/dbraw/zinc/39/34/46/1113393446.db2.gz ZPYCGZZWSMAUHC-UHFFFAOYSA-N 1 1 368.412 4.229 20 5 FIBDMO C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000160764533 1113447736 /nfs/dbraw/zinc/44/77/36/1113447736.db2.gz HPQKOLVFWMPELM-ZWOKBUDYSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)C[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000160764533 1113447743 /nfs/dbraw/zinc/44/77/43/1113447743.db2.gz HPQKOLVFWMPELM-ZWOKBUDYSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483240511 1113469555 /nfs/dbraw/zinc/46/95/55/1113469555.db2.gz RIZCLZXBVFSEOJ-DZGCQCFKSA-N 1 1 358.442 4.464 20 5 FIBDMO CCC1CCC([N@@H+](CCO)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000488203951 1113878038 /nfs/dbraw/zinc/87/80/38/1113878038.db2.gz QIJXJCFJUARCBJ-UHFFFAOYSA-N 1 1 373.453 4.013 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000044089754 1113940663 /nfs/dbraw/zinc/94/06/63/1113940663.db2.gz QASUQMDZFLASOH-CQSZACIVSA-N 1 1 367.405 4.281 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000044089754 1113940665 /nfs/dbraw/zinc/94/06/65/1113940665.db2.gz QASUQMDZFLASOH-CQSZACIVSA-N 1 1 367.405 4.281 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCc2ccc(F)cc21 ZINC000911595583 1114001777 /nfs/dbraw/zinc/00/17/77/1114001777.db2.gz INDKFXCHXAXHQY-LBPRGKRZSA-N 1 1 355.369 4.037 20 5 FIBDMO COc1ccc2c(c1)CCC[C@@H]2[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000489092586 1114048871 /nfs/dbraw/zinc/04/88/71/1114048871.db2.gz CEPYUHWNPRZLRL-SFHVURJKSA-N 1 1 356.422 4.121 20 5 FIBDMO COc1cccc(C=C2CC[NH+](Cc3ccc([N+](=O)[O-])c(OC)c3)CC2)c1 ZINC000490028138 1114204260 /nfs/dbraw/zinc/20/42/60/1114204260.db2.gz GBAYHXWGIZSEJO-UHFFFAOYSA-N 1 1 368.433 4.291 20 5 FIBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1C ZINC000490044359 1114209472 /nfs/dbraw/zinc/20/94/72/1114209472.db2.gz RMQPEMVKFVUETN-MRXNPFEDSA-N 1 1 355.438 4.142 20 5 FIBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1C ZINC000490044359 1114209473 /nfs/dbraw/zinc/20/94/73/1114209473.db2.gz RMQPEMVKFVUETN-MRXNPFEDSA-N 1 1 355.438 4.142 20 5 FIBDMO Cc1ccc([C@H]2C[C@H](C)[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)cc1 ZINC000490083929 1114216515 /nfs/dbraw/zinc/21/65/15/1114216515.db2.gz VECSPTUTRZSQDP-RDJZCZTQSA-N 1 1 368.433 4.148 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccnc1OCC(F)(F)F ZINC000151117377 1114297561 /nfs/dbraw/zinc/29/75/61/1114297561.db2.gz JADDQTJLQWYCJJ-LBPRGKRZSA-N 1 1 369.343 4.090 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@@H](c2c(F)cccc2Cl)[NH+]2CCCC2)nc1 ZINC000029622157 1114340004 /nfs/dbraw/zinc/34/00/04/1114340004.db2.gz QZBIMQLKBJRSKF-HNNXBMFYSA-N 1 1 364.808 4.031 20 5 FIBDMO C[N@H+](CCCc1cc(-c2ccccc2)no1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491193592 1114379898 /nfs/dbraw/zinc/37/98/98/1114379898.db2.gz BKXXDPFPPYHNKL-UHFFFAOYSA-N 1 1 369.396 4.454 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)no1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491193592 1114379901 /nfs/dbraw/zinc/37/99/01/1114379901.db2.gz BKXXDPFPPYHNKL-UHFFFAOYSA-N 1 1 369.396 4.454 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000164377391 1114475947 /nfs/dbraw/zinc/47/59/47/1114475947.db2.gz MDWQJJXDOXKJGX-LJQANCHMSA-N 1 1 353.422 4.069 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000164377683 1114476187 /nfs/dbraw/zinc/47/61/87/1114476187.db2.gz SQJQHGNIZUSWJF-LJQANCHMSA-N 1 1 353.422 4.069 20 5 FIBDMO C[C@]1(CCCO)CCC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000571603168 1114483318 /nfs/dbraw/zinc/48/33/18/1114483318.db2.gz WBRZDKNVPMJZKR-LJQANCHMSA-N 1 1 360.479 4.450 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c1 ZINC000590173497 1114907931 /nfs/dbraw/zinc/90/79/31/1114907931.db2.gz WZKBMWAKGRWGGD-AWEZNQCLSA-N 1 1 365.355 4.073 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)c1 ZINC000590178436 1114908042 /nfs/dbraw/zinc/90/80/42/1114908042.db2.gz TWSORYUTXRMVAT-SECBINFHSA-N 1 1 356.266 4.388 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](CC(F)(F)F)C2)c1 ZINC000590178436 1114908044 /nfs/dbraw/zinc/90/80/44/1114908044.db2.gz TWSORYUTXRMVAT-SECBINFHSA-N 1 1 356.266 4.388 20 5 FIBDMO CC(C)n1ccc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n1 ZINC000573117111 1115046319 /nfs/dbraw/zinc/04/63/19/1115046319.db2.gz GGAQKQSIKQXIPH-UHFFFAOYSA-N 1 1 356.451 4.391 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H]1CCC(F)(F)C1)[C@H]1CC[C@H](O)CC1 ZINC000592132513 1115205254 /nfs/dbraw/zinc/20/52/54/1115205254.db2.gz HYGILUSUDGPJDY-XIRDDKMYSA-N 1 1 368.424 4.136 20 5 FIBDMO Cc1ccc(C2([NH2+]Cc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)CCC2)cc1 ZINC000592186264 1115219783 /nfs/dbraw/zinc/21/97/83/1115219783.db2.gz BRJBSVVUCZOKBQ-UHFFFAOYSA-N 1 1 364.405 4.122 20 5 FIBDMO CCCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCc2ncsc2C1 ZINC000592187193 1115220450 /nfs/dbraw/zinc/22/04/50/1115220450.db2.gz ICLGUJGVZGOPCY-CYBMUJFWSA-N 1 1 351.497 4.272 20 5 FIBDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1cc2ccccc2c2cccnc12 ZINC000592777154 1115261977 /nfs/dbraw/zinc/26/19/77/1115261977.db2.gz MPHGLNGVNDUGAS-QGZVFWFLSA-N 1 1 359.473 4.135 20 5 FIBDMO C[C@@H](CSc1ccccc1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000593046931 1115282208 /nfs/dbraw/zinc/28/22/08/1115282208.db2.gz UYJNXIQBRXUAMZ-AWEZNQCLSA-N 1 1 374.462 4.074 20 5 FIBDMO C[C@@H](CSc1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000593046931 1115282209 /nfs/dbraw/zinc/28/22/09/1115282209.db2.gz UYJNXIQBRXUAMZ-AWEZNQCLSA-N 1 1 374.462 4.074 20 5 FIBDMO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014426 1115503918 /nfs/dbraw/zinc/50/39/18/1115503918.db2.gz PIYLDONDXDWIMQ-UGSOOPFHSA-N 1 1 356.422 4.340 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCCOc2ccc(F)cc21 ZINC000595006267 1115507587 /nfs/dbraw/zinc/50/75/87/1115507587.db2.gz HXBASAARGCLJKS-SJCJKPOMSA-N 1 1 360.385 4.307 20 5 FIBDMO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ncnc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000595064151 1115509065 /nfs/dbraw/zinc/50/90/65/1115509065.db2.gz DPKDFWXYZDDGIN-SGMGOOAPSA-N 1 1 369.450 4.271 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@H](COC)c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000595068084 1115509244 /nfs/dbraw/zinc/50/92/44/1115509244.db2.gz OHIYONHTXUMJKP-KBXCAEBGSA-N 1 1 374.437 4.040 20 5 FIBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595290296 1115521045 /nfs/dbraw/zinc/52/10/45/1115521045.db2.gz YIHQQPCCTCBURE-MRXNPFEDSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595290296 1115521049 /nfs/dbraw/zinc/52/10/49/1115521049.db2.gz YIHQQPCCTCBURE-MRXNPFEDSA-N 1 1 360.385 4.088 20 5 FIBDMO Cc1noc(C[NH2+]C2(c3ccc(C(F)(F)F)cc3)CCCC2)c1[N+](=O)[O-] ZINC000595423921 1115535663 /nfs/dbraw/zinc/53/56/63/1115535663.db2.gz FFHOQYGNXBEHLS-UHFFFAOYSA-N 1 1 369.343 4.469 20 5 FIBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000595431746 1115536098 /nfs/dbraw/zinc/53/60/98/1115536098.db2.gz GYZRKJKGQZNMHA-PKOBYXMFSA-N 1 1 362.376 4.225 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c1 ZINC000595502776 1115538839 /nfs/dbraw/zinc/53/88/39/1115538839.db2.gz NKGBQBCGHZVZBE-ZDUSSCGKSA-N 1 1 365.355 4.388 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H](c3ccccn3)C2)c1 ZINC000595502776 1115538842 /nfs/dbraw/zinc/53/88/42/1115538842.db2.gz NKGBQBCGHZVZBE-ZDUSSCGKSA-N 1 1 365.355 4.388 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CCc3ccccc3-n3ccnc31)CCC2 ZINC000596093994 1115574486 /nfs/dbraw/zinc/57/44/86/1115574486.db2.gz FYHJPQVNZHFUKB-PMACEKPBSA-N 1 1 374.444 4.435 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCCc4n[nH]cc4C3)o2)c(Cl)c1 ZINC000597257852 1115651869 /nfs/dbraw/zinc/65/18/69/1115651869.db2.gz IVYQUAWFDBQDLM-UHFFFAOYSA-N 1 1 372.812 4.180 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCc4n[nH]cc4C3)o2)c(Cl)c1 ZINC000597257852 1115651870 /nfs/dbraw/zinc/65/18/70/1115651870.db2.gz IVYQUAWFDBQDLM-UHFFFAOYSA-N 1 1 372.812 4.180 20 5 FIBDMO CCC[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1ccccn1 ZINC000602538375 1115709545 /nfs/dbraw/zinc/70/95/45/1115709545.db2.gz KUYHOEIDVDTDEG-GFCCVEGCSA-N 1 1 370.272 4.445 20 5 FIBDMO C[N@@H+](CCC(=O)Nc1cccc2ccccc21)Cc1ccccc1[N+](=O)[O-] ZINC000603581546 1115795584 /nfs/dbraw/zinc/79/55/84/1115795584.db2.gz WWJHBLCQOJIOFZ-UHFFFAOYSA-N 1 1 363.417 4.209 20 5 FIBDMO Cc1c(C[N@@H+](C)Cc2ccc(OC(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000603840621 1115818842 /nfs/dbraw/zinc/81/88/42/1115818842.db2.gz NPPYIWNGKMYFAF-UHFFFAOYSA-N 1 1 354.328 4.434 20 5 FIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccccc1OC(F)(F)F ZINC000603840894 1115822629 /nfs/dbraw/zinc/82/26/29/1115822629.db2.gz IEZGLHNAFXHCJC-UHFFFAOYSA-N 1 1 370.327 4.004 20 5 FIBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccc2ccccc21 ZINC000603892046 1115827011 /nfs/dbraw/zinc/82/70/11/1115827011.db2.gz ZVPGAGZUPBTARH-HNNXBMFYSA-N 1 1 363.417 4.207 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](CCO)c1cc(Cl)cc(Cl)c1 ZINC000599680216 1115837663 /nfs/dbraw/zinc/83/76/63/1115837663.db2.gz LJLADISTQVGKQW-OAHLLOKOSA-N 1 1 373.211 4.254 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCCc2ccccc21 ZINC000604434695 1115865356 /nfs/dbraw/zinc/86/53/56/1115865356.db2.gz NINQDXCUUOLXRG-FQEVSTJZSA-N 1 1 367.449 4.241 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000604520781 1115867324 /nfs/dbraw/zinc/86/73/24/1115867324.db2.gz PTIRUKPDJCIWLV-DYESRHJHSA-N 1 1 370.449 4.203 20 5 FIBDMO CCCC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccc(C)o1 ZINC000604493609 1115868070 /nfs/dbraw/zinc/86/80/70/1115868070.db2.gz NGXSODGCDTYTJR-OAHLLOKOSA-N 1 1 359.426 4.298 20 5 FIBDMO CCCC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccc(C)o1 ZINC000604493609 1115868071 /nfs/dbraw/zinc/86/80/71/1115868071.db2.gz NGXSODGCDTYTJR-OAHLLOKOSA-N 1 1 359.426 4.298 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000604501380 1115868360 /nfs/dbraw/zinc/86/83/60/1115868360.db2.gz AMTUGVWQAIPWNU-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000604501380 1115868362 /nfs/dbraw/zinc/86/83/62/1115868362.db2.gz AMTUGVWQAIPWNU-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)s1 ZINC000608836278 1116131156 /nfs/dbraw/zinc/13/11/56/1116131156.db2.gz ZIUNEYBSRQNFQZ-GJZGRUSLSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@H+]3CCC[C@H]3C2)s1 ZINC000608836278 1116131157 /nfs/dbraw/zinc/13/11/57/1116131157.db2.gz ZIUNEYBSRQNFQZ-GJZGRUSLSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H]3Cc3ccccc3)co2)cc1 ZINC000534079383 1116156748 /nfs/dbraw/zinc/15/67/48/1116156748.db2.gz GFQLDLKGXUYQEJ-HXUWFJFHSA-N 1 1 363.417 4.457 20 5 FIBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000089909914 1116351986 /nfs/dbraw/zinc/35/19/86/1116351986.db2.gz NFJULJVCPGNJHT-MSOLQXFVSA-N 1 1 371.437 4.029 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@H]3C3CCOCC3)cs2)c1 ZINC000539670264 1116363615 /nfs/dbraw/zinc/36/36/15/1116363615.db2.gz SJEYWXCZMDZXJS-SFHVURJKSA-N 1 1 373.478 4.109 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCCc2nc(C)sc21 ZINC000539830516 1116387897 /nfs/dbraw/zinc/38/78/97/1116387897.db2.gz BKPQQMAWJPHNIZ-MRXNPFEDSA-N 1 1 361.467 4.268 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCCc2nc(C)sc21 ZINC000539830516 1116387899 /nfs/dbraw/zinc/38/78/99/1116387899.db2.gz BKPQQMAWJPHNIZ-MRXNPFEDSA-N 1 1 361.467 4.268 20 5 FIBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@H]1CCC[C@H]1O ZINC000539912642 1117749882 /nfs/dbraw/zinc/74/98/82/1117749882.db2.gz FFFUGWPMAHLDCP-DNVCBOLYSA-N 1 1 374.412 4.119 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462789374 1117773324 /nfs/dbraw/zinc/77/33/24/1117773324.db2.gz IYHHYHFNRIRRKV-ZDUSSCGKSA-N 1 1 357.401 4.263 20 5 FIBDMO C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000540366122 1118017158 /nfs/dbraw/zinc/01/71/58/1118017158.db2.gz NEYKQDZDEBRJBD-CYBMUJFWSA-N 1 1 370.384 4.111 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccc(F)cc1F)C(C)C ZINC000540427157 1118051291 /nfs/dbraw/zinc/05/12/91/1118051291.db2.gz SDWZGARFZLOEHQ-SFHVURJKSA-N 1 1 350.365 4.369 20 5 FIBDMO CC(C)COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1c([N+](=O)[O-])ncn1C ZINC000540475558 1118077946 /nfs/dbraw/zinc/07/79/46/1118077946.db2.gz OWGKTGXTWVGGEL-KRWDZBQOSA-N 1 1 374.485 4.240 20 5 FIBDMO Cc1ccc([C@@H]2CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3C)C2)cc1 ZINC000541390866 1118491832 /nfs/dbraw/zinc/49/18/32/1118491832.db2.gz VSRIJUJSQQZJKX-GOSISDBHSA-N 1 1 367.449 4.030 20 5 FIBDMO Cc1ccccc1NC(=O)CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000174710026 1118630647 /nfs/dbraw/zinc/63/06/47/1118630647.db2.gz JSPHGFDJKPMTJX-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO Cc1ccccc1NC(=O)CC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000174710026 1118630651 /nfs/dbraw/zinc/63/06/51/1118630651.db2.gz JSPHGFDJKPMTJX-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1cccc2c1OCCO2 ZINC000541773208 1118645352 /nfs/dbraw/zinc/64/53/52/1118645352.db2.gz RYLFPSSGZGQSIR-SFHVURJKSA-N 1 1 354.406 4.012 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cc(Br)cs1 ZINC000541772983 1118645748 /nfs/dbraw/zinc/64/57/48/1118645748.db2.gz LOIZSFIRQPHWHS-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cc(Br)cs1 ZINC000541772983 1118645752 /nfs/dbraw/zinc/64/57/52/1118645752.db2.gz LOIZSFIRQPHWHS-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000464761510 1118684538 /nfs/dbraw/zinc/68/45/38/1118684538.db2.gz FEXLDYGEPTZLLS-OAHLLOKOSA-N 1 1 358.463 4.218 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000464858893 1118726638 /nfs/dbraw/zinc/72/66/38/1118726638.db2.gz XEMYLJGEDXUHOU-KBXCAEBGSA-N 1 1 371.437 4.298 20 5 FIBDMO Cc1cc(C)c(NC(=O)C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000271701805 1118732294 /nfs/dbraw/zinc/73/22/94/1118732294.db2.gz HOEANNBCOOZSRQ-ZDUSSCGKSA-N 1 1 361.829 4.154 20 5 FIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H](CCO)c1ccccc1 ZINC000549861110 1118944398 /nfs/dbraw/zinc/94/43/98/1118944398.db2.gz ZJKDIOAURIMJNW-KRWDZBQOSA-N 1 1 368.355 4.169 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000492107335 1119025588 /nfs/dbraw/zinc/02/55/88/1119025588.db2.gz OZWAORLIDUTWPQ-ZNMIVQPWSA-N 1 1 351.878 4.085 20 5 FIBDMO COc1cc(C[NH2+][C@H]2CCCc3sc(Cl)cc32)c([N+](=O)[O-])cc1O ZINC000492243917 1119053998 /nfs/dbraw/zinc/05/39/98/1119053998.db2.gz YBYFXGBZKTUJRV-NSHDSACASA-N 1 1 368.842 4.191 20 5 FIBDMO CCOc1cc(C[N@@H+](C)Cc2ccc(OC(F)F)cc2)ccc1[N+](=O)[O-] ZINC000492357096 1119077610 /nfs/dbraw/zinc/07/76/10/1119077610.db2.gz MJTGZHOWLFRHQX-UHFFFAOYSA-N 1 1 366.364 4.227 20 5 FIBDMO CCOc1cc(C[N@H+]2CC[C@H](COCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492766554 1119183071 /nfs/dbraw/zinc/18/30/71/1119183071.db2.gz FZGAEDHPUBRCEN-IBGZPJMESA-N 1 1 370.449 4.032 20 5 FIBDMO CCOc1cc(C[N@H+]2CC[C@@H](COCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492766559 1119183121 /nfs/dbraw/zinc/18/31/21/1119183121.db2.gz FZGAEDHPUBRCEN-LJQANCHMSA-N 1 1 370.449 4.032 20 5 FIBDMO C[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1Cc1ccccc1 ZINC000761524524 1119411599 /nfs/dbraw/zinc/41/15/99/1119411599.db2.gz FKDVVUXMIIPQJG-CRAIPNDOSA-N 1 1 373.884 4.391 20 5 FIBDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCN1Cc1ccccc1 ZINC000761524524 1119411602 /nfs/dbraw/zinc/41/16/02/1119411602.db2.gz FKDVVUXMIIPQJG-CRAIPNDOSA-N 1 1 373.884 4.391 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000609193593 1119840892 /nfs/dbraw/zinc/84/08/92/1119840892.db2.gz VCZHXMZMUQYORH-UHFFFAOYSA-N 1 1 368.433 4.377 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC=C(c2ccc(O)cc2)CC1 ZINC000609193593 1119840897 /nfs/dbraw/zinc/84/08/97/1119840897.db2.gz VCZHXMZMUQYORH-UHFFFAOYSA-N 1 1 368.433 4.377 20 5 FIBDMO CCCOc1ncccc1C[NH2+][C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000153212778 1120473358 /nfs/dbraw/zinc/47/33/58/1120473358.db2.gz ZQIAWGKEAIOLEG-CQSZACIVSA-N 1 1 359.426 4.028 20 5 FIBDMO Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000495412556 1120788620 /nfs/dbraw/zinc/78/86/20/1120788620.db2.gz BJAAFBUAEYKWDY-GHMZBOCLSA-N 1 1 370.375 4.382 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@H](CCOC)c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000495425619 1120801144 /nfs/dbraw/zinc/80/11/44/1120801144.db2.gz DEPZTSGYQVUMFV-GOEBONIOSA-N 1 1 362.426 4.323 20 5 FIBDMO Cc1c([C@H](C)N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000495440341 1120823969 /nfs/dbraw/zinc/82/39/69/1120823969.db2.gz RGBQZMXLZXTEOF-CMKODMSKSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1c([C@H](C)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000495440341 1120823981 /nfs/dbraw/zinc/82/39/81/1120823981.db2.gz RGBQZMXLZXTEOF-CMKODMSKSA-N 1 1 367.493 4.464 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2COc2ccc(Cl)cc2)cs1 ZINC000917394838 1122286560 /nfs/dbraw/zinc/28/65/60/1122286560.db2.gz RDWLUXVYXXLWDU-AWEZNQCLSA-N 1 1 352.843 4.353 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2COc2ccc(Cl)cc2)cs1 ZINC000917394838 1122286566 /nfs/dbraw/zinc/28/65/66/1122286566.db2.gz RDWLUXVYXXLWDU-AWEZNQCLSA-N 1 1 352.843 4.353 20 5 FIBDMO C[C@@H]1[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC12CCOCC2 ZINC000542708869 1122313566 /nfs/dbraw/zinc/31/35/66/1122313566.db2.gz WNRCRGDSQMXCFO-HNNXBMFYSA-N 1 1 356.422 4.246 20 5 FIBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc3cc([N+](=O)[O-])ccc3n2)c1 ZINC000301221780 1123396084 /nfs/dbraw/zinc/39/60/84/1123396084.db2.gz CHIKTZOZISTCTA-UHFFFAOYSA-N 1 1 350.422 4.207 20 5 FIBDMO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000609625730 1123773707 /nfs/dbraw/zinc/77/37/07/1123773707.db2.gz VDYNMAWRLJEVDV-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000609625730 1123773710 /nfs/dbraw/zinc/77/37/10/1123773710.db2.gz VDYNMAWRLJEVDV-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCS[C@@H](c3ccccc3)C2)cc1 ZINC000609800966 1123839858 /nfs/dbraw/zinc/83/98/58/1123839858.db2.gz YCNJHRSWIWOITO-LJQANCHMSA-N 1 1 358.463 4.154 20 5 FIBDMO C[C@@H]1C[C@H](N(C)c2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000609964790 1123898753 /nfs/dbraw/zinc/89/87/53/1123898753.db2.gz MDICQIURRBAQBO-CRAIPNDOSA-N 1 1 357.429 4.223 20 5 FIBDMO C[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000237594567 1123990759 /nfs/dbraw/zinc/99/07/59/1123990759.db2.gz QOBBJNRDNFQZPX-CRAIPNDOSA-N 1 1 373.884 4.391 20 5 FIBDMO CN1Cc2ccccc2[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000542776807 1124256822 /nfs/dbraw/zinc/25/68/22/1124256822.db2.gz JONINFBGUWVVJT-GOTSBHOMSA-N 1 1 373.456 4.461 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1OCC ZINC000181387690 1124899079 /nfs/dbraw/zinc/89/90/79/1124899079.db2.gz DTHURVPVOACBEP-CYBMUJFWSA-N 1 1 362.401 4.382 20 5 FIBDMO CCOc1cccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000113322959 1125151151 /nfs/dbraw/zinc/15/11/51/1125151151.db2.gz RZQHAKUQIINPQX-UHFFFAOYSA-N 1 1 369.446 4.407 20 5 FIBDMO C[C@H](N[C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311820346 1125228128 /nfs/dbraw/zinc/22/81/28/1125228128.db2.gz NDAOMRMOJOKZFD-ABSDTBQOSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H](N[C@@H](C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311820346 1125228134 /nfs/dbraw/zinc/22/81/34/1125228134.db2.gz NDAOMRMOJOKZFD-ABSDTBQOSA-N 1 1 353.466 4.156 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000067962385 221309720 /nfs/dbraw/zinc/30/97/20/221309720.db2.gz XTTAMLXZNGPOCJ-IBGZPJMESA-N 1 1 371.412 4.208 20 5 FIBDMO Cc1cccc([C@H]2CC[N@H+]([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC000569386201 568400090 /nfs/dbraw/zinc/40/00/90/568400090.db2.gz WFRQKJITAOBGRX-AEFFLSMTSA-N 1 1 367.449 4.028 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)c(Cl)c1 ZINC000619722732 1125668018 /nfs/dbraw/zinc/66/80/18/1125668018.db2.gz XFYXHOMCMVMHOK-HNNXBMFYSA-N 1 1 374.872 4.161 20 5 FIBDMO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000182927268 1125685348 /nfs/dbraw/zinc/68/53/48/1125685348.db2.gz XGYVUIXNCHIKRA-AWEZNQCLSA-N 1 1 352.394 4.112 20 5 FIBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1c(F)cccc1[N+](=O)[O-] ZINC000619783845 1125696127 /nfs/dbraw/zinc/69/61/27/1125696127.db2.gz LVKJPVGRODWGHU-HXUWFJFHSA-N 1 1 371.456 4.124 20 5 FIBDMO CC[C@@H]1CC[N@@H+]1Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000430192441 1079820025 /nfs/dbraw/zinc/82/00/25/1079820025.db2.gz CBFXEQVTUXXBTB-QGZVFWFLSA-N 1 1 356.422 4.167 20 5 FIBDMO CC[C@@H]1CC[N@H+]1Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000430192441 1079820037 /nfs/dbraw/zinc/82/00/37/1079820037.db2.gz CBFXEQVTUXXBTB-QGZVFWFLSA-N 1 1 356.422 4.167 20 5 FIBDMO COc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430210382 1079963852 /nfs/dbraw/zinc/96/38/52/1079963852.db2.gz DBFWJJAZBKVKMM-SFHVURJKSA-N 1 1 358.438 4.489 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2CCc2ccccc2)c([N+](=O)[O-])cc1F ZINC001167069509 1079984294 /nfs/dbraw/zinc/98/42/94/1079984294.db2.gz CARWAXIOTXOCTH-KRWDZBQOSA-N 1 1 358.413 4.340 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccccc1OC(F)F ZINC000430230848 1080042897 /nfs/dbraw/zinc/04/28/97/1080042897.db2.gz ZPNWLBJPQHHMCF-LLVKDONJSA-N 1 1 352.337 4.056 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCN(c2ccc3ccccc3n2)CC1 ZINC000471193208 1080205514 /nfs/dbraw/zinc/20/55/14/1080205514.db2.gz BOWLSAJOZFMJJI-INIZCTEOSA-N 1 1 362.433 4.026 20 5 FIBDMO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609193142 1080293170 /nfs/dbraw/zinc/29/31/70/1080293170.db2.gz LYBAQNWASPOPJQ-UHFFFAOYSA-N 1 1 358.438 4.413 20 5 FIBDMO CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609193142 1080293174 /nfs/dbraw/zinc/29/31/74/1080293174.db2.gz LYBAQNWASPOPJQ-UHFFFAOYSA-N 1 1 358.438 4.413 20 5 FIBDMO COc1cc(C[N@@H+](CCc2ccccc2)CC(C)C)c([N+](=O)[O-])cc1F ZINC001167193345 1080820256 /nfs/dbraw/zinc/82/02/56/1080820256.db2.gz VOCJOLKOWPRYLY-UHFFFAOYSA-N 1 1 360.429 4.443 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(C4CCCC4)CC3)n2)c1 ZINC000610370858 1081554650 /nfs/dbraw/zinc/55/46/50/1081554650.db2.gz QIXZPSOYUDLTRH-UHFFFAOYSA-N 1 1 356.426 4.047 20 5 FIBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001167406751 1081963515 /nfs/dbraw/zinc/96/35/15/1081963515.db2.gz VLKYRXGSBGYNCV-CQSZACIVSA-N 1 1 364.833 4.309 20 5 FIBDMO O=[N+]([O-])c1sccc1N1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000610469428 1082562873 /nfs/dbraw/zinc/56/28/73/1082562873.db2.gz ODPYIZKIKSEFAP-LJQANCHMSA-N 1 1 357.479 4.149 20 5 FIBDMO CC(C)C[C@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000119362310 1082600027 /nfs/dbraw/zinc/60/00/27/1082600027.db2.gz CIBVFPHXWYPYTA-LSDHHAIUSA-N 1 1 358.442 4.464 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510473140 1082966481 /nfs/dbraw/zinc/96/64/81/1082966481.db2.gz PSOOYRPPTNTGGI-CRAIPNDOSA-N 1 1 350.422 4.261 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCC[C@H]3Cc3ccccc3)nc2c1 ZINC000610581514 1083207162 /nfs/dbraw/zinc/20/71/62/1083207162.db2.gz OQXOCCXVUMVIKE-INIZCTEOSA-N 1 1 351.406 4.333 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CCC[C@H]2OCc2ccccc2)c(F)c1 ZINC000510632681 1083213535 /nfs/dbraw/zinc/21/35/35/1083213535.db2.gz WPPPTMGZROTUHY-RTBURBONSA-N 1 1 362.376 4.101 20 5 FIBDMO Cc1ccc(C[C@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000610581804 1083214257 /nfs/dbraw/zinc/21/42/57/1083214257.db2.gz NVMQDVWGQKQDEZ-MRXNPFEDSA-N 1 1 351.406 4.252 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 ZINC000610604870 1083260543 /nfs/dbraw/zinc/26/05/43/1083260543.db2.gz QEPXNZDZEVIXHO-MIMYLULJSA-N 1 1 356.266 4.328 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCS[C@H]4CCCC[C@H]43)o2)c1 ZINC000610619586 1083265470 /nfs/dbraw/zinc/26/54/70/1083265470.db2.gz HHJYRIRJLXNVRP-AEFFLSMTSA-N 1 1 373.478 4.152 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]2CCO[C@@H]2c2ccc(Cl)cc2)c(F)c1 ZINC000510799923 1083317201 /nfs/dbraw/zinc/31/72/01/1083317201.db2.gz XKUZTTWESFONBT-DLBZAZTESA-N 1 1 368.767 4.146 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000177159872 1083689118 /nfs/dbraw/zinc/68/91/18/1083689118.db2.gz ZJQXLGMSFTVWBJ-LJQANCHMSA-N 1 1 370.380 4.063 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](Cc1ccccc1)C[C@@H](O)c1ccco1 ZINC000177159872 1083689120 /nfs/dbraw/zinc/68/91/20/1083689120.db2.gz ZJQXLGMSFTVWBJ-LJQANCHMSA-N 1 1 370.380 4.063 20 5 FIBDMO Cc1c([C@H](C)[NH2+]C[C@H]2CCCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805890 1083717608 /nfs/dbraw/zinc/71/76/08/1083717608.db2.gz OCXGRIAPPBFCJH-AZUAARDMSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c([C@H](C)NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805890 1083717622 /nfs/dbraw/zinc/71/76/22/1083717622.db2.gz OCXGRIAPPBFCJH-AZUAARDMSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c([C@H](C)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805890 1083717631 /nfs/dbraw/zinc/71/76/31/1083717631.db2.gz OCXGRIAPPBFCJH-AZUAARDMSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000610805871 1083718414 /nfs/dbraw/zinc/71/84/14/1083718414.db2.gz HDNZQVZRVRWYIP-ICSRJNTNSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000610805871 1083718423 /nfs/dbraw/zinc/71/84/23/1083718423.db2.gz HDNZQVZRVRWYIP-ICSRJNTNSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000610805871 1083718432 /nfs/dbraw/zinc/71/84/32/1083718432.db2.gz HDNZQVZRVRWYIP-ICSRJNTNSA-N 1 1 367.493 4.466 20 5 FIBDMO Cn1nc(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c2ccccc21 ZINC000612692121 1083989132 /nfs/dbraw/zinc/98/91/32/1083989132.db2.gz YHVOOOMQBOIPIK-UHFFFAOYSA-N 1 1 362.389 4.031 20 5 FIBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)c3c(F)cccc3[N+](=O)[O-])c2C1 ZINC001125799779 1084016111 /nfs/dbraw/zinc/01/61/11/1084016111.db2.gz OYUPFPTUVFCXST-UHFFFAOYSA-N 1 1 371.412 4.348 20 5 FIBDMO Cc1ccc(C[NH2+][C@@H]2CCCc3cn(C4CCCC4)nc32)cc1[N+](=O)[O-] ZINC000611560920 1084092166 /nfs/dbraw/zinc/09/21/66/1084092166.db2.gz KZUOFJLDHNOJSM-GOSISDBHSA-N 1 1 354.454 4.382 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cnc(C3CC3)s2)cc(C(F)(F)F)c1 ZINC000581286188 1084536205 /nfs/dbraw/zinc/53/62/05/1084536205.db2.gz RGTMWMBFMUEOGF-UHFFFAOYSA-N 1 1 357.357 4.237 20 5 FIBDMO COc1cc(N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000381226682 1084637446 /nfs/dbraw/zinc/63/74/46/1084637446.db2.gz XGCRAGMZDYOZJN-GOEBONIOSA-N 1 1 373.428 4.065 20 5 FIBDMO COCCSc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000611389593 1084708671 /nfs/dbraw/zinc/70/86/71/1084708671.db2.gz GICFFROLJZCPEM-CYBMUJFWSA-N 1 1 364.442 4.323 20 5 FIBDMO O=[N+]([O-])c1cccc([C@H]([NH2+]Cc2ccc(CO)c(F)c2)c2ccccc2)c1 ZINC000180219970 1084907144 /nfs/dbraw/zinc/90/71/44/1084907144.db2.gz JDFFWKHDMYJJKJ-OAQYLSRUSA-N 1 1 366.392 4.105 20 5 FIBDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1C ZINC000511127281 1085017419 /nfs/dbraw/zinc/01/74/19/1085017419.db2.gz UOIOQOCHPLMADW-HXUWFJFHSA-N 1 1 368.433 4.415 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H]2c3ccc(F)cc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000562059935 1085052640 /nfs/dbraw/zinc/05/26/40/1085052640.db2.gz RMVDYYWYPZLKDD-CRTZDJKQSA-N 1 1 360.385 4.305 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2c(F)cccc2F)n1 ZINC000511142532 1085079404 /nfs/dbraw/zinc/07/94/04/1085079404.db2.gz YSSDJNYVTLGNOG-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2c(F)cccc2F)n1 ZINC000511142532 1085079413 /nfs/dbraw/zinc/07/94/13/1085079413.db2.gz YSSDJNYVTLGNOG-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO Cc1cc(CNc2ccnc3c2cccc3[N+](=O)[O-])cc(N2CCCC2)[nH+]1 ZINC000432180343 1085136454 /nfs/dbraw/zinc/13/64/54/1085136454.db2.gz VOGGGFASHJTLGH-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCN(c2ccccc2)C1 ZINC001167586224 1085183406 /nfs/dbraw/zinc/18/34/06/1085183406.db2.gz JCXAVPXIZMXJCP-SFHVURJKSA-N 1 1 359.857 4.349 20 5 FIBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H](C)Cc1ccsc1 ZINC000187796287 1085537235 /nfs/dbraw/zinc/53/72/35/1085537235.db2.gz FNLPERGPXVCHFV-ZDUSSCGKSA-N 1 1 372.450 4.159 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000024673536 1085691524 /nfs/dbraw/zinc/69/15/24/1085691524.db2.gz ZJPMORFAJGUCGU-INIZCTEOSA-N 1 1 367.449 4.142 20 5 FIBDMO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000111177065 1085713305 /nfs/dbraw/zinc/71/33/05/1085713305.db2.gz ZJGKKKLRDZPFAJ-OAHLLOKOSA-N 1 1 354.454 4.142 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+](C)C3CCC(OC)CC3)o2)c([N+](=O)[O-])c1 ZINC000093415022 1085784332 /nfs/dbraw/zinc/78/43/32/1085784332.db2.gz YKDQJUNWMAXJMX-UHFFFAOYSA-N 1 1 374.437 4.253 20 5 FIBDMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@@H]1c1ccccc1 ZINC000582878291 1085869388 /nfs/dbraw/zinc/86/93/88/1085869388.db2.gz OTKHWMIMVJSMJG-UZLBHIALSA-N 1 1 367.449 4.049 20 5 FIBDMO Cc1nc2ccccc2n1C[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000535963206 1086413629 /nfs/dbraw/zinc/41/36/29/1086413629.db2.gz KBCCVYAFUINRKT-SFHVURJKSA-N 1 1 364.449 4.226 20 5 FIBDMO C[C@@H](CNc1ccnc2c1cccc2[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000432314461 1086504451 /nfs/dbraw/zinc/50/44/51/1086504451.db2.gz QQEFPHKATBKJAU-ZDUSSCGKSA-N 1 1 368.462 4.063 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000110125609 1086508694 /nfs/dbraw/zinc/50/86/94/1086508694.db2.gz XYXQQRQHGVSLNZ-MRXNPFEDSA-N 1 1 369.465 4.316 20 5 FIBDMO COc1ccc(C[N@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)cc1C ZINC000728560409 1086509116 /nfs/dbraw/zinc/50/91/16/1086509116.db2.gz QSFOEPLMPFMVCU-UHFFFAOYSA-N 1 1 373.434 4.279 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cn2c3cc([N+](=O)[O-])ccc3oc2=S)cc1C ZINC000728560409 1086509128 /nfs/dbraw/zinc/50/91/28/1086509128.db2.gz QSFOEPLMPFMVCU-UHFFFAOYSA-N 1 1 373.434 4.279 20 5 FIBDMO CC(=O)c1ccc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000052467187 1086861778 /nfs/dbraw/zinc/86/17/78/1086861778.db2.gz HVYKDSYVWIWPEB-UHFFFAOYSA-N 1 1 371.412 4.013 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC2)OCc2ccccc23)c(Cl)c1 ZINC000611787960 1086963069 /nfs/dbraw/zinc/96/30/69/1086963069.db2.gz MCVMWBXVDRMXLF-UHFFFAOYSA-N 1 1 358.825 4.270 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](CN2CCCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000480282596 1087331271 /nfs/dbraw/zinc/33/12/71/1087331271.db2.gz XLMXYIKAELHJDX-XLIONFOSSA-N 1 1 353.466 4.391 20 5 FIBDMO CCc1cccc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000064350500 1087331298 /nfs/dbraw/zinc/33/12/98/1087331298.db2.gz KXXDYFBCHOSNNA-UHFFFAOYSA-N 1 1 355.438 4.006 20 5 FIBDMO CCc1cccc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000064350500 1087331304 /nfs/dbraw/zinc/33/13/04/1087331304.db2.gz KXXDYFBCHOSNNA-UHFFFAOYSA-N 1 1 355.438 4.006 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(CCCn2ccnc2)CC1 ZINC000542133746 1088244983 /nfs/dbraw/zinc/24/49/83/1088244983.db2.gz ZYSKTBSEYUPHEX-UHFFFAOYSA-N 1 1 362.861 4.137 20 5 FIBDMO Cc1[nH+]ccn1CCCN(C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000178931185 1088719717 /nfs/dbraw/zinc/71/97/17/1088719717.db2.gz PCKBRDZNLMHCID-UHFFFAOYSA-N 1 1 358.445 4.055 20 5 FIBDMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C(c3ccccc3)c3ccccc3)C2)nc1 ZINC000514085612 1088726574 /nfs/dbraw/zinc/72/65/74/1088726574.db2.gz YNQIDVWWYAJXMX-IBGZPJMESA-N 1 1 374.444 4.266 20 5 FIBDMO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000435380623 1089585710 /nfs/dbraw/zinc/58/57/10/1089585710.db2.gz RYSHYHPMUJUBJA-YIONKMFJSA-N 1 1 357.479 4.038 20 5 FIBDMO CC(C)CC[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000472834887 1089699181 /nfs/dbraw/zinc/69/91/81/1089699181.db2.gz QFMNBKMGBREDFF-INIZCTEOSA-N 1 1 358.442 4.436 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H](CN1CCCC1)c1ccccc1 ZINC000515072348 1089772644 /nfs/dbraw/zinc/77/26/44/1089772644.db2.gz JFNYBMXVMDLFFB-VQTJNVASSA-N 1 1 351.450 4.009 20 5 FIBDMO CCC[N@@H+]1CC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236808858 1089929359 /nfs/dbraw/zinc/92/93/59/1089929359.db2.gz BGKGWZKBZYCYGA-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CCC[N@H+]1CC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236808858 1089929362 /nfs/dbraw/zinc/92/93/62/1089929362.db2.gz BGKGWZKBZYCYGA-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015171 1089975460 /nfs/dbraw/zinc/97/54/60/1089975460.db2.gz SWSULRIABIVZIX-HKUYNNGSSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H](NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015171 1089975463 /nfs/dbraw/zinc/97/54/63/1089975463.db2.gz SWSULRIABIVZIX-HKUYNNGSSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H]([NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015171 1089975467 /nfs/dbraw/zinc/97/54/67/1089975467.db2.gz SWSULRIABIVZIX-HKUYNNGSSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015178 1090035129 /nfs/dbraw/zinc/03/51/29/1090035129.db2.gz SWSULRIABIVZIX-MJGOQNOKSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H](NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015178 1090035142 /nfs/dbraw/zinc/03/51/42/1090035142.db2.gz SWSULRIABIVZIX-MJGOQNOKSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@@H]([NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000312015178 1090035155 /nfs/dbraw/zinc/03/51/55/1090035155.db2.gz SWSULRIABIVZIX-MJGOQNOKSA-N 1 1 353.466 4.158 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CC[C@@H](c3ccccc3)O2)C2CC2)c1 ZINC001167733822 1090265632 /nfs/dbraw/zinc/26/56/32/1090265632.db2.gz DPRXKLRFLYDXOI-SFTDATJTSA-N 1 1 352.434 4.480 20 5 FIBDMO Cc1ccc2[nH]c(C[NH2+][C@H]3CCCCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000417317579 1090799091 /nfs/dbraw/zinc/79/90/91/1090799091.db2.gz WYSAUGHNBHDGPV-KRWDZBQOSA-N 1 1 350.422 4.337 20 5 FIBDMO Cc1ccc2nc(C[NH2+][C@H]3CCCCc4ccc([N+](=O)[O-])cc43)[nH]c2c1 ZINC000417317579 1090799099 /nfs/dbraw/zinc/79/90/99/1090799099.db2.gz WYSAUGHNBHDGPV-KRWDZBQOSA-N 1 1 350.422 4.337 20 5 FIBDMO O=C(CC[N@H+]1CC[C@H](c2ccc(Cl)cc2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000500066237 1091017220 /nfs/dbraw/zinc/01/72/20/1091017220.db2.gz FWAUOQWSUVALEY-HNNXBMFYSA-N 1 1 373.840 4.066 20 5 FIBDMO Cc1ccc([C@H]2C[C@H](C)CC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])o1 ZINC000500098158 1091037358 /nfs/dbraw/zinc/03/73/58/1091037358.db2.gz OOJQGVDENZEYAA-RDTXWAMCSA-N 1 1 371.437 4.298 20 5 FIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500099849 1091037663 /nfs/dbraw/zinc/03/76/63/1091037663.db2.gz VGBLFXRSFBSNFT-LIRRHRJNSA-N 1 1 371.412 4.146 20 5 FIBDMO O=C(CC[N@H+]1CCCCC[C@@H]1c1ccco1)Nc1ccccc1[N+](=O)[O-] ZINC000500111178 1091045894 /nfs/dbraw/zinc/04/58/94/1091045894.db2.gz ANDMICDYBFEMDW-QGZVFWFLSA-N 1 1 357.410 4.134 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc(Br)n1 ZINC000925693662 1091408635 /nfs/dbraw/zinc/40/86/35/1091408635.db2.gz QNLNMCNNTKNZNE-WDEREUQCSA-N 1 1 350.216 4.164 20 5 FIBDMO CCN1CCN([C@H](C)C[NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000236849438 1091938768 /nfs/dbraw/zinc/93/87/68/1091938768.db2.gz ZHYKMHIZJHUAQD-LJQANCHMSA-N 1 1 361.533 4.109 20 5 FIBDMO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000520879821 1092324312 /nfs/dbraw/zinc/32/43/12/1092324312.db2.gz TYUUECRFABXOQN-XCLFUZPHSA-N 1 1 350.374 4.467 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC4(CCC4)[C@@H]3[C@H]3CCCO3)o2)c1 ZINC000572688800 1092533978 /nfs/dbraw/zinc/53/39/78/1092533978.db2.gz AWUGWCAWHDOHLI-UXHICEINSA-N 1 1 368.433 4.388 20 5 FIBDMO CCOc1ccc(C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C(C)C)cc1 ZINC000521196470 1092573554 /nfs/dbraw/zinc/57/35/54/1092573554.db2.gz ITDMPIBGDUWOOI-UHFFFAOYSA-N 1 1 358.438 4.413 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000549810407 1092801430 /nfs/dbraw/zinc/80/14/30/1092801430.db2.gz LBGMLYONXJYMDA-UHFFFAOYSA-N 1 1 370.840 4.313 20 5 FIBDMO CN(C)Cc1cc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)ccc1F ZINC000433118197 1093277081 /nfs/dbraw/zinc/27/70/81/1093277081.db2.gz RETGRCWXTDTVQJ-FQEVSTJZSA-N 1 1 371.456 4.308 20 5 FIBDMO CC1(C)C[C@H]([NH2+]Cc2ccn(C3CCCC3)n2)c2cc([N+](=O)[O-])ccc21 ZINC000433296293 1093562761 /nfs/dbraw/zinc/56/27/61/1093562761.db2.gz RXSYAAIBTKBIIW-IBGZPJMESA-N 1 1 354.454 4.419 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000397991353 1093799439 /nfs/dbraw/zinc/79/94/39/1093799439.db2.gz ASGUQIKSZWTBSC-WFXMLNOXSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000397991353 1093799446 /nfs/dbraw/zinc/79/94/46/1093799446.db2.gz ASGUQIKSZWTBSC-WFXMLNOXSA-N 1 1 367.493 4.464 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1c1cccc2c1OCCO2 ZINC000513124095 1093861847 /nfs/dbraw/zinc/86/18/47/1093861847.db2.gz ZFSVLBQLXAPVHB-QTWIXLPOSA-N 1 1 366.417 4.216 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cc(Br)cs1 ZINC000404175075 1093899005 /nfs/dbraw/zinc/89/90/05/1093899005.db2.gz HHPRNBABFARAPQ-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO Cc1c(C[NH2+]Cc2ccc(Sc3ccccn3)o2)cccc1[N+](=O)[O-] ZINC000513174622 1093995811 /nfs/dbraw/zinc/99/58/11/1093995811.db2.gz WRLOGNVSEZKRDT-UHFFFAOYSA-N 1 1 355.419 4.332 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513247152 1094034403 /nfs/dbraw/zinc/03/44/03/1094034403.db2.gz KLJNWGKVBREEKH-FOIQADDNSA-N 1 1 367.449 4.315 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000513256908 1094039764 /nfs/dbraw/zinc/03/97/64/1094039764.db2.gz OKOGUIDEMRCSBI-KBXCAEBGSA-N 1 1 364.405 4.228 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000513440870 1094127372 /nfs/dbraw/zinc/12/73/72/1094127372.db2.gz YLELTWYYFXKICZ-SVEBXFOSSA-N 1 1 352.390 4.174 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N(C)C)cc1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182743795 1094165010 /nfs/dbraw/zinc/16/50/10/1094165010.db2.gz IBAAJLVCJFZQBN-MRXNPFEDSA-N 1 1 369.465 4.188 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430016055 1094188091 /nfs/dbraw/zinc/18/80/91/1094188091.db2.gz DHMQSTNDLYWYCO-BJMVGYQFSA-N 1 1 354.303 4.344 20 5 FIBDMO COCc1ccccc1/C=C(/C)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000513552676 1094209974 /nfs/dbraw/zinc/20/99/74/1094209974.db2.gz CXUADBBUVCGBNI-LGMDPLHJSA-N 1 1 354.450 4.319 20 5 FIBDMO O=C(CC[N@H+]1CCC[C@H]1/C=C/c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000500989009 1094403887 /nfs/dbraw/zinc/40/38/87/1094403887.db2.gz JVSCMJRPDACMND-HHNLSAEISA-N 1 1 365.433 4.101 20 5 FIBDMO CC[C@@H]([NH2+][C@@H](c1cnn(C)c1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000366679740 1095081290 /nfs/dbraw/zinc/08/12/90/1095081290.db2.gz OARPXBACMUNQIB-WOJBJXKFSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cn1 ZINC000281318339 1095526469 /nfs/dbraw/zinc/52/64/69/1095526469.db2.gz ZQKMRTDGSMXQHW-RYUDHWBXSA-N 1 1 364.243 4.473 20 5 FIBDMO CC(C)[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(F)cc1 ZINC000502545011 1095570661 /nfs/dbraw/zinc/57/06/61/1095570661.db2.gz VZMCALLTYHIQNG-GOSISDBHSA-N 1 1 370.384 4.271 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000503253183 1096330903 /nfs/dbraw/zinc/33/09/03/1096330903.db2.gz ATUCNWUGZZNZON-DLBZAZTESA-N 1 1 369.465 4.116 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000503253183 1096330910 /nfs/dbraw/zinc/33/09/10/1096330910.db2.gz ATUCNWUGZZNZON-DLBZAZTESA-N 1 1 369.465 4.116 20 5 FIBDMO COc1ccccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@H]1CCCO1 ZINC000515546369 1098686588 /nfs/dbraw/zinc/68/65/88/1098686588.db2.gz PZQFGKNEQYDFGN-LJQANCHMSA-N 1 1 370.449 4.093 20 5 FIBDMO COc1ccccc1C[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@H]1CCCO1 ZINC000515546369 1098686601 /nfs/dbraw/zinc/68/66/01/1098686601.db2.gz PZQFGKNEQYDFGN-LJQANCHMSA-N 1 1 370.449 4.093 20 5 FIBDMO Cc1cc(NCc2ccccc2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000515550465 1098692342 /nfs/dbraw/zinc/69/23/42/1098692342.db2.gz SOTYIHOMBTXDSO-CALCHBBNSA-N 1 1 369.465 4.125 20 5 FIBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000533290857 1098940378 /nfs/dbraw/zinc/94/03/78/1098940378.db2.gz SYNAJCITDRVXRZ-SOLBZPMBSA-N 1 1 367.449 4.047 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCc2ccccn2)Cc2ccc(F)cc2)cc1 ZINC000533368559 1099002094 /nfs/dbraw/zinc/00/20/94/1099002094.db2.gz QWYJPRVTKMKTIG-UHFFFAOYSA-N 1 1 365.408 4.374 20 5 FIBDMO CC[N@@H+](CCc1cccs1)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000533397815 1099007607 /nfs/dbraw/zinc/00/76/07/1099007607.db2.gz CGPNEKBTXBYOPE-UHFFFAOYSA-N 1 1 371.462 4.418 20 5 FIBDMO C[C@@H]1CN(C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000516814883 1099824076 /nfs/dbraw/zinc/82/40/76/1099824076.db2.gz JAVIPOMJYVCKRC-RDTXWAMCSA-N 1 1 359.495 4.095 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1)C1CC1 ZINC000508767973 1100044749 /nfs/dbraw/zinc/04/47/49/1100044749.db2.gz DLQHDTIJMHQCNA-UHFFFAOYSA-N 1 1 353.422 4.140 20 5 FIBDMO Cc1noc(C)c1C[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000517549758 1100474715 /nfs/dbraw/zinc/47/47/15/1100474715.db2.gz KZNHDJCPUKXZIQ-UHFFFAOYSA-N 1 1 366.421 4.257 20 5 FIBDMO CCC1(CC)CC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438495587 1100697459 /nfs/dbraw/zinc/69/74/59/1100697459.db2.gz RFGBXFPOXIPZDF-LBPRGKRZSA-N 1 1 353.850 4.087 20 5 FIBDMO CCC1(CC)CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000438495587 1100697460 /nfs/dbraw/zinc/69/74/60/1100697460.db2.gz RFGBXFPOXIPZDF-LBPRGKRZSA-N 1 1 353.850 4.087 20 5 FIBDMO COCC[N@@H+](C)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000506351944 1100908416 /nfs/dbraw/zinc/90/84/16/1100908416.db2.gz BZZKIPXFTKIOQF-UHFFFAOYSA-N 1 1 350.802 4.119 20 5 FIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H](C)c1cccc(O)c1 ZINC000509557159 1100941412 /nfs/dbraw/zinc/94/14/12/1100941412.db2.gz LVKXVXWVWIONBS-LBPRGKRZSA-N 1 1 366.364 4.485 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H](C)c1cccc(O)c1 ZINC000509557159 1100941414 /nfs/dbraw/zinc/94/14/14/1100941414.db2.gz LVKXVXWVWIONBS-LBPRGKRZSA-N 1 1 366.364 4.485 20 5 FIBDMO Cc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])sc1Br ZINC000507157666 1101536850 /nfs/dbraw/zinc/53/68/50/1101536850.db2.gz BKSBAXAVDWQNMN-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO Cc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])sc1Br ZINC000507157666 1101536859 /nfs/dbraw/zinc/53/68/59/1101536859.db2.gz BKSBAXAVDWQNMN-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2C/C=C\c2ccccc2[N+](=O)[O-])cc1OC ZINC000506636067 1101631205 /nfs/dbraw/zinc/63/12/05/1101631205.db2.gz ZSHMXNHGJZHCAE-MTIYJEKLSA-N 1 1 368.433 4.462 20 5 FIBDMO Cc1cc(N2CCC(C[N@H+](C)C(C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000537344208 1101675811 /nfs/dbraw/zinc/67/58/11/1101675811.db2.gz DPSZLVKLEYPDSI-UHFFFAOYSA-N 1 1 356.470 4.008 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2ccc(Cl)s2)cccc1[N+](=O)[O-] ZINC000026250796 1102303267 /nfs/dbraw/zinc/30/32/67/1102303267.db2.gz QJFJARAONIBDHF-UHFFFAOYSA-N 1 1 367.858 4.079 20 5 FIBDMO CCOc1ccc(C2=CC[N@H+](Cc3ccc([N+](=O)[O-])cc3OC)CC2)cc1 ZINC001168244019 1102600593 /nfs/dbraw/zinc/60/05/93/1102600593.db2.gz JKQDCZSACCYKBP-UHFFFAOYSA-N 1 1 368.433 4.291 20 5 FIBDMO CCOc1ccc(C2=CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3OC)CC2)cc1 ZINC001168244019 1102600597 /nfs/dbraw/zinc/60/05/97/1102600597.db2.gz JKQDCZSACCYKBP-UHFFFAOYSA-N 1 1 368.433 4.291 20 5 FIBDMO CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)Cc1ccccc1C ZINC000507119982 1103127240 /nfs/dbraw/zinc/12/72/40/1103127240.db2.gz IWMBIKQBNDLETN-UHFFFAOYSA-N 1 1 364.449 4.326 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(C)c2)c([N+](=O)[O-])cc1OC ZINC000507144211 1103143525 /nfs/dbraw/zinc/14/35/25/1103143525.db2.gz PQJAOHZZZNITLY-KRWDZBQOSA-N 1 1 356.422 4.258 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(C)c2)c([N+](=O)[O-])cc1OC ZINC000507144213 1103144687 /nfs/dbraw/zinc/14/46/87/1103144687.db2.gz PQJAOHZZZNITLY-QGZVFWFLSA-N 1 1 356.422 4.258 20 5 FIBDMO Cc1ccc(-c2n[nH]cc2C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000507151361 1103169190 /nfs/dbraw/zinc/16/91/90/1103169190.db2.gz DVSWOKNXQQCOFL-UHFFFAOYSA-N 1 1 354.410 4.297 20 5 FIBDMO Cn1cc(C[N@@H+](C)CCCc2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000507156226 1103175941 /nfs/dbraw/zinc/17/59/41/1103175941.db2.gz RVNCJZAWJDFHAG-UHFFFAOYSA-N 1 1 364.449 4.060 20 5 FIBDMO C[C@@H]1CC[N@@H+]([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)C1 ZINC000507185391 1103185208 /nfs/dbraw/zinc/18/52/08/1103185208.db2.gz XICZRFJIDJZYGS-FZKQIMNGSA-N 1 1 373.840 4.270 20 5 FIBDMO C[C@@H]1CC[N@H+]([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)C1 ZINC000507185391 1103185214 /nfs/dbraw/zinc/18/52/14/1103185214.db2.gz XICZRFJIDJZYGS-FZKQIMNGSA-N 1 1 373.840 4.270 20 5 FIBDMO Cc1ccc(-c2n[nH]cc2C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000507172000 1103191504 /nfs/dbraw/zinc/19/15/04/1103191504.db2.gz YLRNINDSROGIJN-UHFFFAOYSA-N 1 1 362.433 4.458 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000551737847 1103581150 /nfs/dbraw/zinc/58/11/50/1103581150.db2.gz CNKPZVMQIDFMRA-CQSZACIVSA-N 1 1 361.392 4.146 20 5 FIBDMO CC[C@H](C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000507695812 1103625550 /nfs/dbraw/zinc/62/55/50/1103625550.db2.gz XRZDBZZWRWCMJX-HNNXBMFYSA-N 1 1 366.421 4.446 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@H]([C@H](C)O)C3)cc2[N+](=O)[O-])cc1 ZINC000507700954 1103629209 /nfs/dbraw/zinc/62/92/09/1103629209.db2.gz YBUKAKODIWJIAK-RDJZCZTQSA-N 1 1 372.490 4.257 20 5 FIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C[C@H]1CCC[C@H]1O ZINC000537709489 1103870596 /nfs/dbraw/zinc/87/05/96/1103870596.db2.gz FVDUEXMXTDHWEM-SJKOYZFVSA-N 1 1 364.829 4.101 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC=C(c2ccc3c(c2)OCCO3)CC1 ZINC000537842194 1103965428 /nfs/dbraw/zinc/96/54/28/1103965428.db2.gz WUDLRLOHRKJACH-OAHLLOKOSA-N 1 1 366.417 4.216 20 5 FIBDMO CC[C@@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1cccc([N+](=O)[O-])c1 ZINC000467416131 1104128575 /nfs/dbraw/zinc/12/85/75/1104128575.db2.gz HEVBDWGNQWEQFF-HZPDHXFCSA-N 1 1 352.793 4.162 20 5 FIBDMO CCC[N@@H+](CCc1cccs1)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000184512477 1104502961 /nfs/dbraw/zinc/50/29/61/1104502961.db2.gz JFYVZZJRNBLFFC-UHFFFAOYSA-N 1 1 372.450 4.161 20 5 FIBDMO Cc1ccccc1[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441456372 1104759844 /nfs/dbraw/zinc/75/98/44/1104759844.db2.gz ZJXZGVRMWWDCBT-UTKZUKDTSA-N 1 1 370.449 4.134 20 5 FIBDMO Cc1ccccc1[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441456372 1104759848 /nfs/dbraw/zinc/75/98/48/1104759848.db2.gz ZJXZGVRMWWDCBT-UTKZUKDTSA-N 1 1 370.449 4.134 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000520525566 1104975386 /nfs/dbraw/zinc/97/53/86/1104975386.db2.gz QQEGRMZFGAAOPV-YPMHNXCESA-N 1 1 358.385 4.215 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000026483400 1107013930 /nfs/dbraw/zinc/01/39/30/1107013930.db2.gz IMZDYVLUCKVQGL-CZUORRHYSA-N 1 1 359.451 4.129 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000026483400 1107013946 /nfs/dbraw/zinc/01/39/46/1107013946.db2.gz IMZDYVLUCKVQGL-CZUORRHYSA-N 1 1 359.451 4.129 20 5 FIBDMO CC(C)c1ccc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)cc1[N+](=O)[O-] ZINC000186435619 1107098300 /nfs/dbraw/zinc/09/83/00/1107098300.db2.gz QEFKAIPPPIDDIV-OAQYLSRUSA-N 1 1 352.434 4.350 20 5 FIBDMO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544775 1107163808 /nfs/dbraw/zinc/16/38/08/1107163808.db2.gz FSUFXUXHDXSAMQ-ZFWWWQNUSA-N 1 1 358.442 4.216 20 5 FIBDMO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544775 1107163817 /nfs/dbraw/zinc/16/38/17/1107163817.db2.gz FSUFXUXHDXSAMQ-ZFWWWQNUSA-N 1 1 358.442 4.216 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc4cc(F)ccc4o3)C2)cc1 ZINC000451551728 1107171119 /nfs/dbraw/zinc/17/11/19/1107171119.db2.gz UWRIKKPQESXTTP-CQSZACIVSA-N 1 1 355.369 4.255 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3nc(-c4ccsc4)no3)C2)cc1 ZINC000451575503 1107189869 /nfs/dbraw/zinc/18/98/69/1107189869.db2.gz SYLXPUINGLOBQH-AWEZNQCLSA-N 1 1 370.434 4.086 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc(-c4ccsc4)no3)C2)cc1 ZINC000451575503 1107189877 /nfs/dbraw/zinc/18/98/77/1107189877.db2.gz SYLXPUINGLOBQH-AWEZNQCLSA-N 1 1 370.434 4.086 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(OCC4CCCCC4)CC3)nc2c1 ZINC000530724270 1107286537 /nfs/dbraw/zinc/28/65/37/1107286537.db2.gz JLDHWEQUALZZRC-UHFFFAOYSA-N 1 1 373.453 4.297 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CC3(CCC3)[C@@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000451848883 1107340570 /nfs/dbraw/zinc/34/05/70/1107340570.db2.gz GZDDHGUEEYGZJI-IBGZPJMESA-N 1 1 369.421 4.052 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451853064 1107344804 /nfs/dbraw/zinc/34/48/04/1107344804.db2.gz LFTWMNYFVNLGKI-IBGZPJMESA-N 1 1 369.421 4.052 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@H](C)C1 ZINC000520204190 1108020848 /nfs/dbraw/zinc/02/08/48/1108020848.db2.gz UCXJLOWSNZYXMP-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C)C1 ZINC000520204190 1108020863 /nfs/dbraw/zinc/02/08/63/1108020863.db2.gz UCXJLOWSNZYXMP-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000531702720 1108084105 /nfs/dbraw/zinc/08/41/05/1108084105.db2.gz OUUSFNKCRVEKOM-LNLFQRSKSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000531702720 1108084117 /nfs/dbraw/zinc/08/41/17/1108084117.db2.gz OUUSFNKCRVEKOM-LNLFQRSKSA-N 1 1 353.466 4.389 20 5 FIBDMO COc1cccc([C@H]2C[C@H](C)C[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444689093 1108089429 /nfs/dbraw/zinc/08/94/29/1108089429.db2.gz MEELQDHDGXELDD-ORAYPTAESA-N 1 1 366.421 4.063 20 5 FIBDMO COc1cccc([C@H]2C[C@H](C)C[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444689093 1108089442 /nfs/dbraw/zinc/08/94/42/1108089442.db2.gz MEELQDHDGXELDD-ORAYPTAESA-N 1 1 366.421 4.063 20 5 FIBDMO COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444689090 1108089954 /nfs/dbraw/zinc/08/99/54/1108089954.db2.gz MEELQDHDGXELDD-BFUOFWGJSA-N 1 1 366.421 4.063 20 5 FIBDMO COc1cccc([C@H]2C[C@@H](C)C[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444689090 1108089970 /nfs/dbraw/zinc/08/99/70/1108089970.db2.gz MEELQDHDGXELDD-BFUOFWGJSA-N 1 1 366.421 4.063 20 5 FIBDMO Cc1cc(C[N@@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1F ZINC000444727749 1108138228 /nfs/dbraw/zinc/13/82/28/1108138228.db2.gz CVIQOYDCOALCKA-ZDUSSCGKSA-N 1 1 370.384 4.285 20 5 FIBDMO Cc1cc(C[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1F ZINC000444727749 1108138236 /nfs/dbraw/zinc/13/82/36/1108138236.db2.gz CVIQOYDCOALCKA-ZDUSSCGKSA-N 1 1 370.384 4.285 20 5 FIBDMO Cc1c(C[NH2+][C@@H](C)c2ncc(-c3ccccc3)n2C)cccc1[N+](=O)[O-] ZINC000453211483 1108258523 /nfs/dbraw/zinc/25/85/23/1108258523.db2.gz NKXILLZSKLMIFO-HNNXBMFYSA-N 1 1 350.422 4.155 20 5 FIBDMO COCc1ccccc1/C=C(\C)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000508516295 1108378560 /nfs/dbraw/zinc/37/85/60/1108378560.db2.gz LTRDTJVXEONAEE-LFIBNONCSA-N 1 1 352.434 4.203 20 5 FIBDMO COCc1ccccc1/C=C(\C)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000508516295 1108378576 /nfs/dbraw/zinc/37/85/76/1108378576.db2.gz LTRDTJVXEONAEE-LFIBNONCSA-N 1 1 352.434 4.203 20 5 FIBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000525127904 1109272587 /nfs/dbraw/zinc/27/25/87/1109272587.db2.gz RXRLHLQKGSRAIW-KRWDZBQOSA-N 1 1 366.421 4.098 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000525145236 1109277418 /nfs/dbraw/zinc/27/74/18/1109277418.db2.gz IJPCCKWJKDKKCW-MRXNPFEDSA-N 1 1 367.449 4.387 20 5 FIBDMO COc1ccc(OCC[N@@H+](C)Cc2csc3ccccc23)c([N+](=O)[O-])c1 ZINC000441178450 1109410309 /nfs/dbraw/zinc/41/03/09/1109410309.db2.gz SQPZWIGPOHYQHH-UHFFFAOYSA-N 1 1 372.446 4.329 20 5 FIBDMO COc1cc(C[N@H+]2CCC3(C2)CCCCC3)c([N+](=O)[O-])cc1OC(F)F ZINC000525636259 1109464126 /nfs/dbraw/zinc/46/41/26/1109464126.db2.gz MOSFVEBGXGEJAZ-UHFFFAOYSA-N 1 1 370.396 4.361 20 5 FIBDMO Cc1ccc(C[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)cc1[N+](=O)[O-] ZINC000525696172 1109481587 /nfs/dbraw/zinc/48/15/87/1109481587.db2.gz YANBGZLSZPRVAY-ZDUSSCGKSA-N 1 1 353.205 4.433 20 5 FIBDMO C[C@@H](C1CCCCC1)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000447399506 1109534083 /nfs/dbraw/zinc/53/40/83/1109534083.db2.gz WOCUOUNHEBEMTD-LBPRGKRZSA-N 1 1 353.850 4.087 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1c1cccs1 ZINC000026231509 1109889361 /nfs/dbraw/zinc/88/93/61/1109889361.db2.gz OJKXSZMGGBWMMI-INIZCTEOSA-N 1 1 359.451 4.130 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3c(c2)OCCCCO3)c(Cl)c1 ZINC000449248353 1110011519 /nfs/dbraw/zinc/01/15/19/1110011519.db2.gz IQFHYUCCXLJUPA-UHFFFAOYSA-N 1 1 362.813 4.089 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2cnc(C3CC3)o2)s1 ZINC000449700223 1110149029 /nfs/dbraw/zinc/14/90/29/1110149029.db2.gz SMHLETQIBONWSI-UHFFFAOYSA-N 1 1 355.419 4.479 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000026363316 1110244069 /nfs/dbraw/zinc/24/40/69/1110244069.db2.gz NAMYQKHEEJQDOB-CHWSQXEVSA-N 1 1 361.829 4.234 20 5 FIBDMO COc1ccc(C[N@H+]2CCC23CCC3)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000538738498 1111271496 /nfs/dbraw/zinc/27/14/96/1111271496.db2.gz YYXMVZPAXOUEAS-UHFFFAOYSA-N 1 1 368.433 4.311 20 5 FIBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000538738176 1111271922 /nfs/dbraw/zinc/27/19/22/1111271922.db2.gz DRFGHHJCASADIF-YJBOKZPZSA-N 1 1 357.454 4.159 20 5 FIBDMO CCN1CC[C@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000538738176 1111271939 /nfs/dbraw/zinc/27/19/39/1111271939.db2.gz DRFGHHJCASADIF-YJBOKZPZSA-N 1 1 357.454 4.159 20 5 FIBDMO CCN1CC[C@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000538738176 1111271945 /nfs/dbraw/zinc/27/19/45/1111271945.db2.gz DRFGHHJCASADIF-YJBOKZPZSA-N 1 1 357.454 4.159 20 5 FIBDMO C[C@@H]1CCCC[C@@H]1CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000552045351 1111556307 /nfs/dbraw/zinc/55/63/07/1111556307.db2.gz DXDCPVVFNHKSFN-MDZRGWNJSA-N 1 1 356.470 4.224 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC000478057340 1111660208 /nfs/dbraw/zinc/66/02/08/1111660208.db2.gz IRTXBCLZUQFFTI-OAHLLOKOSA-N 1 1 361.467 4.002 20 5 FIBDMO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000478433943 1111775971 /nfs/dbraw/zinc/77/59/71/1111775971.db2.gz WVIHHYFWKZMRIK-LBPRGKRZSA-N 1 1 368.359 4.036 20 5 FIBDMO CC(=O)c1cc(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000553076522 1111903016 /nfs/dbraw/zinc/90/30/16/1111903016.db2.gz PQBWISONBPABDB-KUHUBIRLSA-N 1 1 373.478 4.354 20 5 FIBDMO C[C@@H](NC[C@H](C1CC1)[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481304149 1112877362 /nfs/dbraw/zinc/87/73/62/1112877362.db2.gz DAFXQVZQUYZJQA-CXAGYDPISA-N 1 1 359.495 4.314 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(C(C)(F)F)cc1 ZINC000555592506 1112934871 /nfs/dbraw/zinc/93/48/71/1112934871.db2.gz VSFVFYMPTSWFJF-UHFFFAOYSA-N 1 1 350.365 4.395 20 5 FIBDMO Cc1ccc(C[N@@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000006995748 1113170512 /nfs/dbraw/zinc/17/05/12/1113170512.db2.gz PFCQTAMVHVRVST-CQSZACIVSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000006995748 1113170514 /nfs/dbraw/zinc/17/05/14/1113170514.db2.gz PFCQTAMVHVRVST-CQSZACIVSA-N 1 1 352.394 4.146 20 5 FIBDMO C[C@H](c1ccc(F)cc1)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000027557473 1113698610 /nfs/dbraw/zinc/69/86/10/1113698610.db2.gz KISGEBQRZSWTKV-LLVKDONJSA-N 1 1 365.792 4.019 20 5 FIBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000027557473 1113698614 /nfs/dbraw/zinc/69/86/14/1113698614.db2.gz KISGEBQRZSWTKV-LLVKDONJSA-N 1 1 365.792 4.019 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](Oc2ncccc2F)C1 ZINC000489005480 1114034217 /nfs/dbraw/zinc/03/42/17/1114034217.db2.gz QEOZCDAWNYDGBM-HOCLYGCPSA-N 1 1 359.401 4.042 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c(F)c1 ZINC000490400977 1114287559 /nfs/dbraw/zinc/28/75/59/1114287559.db2.gz NMMRPCKGGXBPRF-ZDUSSCGKSA-N 1 1 373.359 4.394 20 5 FIBDMO Cn1cc[nH+]c1C[C@H](Nc1ccnc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000590082786 1114888104 /nfs/dbraw/zinc/88/81/04/1114888104.db2.gz NPZNLMPADDPSCH-SFHVURJKSA-N 1 1 373.416 4.272 20 5 FIBDMO Cc1ccc(CNc2nccc3ccc([N+](=O)[O-])cc32)c(N2CCCC2)[nH+]1 ZINC000591153019 1115030557 /nfs/dbraw/zinc/03/05/57/1115030557.db2.gz GWILTRSFDCLQHA-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1sccc1Br ZINC000573338539 1115097085 /nfs/dbraw/zinc/09/70/85/1115097085.db2.gz QGHHMJVZGPDPHY-LBPRGKRZSA-N 1 1 353.241 4.196 20 5 FIBDMO C[C@@H]1CC2(C[N@H+]1Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)CCOCC2 ZINC000592527813 1115241034 /nfs/dbraw/zinc/24/10/34/1115241034.db2.gz QUOHTNCTKHLIIR-OAHLLOKOSA-N 1 1 356.422 4.246 20 5 FIBDMO C[C@@H]1CC2(C[N@H+]1Cc1csc(-c3cccc([N+](=O)[O-])c3)n1)CCOCC2 ZINC000592525646 1115341398 /nfs/dbraw/zinc/34/13/98/1115341398.db2.gz CIMYIOVHUSVAJM-CQSZACIVSA-N 1 1 373.478 4.109 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1NCCc1cn2c([nH+]1)CCCC2 ZINC000574472526 1115376758 /nfs/dbraw/zinc/37/67/58/1115376758.db2.gz KPYMPMUYLGQTBO-UHFFFAOYSA-N 1 1 355.225 4.089 20 5 FIBDMO Cc1[nH+]cn(CCCCc2noc(-c3cc([N+](=O)[O-])c(C)cc3C)n2)c1C ZINC000594534725 1115461846 /nfs/dbraw/zinc/46/18/46/1115461846.db2.gz OJCFLMUDEFPCBP-UHFFFAOYSA-N 1 1 369.425 4.098 20 5 FIBDMO COc1cc(Cl)ccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595016544 1115504066 /nfs/dbraw/zinc/50/40/66/1115504066.db2.gz HHDMKVDBWAYFTR-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO COc1cc(Cl)ccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595016539 1115504080 /nfs/dbraw/zinc/50/40/80/1115504080.db2.gz HHDMKVDBWAYFTR-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](CO)c1cccc(Cl)c1Cl ZINC000595001147 1115506792 /nfs/dbraw/zinc/50/67/92/1115506792.db2.gz QXPWFZBCSACELY-OAHLLOKOSA-N 1 1 355.221 4.033 20 5 FIBDMO CC[NH+](CC)Cc1ccccc1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595004318 1115507148 /nfs/dbraw/zinc/50/71/48/1115507148.db2.gz PAWWHISNNLNEOS-INIZCTEOSA-N 1 1 371.481 4.296 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCCOc2c(F)cccc21 ZINC000595034638 1115510537 /nfs/dbraw/zinc/51/05/37/1115510537.db2.gz RHVGNZATIGIZBL-PXAZEXFGSA-N 1 1 360.385 4.307 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCOc2c(F)cccc21 ZINC000595034640 1115510593 /nfs/dbraw/zinc/51/05/93/1115510593.db2.gz RHVGNZATIGIZBL-SJKOYZFVSA-N 1 1 360.385 4.307 20 5 FIBDMO COc1ccc(-c2cc(C[NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)on2)cc1 ZINC000595076519 1115516941 /nfs/dbraw/zinc/51/69/41/1115516941.db2.gz KZUJFIAROJYJDU-CQSZACIVSA-N 1 1 367.405 4.418 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cc(F)ccc1OC(F)F ZINC000595092925 1115517624 /nfs/dbraw/zinc/51/76/24/1115517624.db2.gz BCTYPLTWUYJNEH-JTQLQIEISA-N 1 1 370.327 4.195 20 5 FIBDMO Cc1noc(C[NH+]2CCC(c3c(C)[nH]c4ccccc43)CC2)c1[N+](=O)[O-] ZINC000595293974 1115521253 /nfs/dbraw/zinc/52/12/53/1115521253.db2.gz VWKNTKVVBFUIAQ-UHFFFAOYSA-N 1 1 354.410 4.061 20 5 FIBDMO C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000595298052 1115521951 /nfs/dbraw/zinc/52/19/51/1115521951.db2.gz NTSLCQPKSSNVJN-PXNSSMCTSA-N 1 1 358.413 4.334 20 5 FIBDMO Cc1noc(C[NH+]2CCC(c3ccccc3C(F)(F)F)CC2)c1[N+](=O)[O-] ZINC000595346211 1115524298 /nfs/dbraw/zinc/52/42/98/1115524298.db2.gz GKHWDZLDDNXVJY-UHFFFAOYSA-N 1 1 369.343 4.290 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1OCC ZINC000595418575 1115534798 /nfs/dbraw/zinc/53/47/98/1115534798.db2.gz CXCLFRLZWNNAEH-ZDUSSCGKSA-N 1 1 362.401 4.382 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cccc(OC(C)C)c2)c1 ZINC000593021871 1115540109 /nfs/dbraw/zinc/54/01/09/1115540109.db2.gz ZBBHVWZNWDNNIP-AWEZNQCLSA-N 1 1 372.421 4.019 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCC4(CCCC4)CC3)o2)cc1 ZINC000595641348 1115554382 /nfs/dbraw/zinc/55/43/82/1115554382.db2.gz JLUXLDYPZXJFSN-UHFFFAOYSA-N 1 1 356.426 4.191 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(c2ccco2)CC1 ZINC000595615942 1115554444 /nfs/dbraw/zinc/55/44/44/1115554444.db2.gz ODIOEEWPHZIIFN-CYBMUJFWSA-N 1 1 368.393 4.178 20 5 FIBDMO Cc1ccc2c(c1)C[N@H+]([C@H](C)c1nnc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000595659253 1115555297 /nfs/dbraw/zinc/55/52/97/1115555297.db2.gz YZCFSEPHZCWFJL-CQSZACIVSA-N 1 1 364.405 4.073 20 5 FIBDMO Cc1ccc2c(c1)C[N@@H+]([C@H](C)c1nnc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000595659253 1115555301 /nfs/dbraw/zinc/55/53/01/1115555301.db2.gz YZCFSEPHZCWFJL-CQSZACIVSA-N 1 1 364.405 4.073 20 5 FIBDMO CC[N@@H+](Cc1onc(C)c1[N+](=O)[O-])[C@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000595867571 1115566721 /nfs/dbraw/zinc/56/67/21/1115566721.db2.gz OVANWPOWALWPDI-LLVKDONJSA-N 1 1 371.359 4.363 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCCC[C@H]2c2ccco2)c2c(c1)COCO2 ZINC000076805335 1115770699 /nfs/dbraw/zinc/77/06/99/1115770699.db2.gz VURRNJLEMQUZOB-KRWDZBQOSA-N 1 1 358.394 4.172 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCCC[C@H]2c2ccco2)c2c(c1)COCO2 ZINC000076805335 1115770702 /nfs/dbraw/zinc/77/07/02/1115770702.db2.gz VURRNJLEMQUZOB-KRWDZBQOSA-N 1 1 358.394 4.172 20 5 FIBDMO CCOc1cc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(F)cc1OC ZINC000598964347 1115771616 /nfs/dbraw/zinc/77/16/16/1115771616.db2.gz GHEQSGXMMQJZPC-ZDUSSCGKSA-N 1 1 362.401 4.300 20 5 FIBDMO C[N@H+]1CCCC[C@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000599070734 1115787155 /nfs/dbraw/zinc/78/71/55/1115787155.db2.gz OGHJDWFKUBQJPS-UTKZUKDTSA-N 1 1 353.466 4.006 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCCC[C@@H]12 ZINC000603846948 1115821050 /nfs/dbraw/zinc/82/10/50/1115821050.db2.gz IEGGASJHZOSEGZ-XOKHGSTOSA-N 1 1 356.426 4.045 20 5 FIBDMO O=[N+]([O-])c1ncccc1NC[C@H](c1c(F)cccc1Cl)[NH+]1CCCC1 ZINC000603851184 1115821593 /nfs/dbraw/zinc/82/15/93/1115821593.db2.gz RWWXAKLSWVGDAS-OAHLLOKOSA-N 1 1 364.808 4.031 20 5 FIBDMO CC(=O)c1ccc(NCc2ccc(-n3cc[nH+]c3C)c(F)c2)c([N+](=O)[O-])c1 ZINC000063254722 1116031983 /nfs/dbraw/zinc/03/19/83/1116031983.db2.gz PSOLLVDIIZHFID-UHFFFAOYSA-N 1 1 368.368 4.043 20 5 FIBDMO CCN(Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000608788720 1116130110 /nfs/dbraw/zinc/13/01/10/1116130110.db2.gz QSCZSXQUDNSWHA-DYESRHJHSA-N 1 1 353.466 4.252 20 5 FIBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ccc(Cl)o3)o2)c([N+](=O)[O-])c1 ZINC000608835539 1116131058 /nfs/dbraw/zinc/13/10/58/1116131058.db2.gz UKHWYTSMRDTXKB-UHFFFAOYSA-N 1 1 362.769 4.400 20 5 FIBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCc2ccccc21 ZINC000608868669 1116132615 /nfs/dbraw/zinc/13/26/15/1116132615.db2.gz RARPPZVCEOUANZ-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCc2ccccc21 ZINC000608868669 1116132616 /nfs/dbraw/zinc/13/26/16/1116132616.db2.gz RARPPZVCEOUANZ-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3ccccc3)CC2)c2c(c1)COCO2 ZINC000608977461 1116139296 /nfs/dbraw/zinc/13/92/96/1116139296.db2.gz LJIHJLWSZVFSSJ-KRWDZBQOSA-N 1 1 368.433 4.231 20 5 FIBDMO Cc1[nH+]ccn1CCCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000534979058 1116257567 /nfs/dbraw/zinc/25/75/67/1116257567.db2.gz SMSKASWOKLURSN-UHFFFAOYSA-N 1 1 356.245 4.045 20 5 FIBDMO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089907701 1116346925 /nfs/dbraw/zinc/34/69/25/1116346925.db2.gz DYBRWUOBVRUDRK-LJQANCHMSA-N 1 1 366.421 4.316 20 5 FIBDMO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089907701 1116346927 /nfs/dbraw/zinc/34/69/27/1116346927.db2.gz DYBRWUOBVRUDRK-LJQANCHMSA-N 1 1 366.421 4.316 20 5 FIBDMO CCS[C@H]1CCCC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000539830412 1116387816 /nfs/dbraw/zinc/38/78/16/1116387816.db2.gz UFULUITYBYQPHU-SFHVURJKSA-N 1 1 374.510 4.103 20 5 FIBDMO COc1ccccc1-c1cc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)on1 ZINC000595103361 1117748852 /nfs/dbraw/zinc/74/88/52/1117748852.db2.gz LZWZFCZTEVMPLS-AWEZNQCLSA-N 1 1 367.405 4.418 20 5 FIBDMO O=[N+]([O-])c1ccc(OC2CCN(c3cc[nH+]c4ccsc43)CC2)cc1 ZINC000462956309 1117881829 /nfs/dbraw/zinc/88/18/29/1117881829.db2.gz MBEYVINDNKIGKJ-UHFFFAOYSA-N 1 1 355.419 4.252 20 5 FIBDMO COc1ccc(CNc2ccc(-n3c[nH+]c(C)c3C)cc2)cc1[N+](=O)[O-] ZINC000463040433 1117932492 /nfs/dbraw/zinc/93/24/92/1117932492.db2.gz VVTSLHGNDOEFQB-UHFFFAOYSA-N 1 1 352.394 4.018 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000463235709 1118044225 /nfs/dbraw/zinc/04/42/25/1118044225.db2.gz YWCFKSUKNKQXIB-QGZVFWFLSA-N 1 1 350.422 4.055 20 5 FIBDMO C[C@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[N@H+]1C ZINC000540610971 1118150563 /nfs/dbraw/zinc/15/05/63/1118150563.db2.gz YVKWQWNKCHLRIJ-STQMWFEESA-N 1 1 363.845 4.081 20 5 FIBDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCN1C ZINC000540610971 1118150564 /nfs/dbraw/zinc/15/05/64/1118150564.db2.gz YVKWQWNKCHLRIJ-STQMWFEESA-N 1 1 363.845 4.081 20 5 FIBDMO C[C@@H](N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356480 1118389264 /nfs/dbraw/zinc/38/92/64/1118389264.db2.gz OHKBNDGTILCCCR-FOUBCARRSA-N 1 1 367.493 4.402 20 5 FIBDMO C[C@@H](N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356480 1118389270 /nfs/dbraw/zinc/38/92/70/1118389270.db2.gz OHKBNDGTILCCCR-FOUBCARRSA-N 1 1 367.493 4.402 20 5 FIBDMO C[C@@H]([NH2+][C@H]1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356480 1118389275 /nfs/dbraw/zinc/38/92/75/1118389275.db2.gz OHKBNDGTILCCCR-FOUBCARRSA-N 1 1 367.493 4.402 20 5 FIBDMO CCc1ccc([C@@H]([NH2+][C@H](C)Cc2cc(C)[nH]n2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541564646 1118556639 /nfs/dbraw/zinc/55/66/39/1118556639.db2.gz AONUZFYZJMJYFV-XCLFUZPHSA-N 1 1 368.437 4.092 20 5 FIBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2CCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000464841716 1118717934 /nfs/dbraw/zinc/71/79/34/1118717934.db2.gz YVLMPMDWSIZGEH-KXBFYZLASA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2CCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000464841716 1118717937 /nfs/dbraw/zinc/71/79/37/1118717937.db2.gz YVLMPMDWSIZGEH-KXBFYZLASA-N 1 1 353.422 4.067 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C)C[C@H]2c2ccc(C)o2)c([N+](=O)[O-])c1 ZINC000464841786 1118718080 /nfs/dbraw/zinc/71/80/80/1118718080.db2.gz XZHYATMQYGIAAY-PBHICJAKSA-N 1 1 374.437 4.357 20 5 FIBDMO Cc1cc(C)c(NC(=O)C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(Cl)c1 ZINC000271701801 1118731765 /nfs/dbraw/zinc/73/17/65/1118731765.db2.gz HOEANNBCOOZSRQ-CYBMUJFWSA-N 1 1 361.829 4.154 20 5 FIBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000609144643 1118772310 /nfs/dbraw/zinc/77/23/10/1118772310.db2.gz TZUAOUWLAFZFKU-OXQOHEQNSA-N 1 1 358.413 4.334 20 5 FIBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000609144642 1118772426 /nfs/dbraw/zinc/77/24/26/1118772426.db2.gz TZUAOUWLAFZFKU-OXJNMPFZSA-N 1 1 358.413 4.334 20 5 FIBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cc(Cl)ccc2Br)c1 ZINC000090251224 1118792189 /nfs/dbraw/zinc/79/21/89/1118792189.db2.gz DCXHRFUJAPFMIY-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000151896547 1118999738 /nfs/dbraw/zinc/99/97/38/1118999738.db2.gz BLRPLKQDWNBUEF-AEFFLSMTSA-N 1 1 374.437 4.063 20 5 FIBDMO CC(C)([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1cc(C(F)(F)F)on1 ZINC000492110205 1119026569 /nfs/dbraw/zinc/02/65/69/1119026569.db2.gz SXTMGZBZMDBCSM-FNORWQNLSA-N 1 1 355.316 4.140 20 5 FIBDMO CC(C)([NH2+]Cc1csc(Br)c1)c1ccccc1[N+](=O)[O-] ZINC000492111647 1119027509 /nfs/dbraw/zinc/02/75/09/1119027509.db2.gz VQUSWRKCQMPBNR-UHFFFAOYSA-N 1 1 355.257 4.444 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2c2ccc(OC)cc2)ccc1[N+](=O)[O-] ZINC000492466950 1119099282 /nfs/dbraw/zinc/09/92/82/1119099282.db2.gz ZWMDOQNRVPUMAC-GOSISDBHSA-N 1 1 356.422 4.339 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492538829 1119126388 /nfs/dbraw/zinc/12/63/88/1119126388.db2.gz QRBNLEDQKRTHNP-SFHVURJKSA-N 1 1 355.438 4.070 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccccc2OC)ccc1[N+](=O)[O-] ZINC000492768383 1119183643 /nfs/dbraw/zinc/18/36/43/1119183643.db2.gz ISPLQOVXKRBHJV-KRWDZBQOSA-N 1 1 356.422 4.339 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCCc3ccccc3)CC2)cc1Cl ZINC000761507022 1119403093 /nfs/dbraw/zinc/40/30/93/1119403093.db2.gz QYMAHKAHRIOZEN-UHFFFAOYSA-N 1 1 374.868 4.472 20 5 FIBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccc(OC)c(OC)c1 ZINC000761505921 1119406426 /nfs/dbraw/zinc/40/64/26/1119406426.db2.gz ILTOULQUHLCQKU-UHFFFAOYSA-N 1 1 364.829 4.288 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@H+](C)Cc1nc3cc([N+](=O)[O-])ccc3o1)CCC2 ZINC000152564893 1119451315 /nfs/dbraw/zinc/45/13/15/1119451315.db2.gz VGOGGSXVWVCTFI-AWEZNQCLSA-N 1 1 372.450 4.264 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)Cc1nc3cc([N+](=O)[O-])ccc3o1)CCC2 ZINC000152564893 1119451321 /nfs/dbraw/zinc/45/13/21/1119451321.db2.gz VGOGGSXVWVCTFI-AWEZNQCLSA-N 1 1 372.450 4.264 20 5 FIBDMO Cc1ccc([C@H](CNCc2ccc([N+](=O)[O-])cc2Cl)[NH+]2CCCC2)o1 ZINC000542484421 1119881802 /nfs/dbraw/zinc/88/18/02/1119881802.db2.gz ZLLMBMRJIUJATH-KRWDZBQOSA-N 1 1 363.845 4.076 20 5 FIBDMO COC[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000193663109 1120173116 /nfs/dbraw/zinc/17/31/16/1120173116.db2.gz OYONENJHTJVNMJ-HNNXBMFYSA-N 1 1 355.221 4.379 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccccc1OC(F)F ZINC000193120009 1120416902 /nfs/dbraw/zinc/41/69/02/1120416902.db2.gz HLAFFGRDOYRTJA-LLVKDONJSA-N 1 1 352.337 4.056 20 5 FIBDMO Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000495412559 1120788829 /nfs/dbraw/zinc/78/88/29/1120788829.db2.gz BJAAFBUAEYKWDY-WDEREUQCSA-N 1 1 370.375 4.382 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](CCOC)c2ccc(C)o2)cc1[N+](=O)[O-] ZINC000495425620 1120801384 /nfs/dbraw/zinc/80/13/84/1120801384.db2.gz DEPZTSGYQVUMFV-HOCLYGCPSA-N 1 1 362.426 4.323 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](Cc1ccc2c(c1)OCO2)C1CCCC1 ZINC000917004885 1121998723 /nfs/dbraw/zinc/99/87/23/1121998723.db2.gz IHOYDEFNQHUHKM-UHFFFAOYSA-N 1 1 372.396 4.407 20 5 FIBDMO CC(=O)c1ccc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000301597027 1122231079 /nfs/dbraw/zinc/23/10/79/1122231079.db2.gz SQPYLYDHCRMHGV-KXBFYZLASA-N 1 1 367.449 4.120 20 5 FIBDMO Cc1ccc([C@H](C)NCc2cccc(C[NH+]3CCCC3)c2)cc1[N+](=O)[O-] ZINC000123023602 1122233467 /nfs/dbraw/zinc/23/34/67/1122233467.db2.gz YDMLVNSEFFHJRK-KRWDZBQOSA-N 1 1 353.466 4.350 20 5 FIBDMO C[C@H](C1CC1)[N@H+](Cc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917436409 1122303648 /nfs/dbraw/zinc/30/36/48/1122303648.db2.gz CHKKEBYDNZVNSQ-OAHLLOKOSA-N 1 1 350.422 4.203 20 5 FIBDMO C[N@@H+](Cc1cccc(C(F)(F)F)c1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917473485 1122321479 /nfs/dbraw/zinc/32/14/79/1122321479.db2.gz CKVMUYZNQDWFFZ-UHFFFAOYSA-N 1 1 364.327 4.053 20 5 FIBDMO C[N@H+](Cc1cccc(C(F)(F)F)c1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917473485 1122321481 /nfs/dbraw/zinc/32/14/81/1122321481.db2.gz CKVMUYZNQDWFFZ-UHFFFAOYSA-N 1 1 364.327 4.053 20 5 FIBDMO COc1ccccc1[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609280917 1122679988 /nfs/dbraw/zinc/67/99/88/1122679988.db2.gz WNAHQNVHOIIXFU-QGZVFWFLSA-N 1 1 356.422 4.209 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC=C(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000556505411 1122929045 /nfs/dbraw/zinc/92/90/45/1122929045.db2.gz HDWRWMCWTAUNAO-UHFFFAOYSA-N 1 1 365.433 4.021 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[NH2+][C@H](c2nccs2)c2ccccc2)cc1 ZINC000195073905 1123123835 /nfs/dbraw/zinc/12/38/35/1123123835.db2.gz MMDSENMFMGTYTA-SFHVURJKSA-N 1 1 369.446 4.199 20 5 FIBDMO COCc1ccccc1/C=C(/C)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000556857140 1123142681 /nfs/dbraw/zinc/14/26/81/1123142681.db2.gz AHZNHHUCYIEMID-VKAVYKQESA-N 1 1 354.450 4.319 20 5 FIBDMO C[C@@H]1CCCC[C@@H]1CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556873233 1123156868 /nfs/dbraw/zinc/15/68/68/1123156868.db2.gz VNIHPWKDGLFHJG-GPMSIDNRSA-N 1 1 356.470 4.224 20 5 FIBDMO C[N@H+](CCc1ccc(Br)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609316078 1123461156 /nfs/dbraw/zinc/46/11/56/1123461156.db2.gz YEXQLRGDPGLOLF-UHFFFAOYSA-N 1 1 367.218 4.171 20 5 FIBDMO C[N@@H+](CCc1ccc(Br)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000609316078 1123461159 /nfs/dbraw/zinc/46/11/59/1123461159.db2.gz YEXQLRGDPGLOLF-UHFFFAOYSA-N 1 1 367.218 4.171 20 5 FIBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)Cc1ccc(OC)cc1 ZINC000609432183 1123712973 /nfs/dbraw/zinc/71/29/73/1123712973.db2.gz QLCURHQTSXURHK-OAHLLOKOSA-N 1 1 358.438 4.065 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCSC[C@H]2c2ccccc2)cc1 ZINC000609672573 1123790074 /nfs/dbraw/zinc/79/00/74/1123790074.db2.gz QENWJEGHRXULCY-IBGZPJMESA-N 1 1 358.463 4.154 20 5 FIBDMO COC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000091414006 1124385098 /nfs/dbraw/zinc/38/50/98/1124385098.db2.gz UEONOKWEUNLJMW-SJCJKPOMSA-N 1 1 350.365 4.220 20 5 FIBDMO Cc1cc(NC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000153818019 1124528499 /nfs/dbraw/zinc/52/84/99/1124528499.db2.gz WSWKRKZSMXPPMO-DLBZAZTESA-N 1 1 374.485 4.022 20 5 FIBDMO COc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)ccc1OC(C)C ZINC001168686297 1124823648 /nfs/dbraw/zinc/82/36/48/1124823648.db2.gz QYZKNRBLIBYMSB-CYBMUJFWSA-N 1 1 362.401 4.381 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000542929387 1124889516 /nfs/dbraw/zinc/88/95/16/1124889516.db2.gz XXMRHQDFCSIWCI-UAGQMJEPSA-N 1 1 352.862 4.274 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ncc(Cl)cc2[N+](=O)[O-])cc1 ZINC000301740407 1125187127 /nfs/dbraw/zinc/18/71/27/1125187127.db2.gz KKLIUKPRBNEQBY-LLVKDONJSA-N 1 1 357.801 4.310 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301747238 1125194778 /nfs/dbraw/zinc/19/47/78/1125194778.db2.gz QRNLPMULSQZVRL-CQSZACIVSA-N 1 1 366.893 4.124 20 5 FIBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c2ccncc21 ZINC000312139500 1125273257 /nfs/dbraw/zinc/27/32/57/1125273257.db2.gz OJXHTIOSRLDBNS-QGZVFWFLSA-N 1 1 362.433 4.220 20 5 FIBDMO O=[N+]([O-])c1c(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc2ncccc21 ZINC000312139540 1125273736 /nfs/dbraw/zinc/27/37/36/1125273736.db2.gz VPKRJIYDHOPPOK-QGZVFWFLSA-N 1 1 362.433 4.220 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000619054901 1125438677 /nfs/dbraw/zinc/43/86/77/1125438677.db2.gz YYWPFGLRGOXNCM-UHFFFAOYSA-N 1 1 374.872 4.161 20 5 FIBDMO CCN(Cc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000517900735 567828797 /nfs/dbraw/zinc/82/87/97/567828797.db2.gz VAOCCPZATYKCRX-PXNSSMCTSA-N 1 1 353.466 4.252 20 5 FIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccc(N2CCCC2)c1 ZINC000181872170 568049518 /nfs/dbraw/zinc/04/95/18/568049518.db2.gz TYKAPWQXVMAWEI-CQSZACIVSA-N 1 1 366.421 4.187 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1c(F)cccc1OC(F)F ZINC000569116490 568280495 /nfs/dbraw/zinc/28/04/95/568280495.db2.gz HJVRRCYZGIMHLB-CQSZACIVSA-N 1 1 352.312 4.112 20 5 FIBDMO C[C@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCCC1 ZINC000570228109 568463789 /nfs/dbraw/zinc/46/37/89/568463789.db2.gz JZZWKYKLLNTIGS-LBPRGKRZSA-N 1 1 360.376 4.129 20 5 FIBDMO C[C@@]12CC[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]1C2(F)F ZINC000570531330 568484657 /nfs/dbraw/zinc/48/46/57/568484657.db2.gz ASJJANVZXJPFHS-QWHCGFSZSA-N 1 1 350.287 4.091 20 5 FIBDMO C[C@@]12CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@@H]1C2(F)F ZINC000570531330 568484659 /nfs/dbraw/zinc/48/46/59/568484659.db2.gz ASJJANVZXJPFHS-QWHCGFSZSA-N 1 1 350.287 4.091 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 ZINC000182817829 1125637979 /nfs/dbraw/zinc/63/79/79/1125637979.db2.gz CEPJUHIPPGBYCA-DOMZBBRYSA-N 1 1 368.359 4.208 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000619722723 1125668721 /nfs/dbraw/zinc/66/87/21/1125668721.db2.gz VDNJIQDJAWWSSA-SJORKVTESA-N 1 1 368.481 4.377 20 5 FIBDMO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000182927245 1125685126 /nfs/dbraw/zinc/68/51/26/1125685126.db2.gz XGYVUIXNCHIKRA-CQSZACIVSA-N 1 1 352.394 4.112 20 5 FIBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000619784240 1125696384 /nfs/dbraw/zinc/69/63/84/1125696384.db2.gz SVSFQCVPLMPQRC-UHFFFAOYSA-N 1 1 368.861 4.192 20 5 FIBDMO CSC[C@H]1CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000430200794 1079917204 /nfs/dbraw/zinc/91/72/04/1079917204.db2.gz XLDGQQWGOGVVHB-ZDUSSCGKSA-N 1 1 363.508 4.293 20 5 FIBDMO Cc1ccc([C@@H]2CCCC[N@@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000610215231 1079982531 /nfs/dbraw/zinc/98/25/31/1079982531.db2.gz DMLWZDLVKPJFMK-FQEVSTJZSA-N 1 1 368.433 4.497 20 5 FIBDMO Cc1ccc([C@@H]2CCCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000610215231 1079982535 /nfs/dbraw/zinc/98/25/35/1079982535.db2.gz DMLWZDLVKPJFMK-FQEVSTJZSA-N 1 1 368.433 4.497 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2CCc2ccccc2)c([N+](=O)[O-])cc1F ZINC001167069511 1079984589 /nfs/dbraw/zinc/98/45/89/1079984589.db2.gz CARWAXIOTXOCTH-QGZVFWFLSA-N 1 1 358.413 4.340 20 5 FIBDMO COc1ccc(C[C@H]2CCC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1 ZINC000610215680 1079984729 /nfs/dbraw/zinc/98/47/29/1079984729.db2.gz UVEOKJLQMROOFV-MRXNPFEDSA-N 1 1 358.413 4.197 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000430214210 1079988139 /nfs/dbraw/zinc/98/81/39/1079988139.db2.gz XRNJVIDOGYHACA-CYBMUJFWSA-N 1 1 374.412 4.382 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000430214211 1079988321 /nfs/dbraw/zinc/98/83/21/1079988321.db2.gz XRNJVIDOGYHACA-ZDUSSCGKSA-N 1 1 374.412 4.382 20 5 FIBDMO CCC[N@H+]1CCC[C@@H]1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609762691 1080472190 /nfs/dbraw/zinc/47/21/90/1080472190.db2.gz PFFUVFQOUGTJEK-LJQANCHMSA-N 1 1 369.421 4.200 20 5 FIBDMO Cc1ccc(C[C@@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001167265196 1080932106 /nfs/dbraw/zinc/93/21/06/1080932106.db2.gz YZORMZRACIXLAE-IBGZPJMESA-N 1 1 354.450 4.237 20 5 FIBDMO Cc1nc(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc2ccccc12 ZINC000579919001 1081005363 /nfs/dbraw/zinc/00/53/63/1081005363.db2.gz CPQXCWDQNHTGHR-QGZVFWFLSA-N 1 1 362.433 4.226 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+](Cc2cccs2)C(C)C)cccc1[N+](=O)[O-] ZINC000560855878 1081578435 /nfs/dbraw/zinc/57/84/35/1081578435.db2.gz SNLMAFFQTFMNLG-UHFFFAOYSA-N 1 1 361.467 4.204 20 5 FIBDMO CC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC001167380730 1081853630 /nfs/dbraw/zinc/85/36/30/1081853630.db2.gz ILVSWLBYIGOOTH-CHWSQXEVSA-N 1 1 353.850 4.087 20 5 FIBDMO CC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC001167380730 1081853633 /nfs/dbraw/zinc/85/36/33/1081853633.db2.gz ILVSWLBYIGOOTH-CHWSQXEVSA-N 1 1 353.850 4.087 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCC(C)(C2CC2)CC1 ZINC000580742852 1082114934 /nfs/dbraw/zinc/11/49/34/1082114934.db2.gz FSWQCPYONBHTEG-GFCCVEGCSA-N 1 1 365.861 4.087 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC1CCC1 ZINC001167453966 1082447764 /nfs/dbraw/zinc/44/77/64/1082447764.db2.gz PJLCGCBBOILQMS-IIBYNOLFSA-N 1 1 354.450 4.492 20 5 FIBDMO CCOc1ccc([C@@H]2CCC[N@@H+]2Cn2ncc3cc([N+](=O)[O-])ccc32)cc1 ZINC000023855357 1082669119 /nfs/dbraw/zinc/66/91/19/1082669119.db2.gz DNGPDAIRXLLOPI-IBGZPJMESA-N 1 1 366.421 4.138 20 5 FIBDMO CCOc1ccc([C@@H]2CCC[N@H+]2Cn2ncc3cc([N+](=O)[O-])ccc32)cc1 ZINC000023855357 1082669128 /nfs/dbraw/zinc/66/91/28/1082669128.db2.gz DNGPDAIRXLLOPI-IBGZPJMESA-N 1 1 366.421 4.138 20 5 FIBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001167487151 1082955997 /nfs/dbraw/zinc/95/59/97/1082955997.db2.gz GKDZKSQJBPEABD-TZIWHRDSSA-N 1 1 356.466 4.280 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510473141 1082966690 /nfs/dbraw/zinc/96/66/90/1082966690.db2.gz PSOOYRPPTNTGGI-MAUKXSAKSA-N 1 1 350.422 4.261 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cc1OC ZINC000051283938 1082991976 /nfs/dbraw/zinc/99/19/76/1082991976.db2.gz QILSZZDIKOHGBD-INIZCTEOSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cc1OC ZINC000051283938 1082991978 /nfs/dbraw/zinc/99/19/78/1082991978.db2.gz QILSZZDIKOHGBD-INIZCTEOSA-N 1 1 360.385 4.088 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]2CCC[C@@H]2OCc2ccccc2)c(F)c1 ZINC000510632677 1083213686 /nfs/dbraw/zinc/21/36/86/1083213686.db2.gz WPPPTMGZROTUHY-OALUTQOASA-N 1 1 362.376 4.101 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000430941358 1083244656 /nfs/dbraw/zinc/24/46/56/1083244656.db2.gz WAXOMFYPGICAMG-PKOBYXMFSA-N 1 1 354.450 4.380 20 5 FIBDMO CC[N@H+](Cc1cnn(C)c1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000092437677 1083405961 /nfs/dbraw/zinc/40/59/61/1083405961.db2.gz SHHYNFQQXYGMJO-UHFFFAOYSA-N 1 1 356.451 4.079 20 5 FIBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+](Cc4ccccc4[N+](=O)[O-])C3)nc2c1 ZINC000535666917 1083501444 /nfs/dbraw/zinc/50/14/44/1083501444.db2.gz VFRLVTXUSVMWDU-MRXNPFEDSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@H+](Cc4ccccc4[N+](=O)[O-])C3)[nH]c2c1 ZINC000535666917 1083501450 /nfs/dbraw/zinc/50/14/50/1083501450.db2.gz VFRLVTXUSVMWDU-MRXNPFEDSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@@H+](Cc4ccccc4[N+](=O)[O-])C3)[nH]c2c1 ZINC000535666917 1083501459 /nfs/dbraw/zinc/50/14/59/1083501459.db2.gz VFRLVTXUSVMWDU-MRXNPFEDSA-N 1 1 350.422 4.159 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(Br)c1 ZINC000548935743 1083858607 /nfs/dbraw/zinc/85/86/07/1083858607.db2.gz VNZGJCIPDHCNEH-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](c2ccco2)C1 ZINC000247694584 1083864236 /nfs/dbraw/zinc/86/42/36/1083864236.db2.gz WMQMTBMUYOPGPN-SUMWQHHRSA-N 1 1 358.394 4.028 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](c2ccco2)C1 ZINC000247694584 1083864258 /nfs/dbraw/zinc/86/42/58/1083864258.db2.gz WMQMTBMUYOPGPN-SUMWQHHRSA-N 1 1 358.394 4.028 20 5 FIBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000612540002 1083902149 /nfs/dbraw/zinc/90/21/49/1083902149.db2.gz QGBCHCRTJYXEBB-BEFAXECRSA-N 1 1 362.376 4.225 20 5 FIBDMO O=[N+]([O-])c1cccc([C@H]([NH2+]Cc2ccc3c(c2)OCO3)c2ccccc2)c1 ZINC000179970817 1083945008 /nfs/dbraw/zinc/94/50/08/1083945008.db2.gz CGHCCTLJPJKJIN-OAQYLSRUSA-N 1 1 362.385 4.203 20 5 FIBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CCCC2(CCCC2)C1 ZINC000782636207 1084014211 /nfs/dbraw/zinc/01/42/11/1084014211.db2.gz FNMGYOLWQAVSKM-CYBMUJFWSA-N 1 1 365.861 4.231 20 5 FIBDMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CCCC2(CCCC2)C1 ZINC000782636207 1084014232 /nfs/dbraw/zinc/01/42/32/1084014232.db2.gz FNMGYOLWQAVSKM-CYBMUJFWSA-N 1 1 365.861 4.231 20 5 FIBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000550000386 1084060521 /nfs/dbraw/zinc/06/05/21/1084060521.db2.gz QHYANIWNYDAONQ-GZMMTYOYSA-N 1 1 356.266 4.386 20 5 FIBDMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000550000386 1084060529 /nfs/dbraw/zinc/06/05/29/1084060529.db2.gz QHYANIWNYDAONQ-GZMMTYOYSA-N 1 1 356.266 4.386 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000613025678 1084275489 /nfs/dbraw/zinc/27/54/89/1084275489.db2.gz KJYCJRXEUPZMBS-HXUWFJFHSA-N 1 1 367.449 4.459 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](COC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000539088872 1084313571 /nfs/dbraw/zinc/31/35/71/1084313571.db2.gz BTSLLDJGVSLLBD-CXAGYDPISA-N 1 1 362.401 4.171 20 5 FIBDMO Cc1cc(NCc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)ccc1[N+](=O)[O-] ZINC000071952689 1084374556 /nfs/dbraw/zinc/37/45/56/1084374556.db2.gz MSWUBSLFHVIREQ-CALCHBBNSA-N 1 1 369.465 4.125 20 5 FIBDMO C[NH+](C)Cc1ccsc1C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000580356802 1084410602 /nfs/dbraw/zinc/41/06/02/1084410602.db2.gz UVFLKVPFGOLQRU-UHFFFAOYSA-N 1 1 361.467 4.268 20 5 FIBDMO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000580518080 1084430938 /nfs/dbraw/zinc/43/09/38/1084430938.db2.gz HNYPHGDCSWWIKT-CYBMUJFWSA-N 1 1 354.410 4.109 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2cccs2)n1 ZINC000511073136 1084623254 /nfs/dbraw/zinc/62/32/54/1084623254.db2.gz OIXCJCRSBRNXTP-UHFFFAOYSA-N 1 1 359.476 4.454 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2cccs2)n1 ZINC000511073136 1084623259 /nfs/dbraw/zinc/62/32/59/1084623259.db2.gz OIXCJCRSBRNXTP-UHFFFAOYSA-N 1 1 359.476 4.454 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(Cl)cc2cccnc21 ZINC000511074833 1084631425 /nfs/dbraw/zinc/63/14/25/1084631425.db2.gz PYAFGUASFBRQMU-UHFFFAOYSA-N 1 1 355.825 4.471 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Br)s1 ZINC000511075526 1084641727 /nfs/dbraw/zinc/64/17/27/1084641727.db2.gz ZOUYOYZYQJIXIL-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO COc1cc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379430 1084667870 /nfs/dbraw/zinc/66/78/70/1084667870.db2.gz SLAWWHZEOWXDAG-GOSISDBHSA-N 1 1 362.426 4.033 20 5 FIBDMO COc1cc(C[N@H+]2CCS[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379430 1084667875 /nfs/dbraw/zinc/66/78/75/1084667875.db2.gz SLAWWHZEOWXDAG-GOSISDBHSA-N 1 1 362.426 4.033 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)o1 ZINC000539897038 1084694573 /nfs/dbraw/zinc/69/45/73/1084694573.db2.gz XWYSYPLQAJPZBQ-CVEARBPZSA-N 1 1 356.422 4.103 20 5 FIBDMO CC(C)(CO)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1cccs1 ZINC000582574509 1084770750 /nfs/dbraw/zinc/77/07/50/1084770750.db2.gz GQMATSNYOJODKP-HNNXBMFYSA-N 1 1 354.859 4.159 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2cccc(F)c2)n1 ZINC000511138646 1085067112 /nfs/dbraw/zinc/06/71/12/1085067112.db2.gz FWNVIUMZHODLDN-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2cccc(F)c2)n1 ZINC000511138646 1085067119 /nfs/dbraw/zinc/06/71/19/1085067119.db2.gz FWNVIUMZHODLDN-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@@H](C)Nc2ncnc3ccc([N+](=O)[O-])cc32)cc1 ZINC000611709928 1085422378 /nfs/dbraw/zinc/42/23/78/1085422378.db2.gz VUZGMBOCIMWDTH-CYBMUJFWSA-N 1 1 374.404 4.205 20 5 FIBDMO CCC[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000181780740 1085555178 /nfs/dbraw/zinc/55/51/78/1085555178.db2.gz OBGRGCLHMOZFAC-QGZVFWFLSA-N 1 1 352.394 4.276 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000024673541 1085691510 /nfs/dbraw/zinc/69/15/10/1085691510.db2.gz ZJPMORFAJGUCGU-MRXNPFEDSA-N 1 1 367.449 4.142 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000178729867 1085965890 /nfs/dbraw/zinc/96/58/90/1085965890.db2.gz KIHGGWNYFGJAIF-QGZVFWFLSA-N 1 1 354.406 4.140 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Br)s2)c(Cl)c1 ZINC000049963483 1086079380 /nfs/dbraw/zinc/07/93/80/1086079380.db2.gz PSXDLCPISFDNOP-UHFFFAOYSA-N 1 1 361.648 4.362 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC001167658706 1086388488 /nfs/dbraw/zinc/38/84/88/1086388488.db2.gz KNOOCNRQBQROTO-MRXNPFEDSA-N 1 1 363.477 4.210 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCC2(CCCC2)CC1 ZINC000583408917 1086654546 /nfs/dbraw/zinc/65/45/46/1086654546.db2.gz SGWIKHXSZYWIIW-ZDUSSCGKSA-N 1 1 365.861 4.231 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)CC[C@H]1c1ccccc1 ZINC000512166174 1086864799 /nfs/dbraw/zinc/86/47/99/1086864799.db2.gz NKXQVVRXFJGGRB-QAPCUYQASA-N 1 1 367.449 4.315 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)CC[C@H]1c1ccccc1 ZINC000512166174 1086864808 /nfs/dbraw/zinc/86/48/08/1086864808.db2.gz NKXQVVRXFJGGRB-QAPCUYQASA-N 1 1 367.449 4.315 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C)CC[C@H]1c1ccccc1 ZINC000512166175 1086866200 /nfs/dbraw/zinc/86/62/00/1086866200.db2.gz NKXQVVRXFJGGRB-YJBOKZPZSA-N 1 1 367.449 4.315 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C)CC[C@H]1c1ccccc1 ZINC000512166175 1086866212 /nfs/dbraw/zinc/86/62/12/1086866212.db2.gz NKXQVVRXFJGGRB-YJBOKZPZSA-N 1 1 367.449 4.315 20 5 FIBDMO CC(C)(C)C1=CC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000536172899 1087066971 /nfs/dbraw/zinc/06/69/71/1087066971.db2.gz MUYAIOOCCIKSHC-UHFFFAOYSA-N 1 1 355.438 4.471 20 5 FIBDMO C[NH+](C)C[C@H](N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000584223782 1087223573 /nfs/dbraw/zinc/22/35/73/1087223573.db2.gz ZHRUXUTYDCRNQP-UXHICEINSA-N 1 1 371.456 4.349 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC(O)(c2ccccc2Cl)CC1 ZINC000588600612 1087369039 /nfs/dbraw/zinc/36/90/39/1087369039.db2.gz OYHWUWMZHYMYFB-ALCCZGGFSA-N 1 1 372.852 4.245 20 5 FIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cccnc2)cc1OC ZINC000611932122 1087590134 /nfs/dbraw/zinc/59/01/34/1087590134.db2.gz QXIWWSWXCRQNSF-LSDHHAIUSA-N 1 1 373.453 4.274 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000708576790 1087594874 /nfs/dbraw/zinc/59/48/74/1087594874.db2.gz INBGQUZVWCOONE-HOCLYGCPSA-N 1 1 359.857 4.428 20 5 FIBDMO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cccnc2)cc1OC ZINC000542123692 1087610864 /nfs/dbraw/zinc/61/08/64/1087610864.db2.gz QXIWWSWXCRQNSF-GJZGRUSLSA-N 1 1 373.453 4.274 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](Cc4ccncc4)C3)o2)cc1 ZINC000611983803 1087673446 /nfs/dbraw/zinc/67/34/46/1087673446.db2.gz LLCYZNKEYVRKDV-QGZVFWFLSA-N 1 1 363.417 4.314 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180421668 1087909091 /nfs/dbraw/zinc/90/90/91/1087909091.db2.gz PDYLLBREKGWBNY-ZDUSSCGKSA-N 1 1 359.382 4.141 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2nc3cc(C)ccc3[nH]2)cc1[N+](=O)[O-] ZINC000504921524 1087973456 /nfs/dbraw/zinc/97/34/56/1087973456.db2.gz SVVUWIVXDWYUMD-CYBMUJFWSA-N 1 1 354.410 4.029 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)C3CCCC3)o2)c(Cl)c1 ZINC000505271135 1088309642 /nfs/dbraw/zinc/30/96/42/1088309642.db2.gz FNVLVXIMAINJTJ-UHFFFAOYSA-N 1 1 364.829 4.245 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000514176490 1088863171 /nfs/dbraw/zinc/86/31/71/1088863171.db2.gz QKGIYNAHVTYELJ-UHFFFAOYSA-N 1 1 357.376 4.068 20 5 FIBDMO Cc1nn2c(nc(C(C)C)c2C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])s1 ZINC000430128418 1089369147 /nfs/dbraw/zinc/36/91/47/1089369147.db2.gz GTUDYVQSENPYHO-UHFFFAOYSA-N 1 1 373.482 4.156 20 5 FIBDMO Cc1cc(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000514838315 1089515916 /nfs/dbraw/zinc/51/59/16/1089515916.db2.gz FUQMXHMMQQDCIK-UHFFFAOYSA-N 1 1 368.412 4.075 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCCC4(CCOCC4)C3)cs2)c1 ZINC000271197307 1089997924 /nfs/dbraw/zinc/99/79/24/1089997924.db2.gz RYPCLZUEKCFRMR-UHFFFAOYSA-N 1 1 373.478 4.111 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccc(F)c(F)c1 ZINC000104666352 1090289021 /nfs/dbraw/zinc/28/90/21/1090289021.db2.gz RJORHETVVNDZJY-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO Cc1ccc([C@@H]2C[C@@H](C)CC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])o1 ZINC000500098157 1091037867 /nfs/dbraw/zinc/03/78/67/1091037867.db2.gz OOJQGVDENZEYAA-KSSFIOAISA-N 1 1 371.437 4.298 20 5 FIBDMO COCCCC[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000418142953 1091081289 /nfs/dbraw/zinc/08/12/89/1091081289.db2.gz YUWZYOFOJWZYLY-UHFFFAOYSA-N 1 1 362.401 4.385 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](CO)c2ccc(C(F)(F)F)cc2)c(Cl)c1 ZINC000542044917 1091839071 /nfs/dbraw/zinc/83/90/71/1091839071.db2.gz AAQXMBUEPPHZHW-OAHLLOKOSA-N 1 1 374.746 4.090 20 5 FIBDMO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000520879820 1092323625 /nfs/dbraw/zinc/32/36/25/1092323625.db2.gz TYUUECRFABXOQN-RNODOKPDSA-N 1 1 350.374 4.467 20 5 FIBDMO Cc1sc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)cc1[N+](=O)[O-] ZINC000500763080 1092535458 /nfs/dbraw/zinc/53/54/58/1092535458.db2.gz UOZMWSLUSDURKO-CYBMUJFWSA-N 1 1 373.478 4.449 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000521424456 1092691173 /nfs/dbraw/zinc/69/11/73/1092691173.db2.gz FDDLMFASCMVOMW-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)Cc1cccc(C(F)(F)F)c1 ZINC000521424456 1092691183 /nfs/dbraw/zinc/69/11/83/1092691183.db2.gz FDDLMFASCMVOMW-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236933701 1092812069 /nfs/dbraw/zinc/81/20/69/1092812069.db2.gz NABDOKDIZXKVBC-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CC[N@@H+]1CCC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236933701 1092812076 /nfs/dbraw/zinc/81/20/76/1092812076.db2.gz NABDOKDIZXKVBC-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CC[N@H+]1CCC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236933701 1092812092 /nfs/dbraw/zinc/81/20/92/1092812092.db2.gz NABDOKDIZXKVBC-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CCN1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000236933701 1092812114 /nfs/dbraw/zinc/81/21/14/1092812114.db2.gz NABDOKDIZXKVBC-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CC(C)c1ncc(C[N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cn1 ZINC000443058665 1092923170 /nfs/dbraw/zinc/92/31/70/1092923170.db2.gz AIFDVFGYLXDDAX-UHFFFAOYSA-N 1 1 366.421 4.400 20 5 FIBDMO CC(C)c1ncc(C[N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)cn1 ZINC000443058665 1092923179 /nfs/dbraw/zinc/92/31/79/1092923179.db2.gz AIFDVFGYLXDDAX-UHFFFAOYSA-N 1 1 366.421 4.400 20 5 FIBDMO CC(C)[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(F)cc1 ZINC000521859636 1092951648 /nfs/dbraw/zinc/95/16/48/1092951648.db2.gz LHJSVIKRWBGACI-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO CC(C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1ccc(F)cc1 ZINC000521859636 1092951649 /nfs/dbraw/zinc/95/16/49/1092951649.db2.gz LHJSVIKRWBGACI-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](OC(F)F)C3)o2)c(Cl)c1 ZINC000522016677 1093035624 /nfs/dbraw/zinc/03/56/24/1093035624.db2.gz NLLVGBVQLGJPHZ-LBPRGKRZSA-N 1 1 372.755 4.322 20 5 FIBDMO Cc1cccc([C@@H]2CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000542318075 1093242410 /nfs/dbraw/zinc/24/24/10/1093242410.db2.gz RMCUEXOWXKWWCA-GOSISDBHSA-N 1 1 367.449 4.030 20 5 FIBDMO COc1ccc2cc(C[N@@H+](C)CCc3ccc([N+](=O)[O-])cc3)ccc2c1 ZINC000522268451 1093254503 /nfs/dbraw/zinc/25/45/03/1093254503.db2.gz NSCIKAFOYHLNFQ-UHFFFAOYSA-N 1 1 350.418 4.431 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000063549433 1093300657 /nfs/dbraw/zinc/30/06/57/1093300657.db2.gz HFPFQTCXLYNACJ-IBGZPJMESA-N 1 1 371.412 4.208 20 5 FIBDMO CCCOc1ncccc1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144330 1093321153 /nfs/dbraw/zinc/32/11/53/1093321153.db2.gz LXGGCBNEOITGLL-SFHVURJKSA-N 1 1 355.438 4.291 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]([C@H](C)c1ccco1)C1CC1 ZINC000086234967 1093894767 /nfs/dbraw/zinc/89/47/67/1093894767.db2.gz PNYGBLRTTGCPRR-CQSZACIVSA-N 1 1 357.410 4.050 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473512385 1093905493 /nfs/dbraw/zinc/90/54/93/1093905493.db2.gz HSSHTZPEROQQEL-IAGOWNOFSA-N 1 1 368.481 4.234 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000513256247 1094038846 /nfs/dbraw/zinc/03/88/46/1094038846.db2.gz KQNPVTOAACKDIR-KDOFPFPSSA-N 1 1 364.405 4.228 20 5 FIBDMO CCN(C[C@@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1)CC(F)(F)F ZINC000182823757 1094172732 /nfs/dbraw/zinc/17/27/32/1094172732.db2.gz WRPCSUAIEQHNCS-GJZGRUSLSA-N 1 1 373.419 4.170 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(Sc2ccccn2)o1 ZINC000513552636 1094209497 /nfs/dbraw/zinc/20/94/97/1094209497.db2.gz CICSIABLACLSKN-UHFFFAOYSA-N 1 1 369.446 4.409 20 5 FIBDMO CCC[C@@H]([NH2+][C@H]1CCCn2nc(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000167982759 1094284885 /nfs/dbraw/zinc/28/48/85/1094284885.db2.gz TXASDSIJLJFBFU-SJORKVTESA-N 1 1 357.458 4.276 20 5 FIBDMO C[C@@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000413233271 1094765383 /nfs/dbraw/zinc/76/53/83/1094765383.db2.gz CRUGBYBBHAQPMX-VXGBXAGGSA-N 1 1 372.391 4.074 20 5 FIBDMO COc1cc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@H]2C)c([N+](=O)[O-])cc1F ZINC000503369929 1096369795 /nfs/dbraw/zinc/36/97/95/1096369795.db2.gz GNIKPXMWONVGKU-ADLMAVQZSA-N 1 1 364.804 4.421 20 5 FIBDMO CCCCN1CCC([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000513790471 1096436208 /nfs/dbraw/zinc/43/62/08/1096436208.db2.gz YKRSDVXULWEMLW-XLIONFOSSA-N 1 1 359.514 4.160 20 5 FIBDMO CC[C@H](NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000423471486 1096693957 /nfs/dbraw/zinc/69/39/57/1096693957.db2.gz MFRHVZFDMCCXST-WMQCIHAUSA-N 1 1 371.456 4.168 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000515410492 1098561889 /nfs/dbraw/zinc/56/18/89/1098561889.db2.gz ITJKPCKMCNYEMN-OAHLLOKOSA-N 1 1 353.422 4.222 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc(Cl)c(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000533039042 1098702881 /nfs/dbraw/zinc/70/28/81/1098702881.db2.gz MYZMRKGACPWIMW-GFCCVEGCSA-N 1 1 361.829 4.052 20 5 FIBDMO Cc1ccc([C@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000533247847 1098909641 /nfs/dbraw/zinc/90/96/41/1098909641.db2.gz NSUOOCONGFVWTP-HXUWFJFHSA-N 1 1 367.449 4.012 20 5 FIBDMO C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000436330641 1098934149 /nfs/dbraw/zinc/93/41/49/1098934149.db2.gz MCIAMLOULOHRGQ-RYUDHWBXSA-N 1 1 372.391 4.074 20 5 FIBDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000533293960 1098942546 /nfs/dbraw/zinc/94/25/46/1098942546.db2.gz BNLBCBBJGWBMGI-HNNXBMFYSA-N 1 1 366.421 4.016 20 5 FIBDMO C[C@@H](c1ccc(F)c(Cl)c1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000533380297 1098996327 /nfs/dbraw/zinc/99/63/27/1098996327.db2.gz HUDQYWZKFZPFND-WCQYABFASA-N 1 1 364.808 4.030 20 5 FIBDMO C[C@@H](c1ccc(F)c(Cl)c1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000533380297 1098996331 /nfs/dbraw/zinc/99/63/31/1098996331.db2.gz HUDQYWZKFZPFND-WCQYABFASA-N 1 1 364.808 4.030 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000533435532 1099055168 /nfs/dbraw/zinc/05/51/68/1099055168.db2.gz IAOYKGHLJPDULI-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@H](c3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000533435583 1099055748 /nfs/dbraw/zinc/05/57/48/1099055748.db2.gz LYBVWMIVCSHKDD-MAUKXSAKSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cccc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000064350553 1099345844 /nfs/dbraw/zinc/34/58/44/1099345844.db2.gz WRGDSHOFLXDERR-UHFFFAOYSA-N 1 1 355.438 4.061 20 5 FIBDMO Cc1cccc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1C ZINC000064350553 1099345858 /nfs/dbraw/zinc/34/58/58/1099345858.db2.gz WRGDSHOFLXDERR-UHFFFAOYSA-N 1 1 355.438 4.061 20 5 FIBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000508671901 1099477986 /nfs/dbraw/zinc/47/79/86/1099477986.db2.gz PHMXUDAIHPCMGD-IBGZPJMESA-N 1 1 356.422 4.435 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000437094530 1099597312 /nfs/dbraw/zinc/59/73/12/1099597312.db2.gz VTIKELMSDGVWLZ-MLGOLLRUSA-N 1 1 360.385 4.307 20 5 FIBDMO COc1ccc(C[N@H+]2CCC[C@H]2C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000536674198 1100160383 /nfs/dbraw/zinc/16/03/83/1100160383.db2.gz PGEHWOVNKTVYIK-OAHLLOKOSA-N 1 1 356.422 4.167 20 5 FIBDMO Cn1cc(C[N@H+]2CCC3(C2)CCCCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536677534 1100169413 /nfs/dbraw/zinc/16/94/13/1100169413.db2.gz FDRGNDOPRCFYIJ-UHFFFAOYSA-N 1 1 354.454 4.152 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000536703801 1100209843 /nfs/dbraw/zinc/20/98/43/1100209843.db2.gz ZNINXKKZJTYCPH-CHWSQXEVSA-N 1 1 365.861 4.087 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000536703801 1100209852 /nfs/dbraw/zinc/20/98/52/1100209852.db2.gz ZNINXKKZJTYCPH-CHWSQXEVSA-N 1 1 365.861 4.087 20 5 FIBDMO CC(C)C[N@@H+](Cc1cnn(C)c1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000459597441 1100334490 /nfs/dbraw/zinc/33/44/90/1100334490.db2.gz PJJMAGUHYWGNPP-UHFFFAOYSA-N 1 1 370.375 4.005 20 5 FIBDMO Cc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000459642980 1100380924 /nfs/dbraw/zinc/38/09/24/1100380924.db2.gz CICGFMXFIIBIBZ-INIZCTEOSA-N 1 1 372.387 4.084 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@@H+]1CCCC[C@@H]1C ZINC000517535990 1100473029 /nfs/dbraw/zinc/47/30/29/1100473029.db2.gz SDRQPFVVYTVTAP-JKSUJKDBSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@H+]1CCCC[C@@H]1C ZINC000517535990 1100473034 /nfs/dbraw/zinc/47/30/34/1100473034.db2.gz SDRQPFVVYTVTAP-JKSUJKDBSA-N 1 1 357.454 4.207 20 5 FIBDMO CC(=O)c1cc(NC[C@@H](c2ccco2)[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000517594556 1100520261 /nfs/dbraw/zinc/52/02/61/1100520261.db2.gz CMGGAGALDHLHPG-SFHVURJKSA-N 1 1 357.410 4.030 20 5 FIBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000550000391 1100588182 /nfs/dbraw/zinc/58/81/82/1100588182.db2.gz QHYANIWNYDAONQ-LDYMZIIASA-N 1 1 356.266 4.386 20 5 FIBDMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000550000391 1100588190 /nfs/dbraw/zinc/58/81/90/1100588190.db2.gz QHYANIWNYDAONQ-LDYMZIIASA-N 1 1 356.266 4.386 20 5 FIBDMO C[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+]1CCC[C@@H](C)C1 ZINC000518031469 1100874783 /nfs/dbraw/zinc/87/47/83/1100874783.db2.gz VJAGHZJMENWWTM-SJORKVTESA-N 1 1 361.489 4.238 20 5 FIBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ccc(C)c(C)n3)o2)c([N+](=O)[O-])c1 ZINC000459674008 1101313737 /nfs/dbraw/zinc/31/37/37/1101313737.db2.gz ROBADHZPUXAIOD-UHFFFAOYSA-N 1 1 367.405 4.165 20 5 FIBDMO C[N@@H+](CCc1cccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1)C1CC1 ZINC000537128173 1101484644 /nfs/dbraw/zinc/48/46/44/1101484644.db2.gz XQXFHLCOCGLUFL-UHFFFAOYSA-N 1 1 373.840 4.137 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2C/C=C/c2ccccc2[N+](=O)[O-])cc1OC ZINC000506636063 1101631650 /nfs/dbraw/zinc/63/16/50/1101631650.db2.gz ZSHMXNHGJZHCAE-KRZKXXONSA-N 1 1 368.433 4.462 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2C/C=C\c2ccccc2[N+](=O)[O-])cc1OC ZINC000506636061 1101631691 /nfs/dbraw/zinc/63/16/91/1101631691.db2.gz ZSHMXNHGJZHCAE-GNJLHFKMSA-N 1 1 368.433 4.462 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)[C@H]2CC[C@H](O)CC2)cc1[N+](=O)[O-] ZINC000439777120 1101757530 /nfs/dbraw/zinc/75/75/30/1101757530.db2.gz ZHEXAKCGXKGGQP-UAPYVXQJSA-N 1 1 369.465 4.098 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000026226339 1101948258 /nfs/dbraw/zinc/94/82/58/1101948258.db2.gz RLJGJJFLFCNKPH-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCCC[C@H]12 ZINC000532470977 1102389469 /nfs/dbraw/zinc/38/94/69/1102389469.db2.gz DAJAMLNMTFTHSG-XYPHTWIQSA-N 1 1 356.426 4.045 20 5 FIBDMO O=C(C[N@H+]1CCCCC[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000532490495 1102423100 /nfs/dbraw/zinc/42/31/00/1102423100.db2.gz ZQDACNBLLFAKAS-SFHVURJKSA-N 1 1 353.422 4.151 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(Br)c(Cl)s1 ZINC000191694453 1102572180 /nfs/dbraw/zinc/57/21/80/1102572180.db2.gz ONQVCKUEKSZPJG-UHFFFAOYSA-N 1 1 361.648 4.362 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](c3nc4c(s3)CCCC4)C2)c1 ZINC000532638030 1102627710 /nfs/dbraw/zinc/62/77/10/1102627710.db2.gz WNRDBFYDBIWSQW-HNNXBMFYSA-N 1 1 357.479 4.310 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000537651178 1102704185 /nfs/dbraw/zinc/70/41/85/1102704185.db2.gz ZJGWZLNDHCEWHC-ZAOIQFLMSA-N 1 1 352.434 4.147 20 5 FIBDMO O=C(CC[N@H+]1CCC[C@@H](c2ccccc2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000550990856 1102750441 /nfs/dbraw/zinc/75/04/41/1102750441.db2.gz BYGJVBUQRQELGW-GOSISDBHSA-N 1 1 367.449 4.193 20 5 FIBDMO Cc1cc(C)n(-c2ccc(C[N@@H+](C)Cc3ccccc3[N+](=O)[O-])cc2)n1 ZINC000192640721 1102772559 /nfs/dbraw/zinc/77/25/59/1102772559.db2.gz IKTUBCKJWMIJES-UHFFFAOYSA-N 1 1 350.422 4.029 20 5 FIBDMO Cc1cc(C)n(-c2ccc(C[N@H+](C)Cc3ccccc3[N+](=O)[O-])cc2)n1 ZINC000192640721 1102772572 /nfs/dbraw/zinc/77/25/72/1102772572.db2.gz IKTUBCKJWMIJES-UHFFFAOYSA-N 1 1 350.422 4.029 20 5 FIBDMO C[N@H+](Cc1ccc(Br)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507147406 1103148297 /nfs/dbraw/zinc/14/82/97/1103148297.db2.gz YIVHRDAENYIRPZ-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO C[N@@H+](Cc1ccc(Br)c(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000507147406 1103148301 /nfs/dbraw/zinc/14/83/01/1103148301.db2.gz YIVHRDAENYIRPZ-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO CCN(CC)c1ncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000507161330 1103161861 /nfs/dbraw/zinc/16/18/61/1103161861.db2.gz QAQITGVRKSTXHZ-UHFFFAOYSA-N 1 1 360.483 4.062 20 5 FIBDMO CCN(CC)c1ncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000507161330 1103161870 /nfs/dbraw/zinc/16/18/70/1103161870.db2.gz QAQITGVRKSTXHZ-UHFFFAOYSA-N 1 1 360.483 4.062 20 5 FIBDMO CCOc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1OC ZINC000507165771 1103164991 /nfs/dbraw/zinc/16/49/91/1103164991.db2.gz AHEGWWMFKJRMNT-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CCOc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1OC ZINC000507165771 1103164998 /nfs/dbraw/zinc/16/49/98/1103164998.db2.gz AHEGWWMFKJRMNT-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CC[N@@H+](CCc1ccccc1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507165806 1103165326 /nfs/dbraw/zinc/16/53/26/1103165326.db2.gz AWZACTJSAYFVFD-UHFFFAOYSA-N 1 1 364.449 4.060 20 5 FIBDMO COc1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1SC ZINC000507167879 1103166805 /nfs/dbraw/zinc/16/68/05/1103166805.db2.gz PAMIGBGHDRYQBZ-UHFFFAOYSA-N 1 1 358.463 4.490 20 5 FIBDMO COc1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1SC ZINC000507167879 1103166813 /nfs/dbraw/zinc/16/68/13/1103166813.db2.gz PAMIGBGHDRYQBZ-UHFFFAOYSA-N 1 1 358.463 4.490 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)no1)Cc1ccccc1[N+](=O)[O-] ZINC000507178240 1103178618 /nfs/dbraw/zinc/17/86/18/1103178618.db2.gz FDDVXJOTNMRUDU-UHFFFAOYSA-N 1 1 351.406 4.314 20 5 FIBDMO COCC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC1 ZINC000507170155 1103186981 /nfs/dbraw/zinc/18/69/81/1103186981.db2.gz ZNVNAGFJJHHJAE-UHFFFAOYSA-N 1 1 350.802 4.119 20 5 FIBDMO CC(C)[N@@H+](Cc1c[nH]nc1-c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000507173376 1103193592 /nfs/dbraw/zinc/19/35/92/1103193592.db2.gz MCICTVKKKIOKCB-UHFFFAOYSA-N 1 1 350.422 4.396 20 5 FIBDMO Cc1c([C@H](C)[NH2+][C@H](CN2CCCC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000120833507 1103374330 /nfs/dbraw/zinc/37/43/30/1103374330.db2.gz MFYDKJLCEHGJAB-FXAWDEMLSA-N 1 1 353.466 4.391 20 5 FIBDMO Cc1ccc([C@@H](CC(=O)OC(C)C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000538269331 1104091532 /nfs/dbraw/zinc/09/15/32/1104091532.db2.gz VPCRLWAJSDLWDF-GOSISDBHSA-N 1 1 356.422 4.076 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCCCC[C@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000441377300 1104317057 /nfs/dbraw/zinc/31/70/57/1104317057.db2.gz ASZBOTKJWSPMPT-INIZCTEOSA-N 1 1 360.410 4.193 20 5 FIBDMO COCc1nc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(-c2ccccc2)s1 ZINC000441389051 1104325795 /nfs/dbraw/zinc/32/57/95/1104325795.db2.gz UGFUJSFHTSDDAP-UHFFFAOYSA-N 1 1 369.446 4.155 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000441403299 1104345964 /nfs/dbraw/zinc/34/59/64/1104345964.db2.gz KQHVLVCEUIXTMV-HOCLYGCPSA-N 1 1 356.397 4.390 20 5 FIBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCc2sccc2C1 ZINC000520747957 1105192887 /nfs/dbraw/zinc/19/28/87/1105192887.db2.gz QUHAAWNKGWLDML-NSHDSACASA-N 1 1 351.859 4.168 20 5 FIBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCc2sccc2C1 ZINC000520747957 1105192888 /nfs/dbraw/zinc/19/28/88/1105192888.db2.gz QUHAAWNKGWLDML-NSHDSACASA-N 1 1 351.859 4.168 20 5 FIBDMO CC(C)c1nnc([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000536495857 1105220489 /nfs/dbraw/zinc/22/04/89/1105220489.db2.gz CHWGLOJMRBOINK-GFCCVEGCSA-N 1 1 371.466 4.416 20 5 FIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccc(C(F)(F)F)c1 ZINC000520785479 1105274546 /nfs/dbraw/zinc/27/45/46/1105274546.db2.gz VZPFQPFKFKCBNI-UHFFFAOYSA-N 1 1 354.328 4.124 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@H+]2CCC[C@@](C)(O)CC2)cc1[N+](=O)[O-] ZINC000475333063 1106737758 /nfs/dbraw/zinc/73/77/58/1106737758.db2.gz RUKLSKQTWNLJMI-OAQYLSRUSA-N 1 1 369.465 4.100 20 5 FIBDMO CO[C@@H](C)c1nc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451543132 1107163873 /nfs/dbraw/zinc/16/38/73/1107163873.db2.gz AYLZMBYVRDHILB-ZFWWWQNUSA-N 1 1 361.467 4.138 20 5 FIBDMO CO[C@@H](C)c1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451543132 1107163880 /nfs/dbraw/zinc/16/38/80/1107163880.db2.gz AYLZMBYVRDHILB-ZFWWWQNUSA-N 1 1 361.467 4.138 20 5 FIBDMO Cc1ccccc1NC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548445 1107169327 /nfs/dbraw/zinc/16/93/27/1107169327.db2.gz NGJKDNWLUPQIER-SJLPKXTDSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccccc1NC(=O)[C@@H](C)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548445 1107169337 /nfs/dbraw/zinc/16/93/37/1107169337.db2.gz NGJKDNWLUPQIER-SJLPKXTDSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1ccccc1CN1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000530626142 1107206164 /nfs/dbraw/zinc/20/61/64/1107206164.db2.gz QLAOVHZKUGQPEY-QFIPXVFZSA-N 1 1 365.477 4.083 20 5 FIBDMO COC[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(F)cc1 ZINC000530729488 1107292394 /nfs/dbraw/zinc/29/23/94/1107292394.db2.gz VQBLCPZXHDWVPQ-IBGZPJMESA-N 1 1 370.380 4.471 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000508482872 1107409065 /nfs/dbraw/zinc/40/90/65/1107409065.db2.gz CFLXNAYZLXSIOO-UHFFFAOYSA-N 1 1 355.438 4.387 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H](c1cccs1)C1(CO)CCC1 ZINC000452059458 1107454902 /nfs/dbraw/zinc/45/49/02/1107454902.db2.gz KMXCDAUJKQQLHQ-INIZCTEOSA-N 1 1 366.870 4.303 20 5 FIBDMO C[C@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[NH+]1CCC(C)CC1 ZINC000520221078 1108068104 /nfs/dbraw/zinc/06/81/04/1108068104.db2.gz LRTGKCQVJFJZEV-MRXNPFEDSA-N 1 1 357.454 4.065 20 5 FIBDMO COc1ccccc1[C@@H](CC(C)C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444672058 1108073543 /nfs/dbraw/zinc/07/35/43/1108073543.db2.gz FBONXZUPCZTGSB-QGZVFWFLSA-N 1 1 368.437 4.357 20 5 FIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(C(F)(F)F)cc1 ZINC000444681263 1108084129 /nfs/dbraw/zinc/08/41/29/1108084129.db2.gz TVAAMPZNHVDVFT-SNVBAGLBSA-N 1 1 364.327 4.341 20 5 FIBDMO COc1ccc(CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC(C)C)cc1OC ZINC000523761121 1108507176 /nfs/dbraw/zinc/50/71/76/1108507176.db2.gz XEVXPYZNSMUESE-UHFFFAOYSA-N 1 1 372.465 4.313 20 5 FIBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)C1=CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000453407324 1108507459 /nfs/dbraw/zinc/50/74/59/1108507459.db2.gz UUMOCBHKGSAEKA-SFHVURJKSA-N 1 1 354.454 4.144 20 5 FIBDMO COc1ccc(OCC[N@@H+](Cc2ccco2)C2CCCC2)c([N+](=O)[O-])c1 ZINC000441208775 1109453018 /nfs/dbraw/zinc/45/30/18/1109453018.db2.gz RJCZKMFOHJJPEJ-UHFFFAOYSA-N 1 1 360.410 4.020 20 5 FIBDMO COc1ccc(OCC[N@@H+](Cc2cccc(F)c2)C(C)C)c([N+](=O)[O-])c1 ZINC000441223078 1109475410 /nfs/dbraw/zinc/47/54/10/1109475410.db2.gz AXEALWBPOAWRHA-UHFFFAOYSA-N 1 1 362.401 4.032 20 5 FIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525783991 1109517866 /nfs/dbraw/zinc/51/78/66/1109517866.db2.gz HSDUORZRHYVBEV-DJJJIMSYSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@H]1C[C@@H](c2cccc(F)c2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525783991 1109517869 /nfs/dbraw/zinc/51/78/69/1109517869.db2.gz HSDUORZRHYVBEV-DJJJIMSYSA-N 1 1 372.396 4.184 20 5 FIBDMO CCC[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nnc2ccccn21 ZINC000447542138 1109574101 /nfs/dbraw/zinc/57/41/01/1109574101.db2.gz IBWINPCFZCWNDU-QZTJIDSGSA-N 1 1 365.437 4.146 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000526096955 1109618021 /nfs/dbraw/zinc/61/80/21/1109618021.db2.gz KVYSZXQHQITBEX-SJORKVTESA-N 1 1 374.485 4.022 20 5 FIBDMO COc1ccc(C[N@@H+]2[C@H](C)C[C@@H]2C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000527238483 1109720020 /nfs/dbraw/zinc/72/00/20/1109720020.db2.gz FOSJFZAUTNGYJW-GASCZTMLSA-N 1 1 356.422 4.165 20 5 FIBDMO C[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc2O1 ZINC000449422798 1110070970 /nfs/dbraw/zinc/07/09/70/1110070970.db2.gz FOYDJWBDELHLMV-IAQYHMDHSA-N 1 1 364.348 4.198 20 5 FIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@@H]1C ZINC000449492919 1110087862 /nfs/dbraw/zinc/08/78/62/1110087862.db2.gz CUQAUINPSIYPCN-YVEFUNNKSA-N 1 1 364.829 4.365 20 5 FIBDMO CC[N@H+]1CC[C@H](N(C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000538718095 1111260446 /nfs/dbraw/zinc/26/04/46/1111260446.db2.gz URSZNHBZTXIYMM-PBHICJAKSA-N 1 1 374.510 4.023 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)C(=O)N1CCC[C@@H]1c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000539327725 1111523040 /nfs/dbraw/zinc/52/30/40/1111523040.db2.gz BJCVCSIUKNLBIT-JKIFEVAISA-N 1 1 373.478 4.059 20 5 FIBDMO C[C@@H]1CCC[C@@H](CC[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552042453 1111555150 /nfs/dbraw/zinc/55/51/50/1111555150.db2.gz GONRTSQOSRRXNL-GJYPPUQNSA-N 1 1 356.470 4.224 20 5 FIBDMO CCS[C@@H]1CCC[C@@H]([NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552044581 1111555582 /nfs/dbraw/zinc/55/55/82/1111555582.db2.gz GWODRNJHBVCSPG-KBAYOESNSA-N 1 1 374.510 4.072 20 5 FIBDMO Cc1ccc([C@H](C)NCCC[N@@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000480227669 1112339953 /nfs/dbraw/zinc/33/99/53/1112339953.db2.gz IXGRWFDKYXKKTE-KRWDZBQOSA-N 1 1 353.466 4.002 20 5 FIBDMO C[C@@H](c1cccc(Cl)c1F)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000480767181 1112586256 /nfs/dbraw/zinc/58/62/56/1112586256.db2.gz DLMQKDMVPNPWLU-NWDGAFQWSA-N 1 1 364.808 4.030 20 5 FIBDMO C[C@@H](c1cccc(Cl)c1F)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000480767181 1112586261 /nfs/dbraw/zinc/58/62/61/1112586261.db2.gz DLMQKDMVPNPWLU-NWDGAFQWSA-N 1 1 364.808 4.030 20 5 FIBDMO CC[C@@H](NC[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482435447 1113254066 /nfs/dbraw/zinc/25/40/66/1113254066.db2.gz HQUPOFQNFDMJRS-DENIHFKCSA-N 1 1 367.493 4.200 20 5 FIBDMO CC[C@@H](NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482435447 1113254067 /nfs/dbraw/zinc/25/40/67/1113254067.db2.gz HQUPOFQNFDMJRS-DENIHFKCSA-N 1 1 367.493 4.200 20 5 FIBDMO CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000160041421 1113286906 /nfs/dbraw/zinc/28/69/06/1113286906.db2.gz GXNLJYKFARYBJA-QGZVFWFLSA-N 1 1 368.481 4.289 20 5 FIBDMO CCC[C@@H]([NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000129294236 1113822588 /nfs/dbraw/zinc/82/25/88/1113822588.db2.gz DIAHPWNGIVAGEF-DLBZAZTESA-N 1 1 353.426 4.220 20 5 FIBDMO Cc1cc(F)ccc1C[N@@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000488117185 1113859407 /nfs/dbraw/zinc/85/94/07/1113859407.db2.gz YPQDDFVAWSOBOT-CYBMUJFWSA-N 1 1 370.384 4.285 20 5 FIBDMO Cc1cc(F)ccc1C[N@H+](C)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000488117185 1113859412 /nfs/dbraw/zinc/85/94/12/1113859412.db2.gz YPQDDFVAWSOBOT-CYBMUJFWSA-N 1 1 370.384 4.285 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](C)c1ccc(F)cc1 ZINC000150324379 1113900531 /nfs/dbraw/zinc/90/05/31/1113900531.db2.gz HBEWCYLRMDZNEI-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO Cc1ccc([C@@H]2C[C@H](C)[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000490077281 1114213723 /nfs/dbraw/zinc/21/37/23/1114213723.db2.gz DIOOLVVACPLTBJ-GOEBONIOSA-N 1 1 351.406 4.422 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(N(C)C)c2)ccc1[N+](=O)[O-] ZINC000490083615 1114216332 /nfs/dbraw/zinc/21/63/32/1114216332.db2.gz BDYCKLKVDCEEFC-SFHVURJKSA-N 1 1 355.438 4.007 20 5 FIBDMO CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc[nH+]c(N(C)C)c1 ZINC000490882579 1114346759 /nfs/dbraw/zinc/34/67/59/1114346759.db2.gz HLEFBTSZISBDHX-UHFFFAOYSA-N 1 1 374.466 4.056 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1ccc([N+](=O)[O-])cc1F ZINC000491194951 1114379855 /nfs/dbraw/zinc/37/98/55/1114379855.db2.gz RKNOUINAQBZOGO-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000586778943 1114391992 /nfs/dbraw/zinc/39/19/92/1114391992.db2.gz GPNLULMFTSPMPN-QYZOEREBSA-N 1 1 372.852 4.253 20 5 FIBDMO CCN(Cc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000249702766 1114592939 /nfs/dbraw/zinc/59/29/39/1114592939.db2.gz DUOCUOHNQXIJPK-CRAIPNDOSA-N 1 1 359.495 4.314 20 5 FIBDMO CC1(C)CCC[C@H]1[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000592153478 1115216002 /nfs/dbraw/zinc/21/60/02/1115216002.db2.gz DLFIUUOOFVGEJJ-RDJZCZTQSA-N 1 1 370.453 4.293 20 5 FIBDMO Cc1ccccc1-n1cc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cn1 ZINC000592368138 1115280594 /nfs/dbraw/zinc/28/05/94/1115280594.db2.gz UINITDOPBDWZNX-UHFFFAOYSA-N 1 1 350.422 4.114 20 5 FIBDMO COc1ccc(C2CC[NH+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)nc1 ZINC000593041935 1115281621 /nfs/dbraw/zinc/28/16/21/1115281621.db2.gz SLTBMQMYYZHAQA-UHFFFAOYSA-N 1 1 361.829 4.031 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2ccco2)Cc2ccccc2)c1 ZINC000058933394 1115355449 /nfs/dbraw/zinc/35/54/49/1115355449.db2.gz VKUOKPJOMNZYNO-UHFFFAOYSA-N 1 1 352.390 4.269 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000595007512 1115508115 /nfs/dbraw/zinc/50/81/15/1115508115.db2.gz LHYSPTXROJGEMH-MRXNPFEDSA-N 1 1 371.481 4.294 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000595007512 1115508118 /nfs/dbraw/zinc/50/81/18/1115508118.db2.gz LHYSPTXROJGEMH-MRXNPFEDSA-N 1 1 371.481 4.294 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cc(Cl)cc2c1OCC2 ZINC000595030912 1115510085 /nfs/dbraw/zinc/51/00/85/1115510085.db2.gz CIGAZXYYQKBSNS-LLVKDONJSA-N 1 1 362.813 4.043 20 5 FIBDMO CCOc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)CCO2 ZINC000595031678 1115510250 /nfs/dbraw/zinc/51/02/50/1115510250.db2.gz BJMFZCOWVMYHFG-SCLBCKFNSA-N 1 1 372.421 4.177 20 5 FIBDMO Cn1cc[nH+]c1C[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000078558804 1115519816 /nfs/dbraw/zinc/51/98/16/1115519816.db2.gz RKDLONCJFJPBII-INIZCTEOSA-N 1 1 356.813 4.378 20 5 FIBDMO C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000595298053 1115521572 /nfs/dbraw/zinc/52/15/72/1115521572.db2.gz NTSLCQPKSSNVJN-XLIONFOSSA-N 1 1 358.413 4.334 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000595358221 1115533962 /nfs/dbraw/zinc/53/39/62/1115533962.db2.gz SHJFQONFZUDMEI-CQSZACIVSA-N 1 1 355.369 4.255 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cccc(OC(C)C)c2)c1 ZINC000593021873 1115540003 /nfs/dbraw/zinc/54/00/03/1115540003.db2.gz ZBBHVWZNWDNNIP-CQSZACIVSA-N 1 1 372.421 4.019 20 5 FIBDMO CC[C@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000593023077 1115540451 /nfs/dbraw/zinc/54/04/51/1115540451.db2.gz OSOORKHTPCAIJR-LBPRGKRZSA-N 1 1 368.842 4.337 20 5 FIBDMO CCC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1CCCCC1 ZINC000060495317 1115648564 /nfs/dbraw/zinc/64/85/64/1115648564.db2.gz SKIXSBMFHDWDJH-UHFFFAOYSA-N 1 1 358.442 4.437 20 5 FIBDMO CSc1cc(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccn1 ZINC000602600249 1115712689 /nfs/dbraw/zinc/71/26/89/1115712689.db2.gz HIQFULLPQBPYIL-UHFFFAOYSA-N 1 1 357.357 4.020 20 5 FIBDMO Cc1c(NC(=O)CC[NH2+][C@@H](C(F)F)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000598647460 1115742626 /nfs/dbraw/zinc/74/26/26/1115742626.db2.gz BAKGHJHTPQCCBG-QGZVFWFLSA-N 1 1 369.412 4.035 20 5 FIBDMO COc1ccc(C[NH2+][C@@H]2CC(C)(C)Oc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000593674416 1115787882 /nfs/dbraw/zinc/78/78/82/1115787882.db2.gz SJXJOHQIQKVKNW-OAHLLOKOSA-N 1 1 360.385 4.135 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@@]4(CC4(F)F)C3)o2)c([N+](=O)[O-])c1 ZINC000593696286 1115797903 /nfs/dbraw/zinc/79/79/03/1115797903.db2.gz ZTPGWFBUCDORPI-QGZVFWFLSA-N 1 1 364.348 4.095 20 5 FIBDMO CCc1ccc(C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C2CC2)cc1 ZINC000603629963 1115800476 /nfs/dbraw/zinc/80/04/76/1115800476.db2.gz LCUUPBOCKAAICX-UHFFFAOYSA-N 1 1 368.433 4.188 20 5 FIBDMO CCc1ccc(C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C2CC2)cc1 ZINC000603629963 1115800478 /nfs/dbraw/zinc/80/04/78/1115800478.db2.gz LCUUPBOCKAAICX-UHFFFAOYSA-N 1 1 368.433 4.188 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000603843213 1115820449 /nfs/dbraw/zinc/82/04/49/1115820449.db2.gz GFTGCUNRAUNKMX-GOSISDBHSA-N 1 1 354.406 4.012 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCCC[C@H]12 ZINC000603846946 1115821112 /nfs/dbraw/zinc/82/11/12/1115821112.db2.gz IEGGASJHZOSEGZ-KBRIMQKVSA-N 1 1 356.426 4.045 20 5 FIBDMO O=[N+]([O-])c1cc(CN2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)cs1 ZINC000603933589 1115830940 /nfs/dbraw/zinc/83/09/40/1115830940.db2.gz WQXJAAOGELLNED-UHFFFAOYSA-N 1 1 365.886 4.018 20 5 FIBDMO O=[N+]([O-])c1cc(CN2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)cs1 ZINC000603933589 1115830942 /nfs/dbraw/zinc/83/09/42/1115830942.db2.gz WQXJAAOGELLNED-UHFFFAOYSA-N 1 1 365.886 4.018 20 5 FIBDMO Cc1ccc([C@@H]2CCC[N@H+]2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000604435115 1115865234 /nfs/dbraw/zinc/86/52/34/1115865234.db2.gz XYFLPJHOLFICDB-FQEVSTJZSA-N 1 1 367.449 4.377 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000604434696 1115865432 /nfs/dbraw/zinc/86/54/32/1115865432.db2.gz NINQDXCUUOLXRG-HXUWFJFHSA-N 1 1 367.449 4.241 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCC[NH+]1Cc2ccccc2C1 ZINC000604482927 1115866409 /nfs/dbraw/zinc/86/64/09/1115866409.db2.gz QVAMREYASDDEOM-UHFFFAOYSA-N 1 1 351.328 4.041 20 5 FIBDMO CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccccc1F ZINC000604493305 1115867817 /nfs/dbraw/zinc/86/78/17/1115867817.db2.gz HQJRUYSXSYODRI-UHFFFAOYSA-N 1 1 373.428 4.283 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@@H+]4CCCC[C@H]34)s2)cc1 ZINC000608836011 1116131215 /nfs/dbraw/zinc/13/12/15/1116131215.db2.gz GSGRQPUHVODOTB-ZWKOTPCHSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@H+]4CCCC[C@H]34)s2)cc1 ZINC000608836011 1116131216 /nfs/dbraw/zinc/13/12/16/1116131216.db2.gz GSGRQPUHVODOTB-ZWKOTPCHSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)s1 ZINC000608836279 1116131264 /nfs/dbraw/zinc/13/12/64/1116131264.db2.gz ZIUNEYBSRQNFQZ-HUUCEWRRSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)s1 ZINC000608836279 1116131265 /nfs/dbraw/zinc/13/12/65/1116131265.db2.gz ZIUNEYBSRQNFQZ-HUUCEWRRSA-N 1 1 357.479 4.040 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)c2C1 ZINC000608949403 1116137779 /nfs/dbraw/zinc/13/77/79/1116137779.db2.gz DYFPDTKUCNACNU-UHFFFAOYSA-N 1 1 365.389 4.319 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)c2C1 ZINC000608949403 1116137781 /nfs/dbraw/zinc/13/77/81/1116137781.db2.gz DYFPDTKUCNACNU-UHFFFAOYSA-N 1 1 365.389 4.319 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cnn(Cc3ccccc3)c2)C2CC2)cc1 ZINC000534336872 1116188566 /nfs/dbraw/zinc/18/85/66/1116188566.db2.gz RIBYXCOGUQQVSI-UHFFFAOYSA-N 1 1 362.433 4.004 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cnn(Cc3ccccc3)c2)C2CC2)cc1 ZINC000534336872 1116188567 /nfs/dbraw/zinc/18/85/67/1116188567.db2.gz RIBYXCOGUQQVSI-UHFFFAOYSA-N 1 1 362.433 4.004 20 5 FIBDMO O=[N+]([O-])c1ccccc1CN1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000534964792 1116258371 /nfs/dbraw/zinc/25/83/71/1116258371.db2.gz CIAJAMCQFJTNPC-UHFFFAOYSA-N 1 1 365.477 4.083 20 5 FIBDMO O=[N+]([O-])c1ccccc1CN1CCC2(CC[N@@H+](Cc3ccccc3)C2)CC1 ZINC000534964792 1116258373 /nfs/dbraw/zinc/25/83/73/1116258373.db2.gz CIAJAMCQFJTNPC-UHFFFAOYSA-N 1 1 365.477 4.083 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000535376714 1116300865 /nfs/dbraw/zinc/30/08/65/1116300865.db2.gz ZQOFGCFWMCYXAS-ZDUSSCGKSA-N 1 1 356.426 4.384 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000535376714 1116300867 /nfs/dbraw/zinc/30/08/67/1116300867.db2.gz ZQOFGCFWMCYXAS-ZDUSSCGKSA-N 1 1 356.426 4.384 20 5 FIBDMO CC(C)c1ccc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000539899592 1117741004 /nfs/dbraw/zinc/74/10/04/1117741004.db2.gz GXFLGOZHHPMGPQ-FXAWDEMLSA-N 1 1 357.498 4.167 20 5 FIBDMO Cc1cnc(NCc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000463052438 1117941503 /nfs/dbraw/zinc/94/15/03/1117941503.db2.gz HPMPQXVNBISHEP-OAHLLOKOSA-N 1 1 354.454 4.142 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000463436121 1118155143 /nfs/dbraw/zinc/15/51/43/1118155143.db2.gz XDHYEFMACHNITN-FQEVSTJZSA-N 1 1 374.868 4.065 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000463436121 1118155149 /nfs/dbraw/zinc/15/51/49/1118155149.db2.gz XDHYEFMACHNITN-FQEVSTJZSA-N 1 1 374.868 4.065 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000541022122 1118351388 /nfs/dbraw/zinc/35/13/88/1118351388.db2.gz UGPWYZFAHLWOJV-SNUQEOBHSA-N 1 1 365.861 4.087 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@]2(CC[C@@H](C)C2)C1 ZINC000541022122 1118351393 /nfs/dbraw/zinc/35/13/93/1118351393.db2.gz UGPWYZFAHLWOJV-SNUQEOBHSA-N 1 1 365.861 4.087 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+](Cc1ccc2c(c1)OCO2)C1CCCC1 ZINC000609144006 1118736482 /nfs/dbraw/zinc/73/64/82/1118736482.db2.gz NNKVZBAOIVXMMA-UHFFFAOYSA-N 1 1 372.396 4.407 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](Cc1ccc2c(c1)OCO2)C1CCCC1 ZINC000609144006 1118736486 /nfs/dbraw/zinc/73/64/86/1118736486.db2.gz NNKVZBAOIVXMMA-UHFFFAOYSA-N 1 1 372.396 4.407 20 5 FIBDMO CCOc1cc(C[N@@H+](Cc2ccc(OC)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000492378260 1119079731 /nfs/dbraw/zinc/07/97/31/1119079731.db2.gz RWLUOAOEOYRWDQ-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CC(C)[N@@H+](C)Cc1cccc(CNCc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000152115154 1119099442 /nfs/dbraw/zinc/09/94/42/1119099442.db2.gz HGPCZIKDXLJIGU-UHFFFAOYSA-N 1 1 361.873 4.378 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC=C(c3c[nH]c4ncccc34)CC2)cc1Cl ZINC000761505055 1119406392 /nfs/dbraw/zinc/40/63/92/1119406392.db2.gz DIRJRONFWBWUMU-UHFFFAOYSA-N 1 1 368.824 4.414 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC=C(c3c[nH]c4ncccc34)CC2)cc1Cl ZINC000761505055 1119406395 /nfs/dbraw/zinc/40/63/95/1119406395.db2.gz DIRJRONFWBWUMU-UHFFFAOYSA-N 1 1 368.824 4.414 20 5 FIBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761513682 1119407345 /nfs/dbraw/zinc/40/73/45/1119407345.db2.gz CCBQUYZBIMHMJC-CYBMUJFWSA-N 1 1 368.861 4.192 20 5 FIBDMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761513682 1119407346 /nfs/dbraw/zinc/40/73/46/1119407346.db2.gz CCBQUYZBIMHMJC-CYBMUJFWSA-N 1 1 368.861 4.192 20 5 FIBDMO CCc1nc(C)c(C[NH2+]Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)o1 ZINC000494326904 1119833516 /nfs/dbraw/zinc/83/35/16/1119833516.db2.gz IPVDXTCTZMKJJZ-UHFFFAOYSA-N 1 1 371.393 4.012 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cccc(F)c1 ZINC000609193219 1119839983 /nfs/dbraw/zinc/83/99/83/1119839983.db2.gz CGCNRBJQIAFZIP-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO Cc1cc(C(=O)Nc2cccc3c2C[N@@H+](CC(C)C)C3)cc([N+](=O)[O-])c1 ZINC000494443515 1119863036 /nfs/dbraw/zinc/86/30/36/1119863036.db2.gz VBCWRQNNDBFJFK-UHFFFAOYSA-N 1 1 353.422 4.127 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC(CCCn2ccnc2)CC1 ZINC000494777155 1120195294 /nfs/dbraw/zinc/19/52/94/1120195294.db2.gz AMDJFCUTODFJHV-UHFFFAOYSA-N 1 1 362.861 4.137 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](Cc1ccccc1)CC1(O)CCCC1 ZINC000761968919 1120607971 /nfs/dbraw/zinc/60/79/71/1120607971.db2.gz CYAJJMUROFQCNW-UHFFFAOYSA-N 1 1 358.413 4.041 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000609233306 1121228293 /nfs/dbraw/zinc/22/82/93/1121228293.db2.gz CWZWZQFCCQABFT-NRFANRHFSA-N 1 1 370.449 4.346 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000609233306 1121228299 /nfs/dbraw/zinc/22/82/99/1121228299.db2.gz CWZWZQFCCQABFT-NRFANRHFSA-N 1 1 370.449 4.346 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2c3ccccc3ncc2[N+](=O)[O-])C1 ZINC000488076399 1121408883 /nfs/dbraw/zinc/40/88/83/1121408883.db2.gz MXWSYTOVEQVWRQ-SJORKVTESA-N 1 1 368.481 4.234 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)cc1[N+](=O)[O-] ZINC000765818939 1122148627 /nfs/dbraw/zinc/14/86/27/1122148627.db2.gz GVSPZXFJJQHWMZ-YOEHRIQHSA-N 1 1 372.469 4.499 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCCc3cn(C(C)C)nc32)cc1[N+](=O)[O-] ZINC000765818925 1122148839 /nfs/dbraw/zinc/14/88/39/1122148839.db2.gz GVSPZXFJJQHWMZ-PBHICJAKSA-N 1 1 372.469 4.499 20 5 FIBDMO C[C@@H](C1CC1)[N@H+](Cc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917437968 1122304437 /nfs/dbraw/zinc/30/44/37/1122304437.db2.gz QJKYQUMRZDTDIT-HNNXBMFYSA-N 1 1 350.422 4.203 20 5 FIBDMO C[N@H+](CCCc1ccccc1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000917454918 1122320818 /nfs/dbraw/zinc/32/08/18/1122320818.db2.gz MEGUMEIVRKVRKL-UHFFFAOYSA-N 1 1 357.435 4.394 20 5 FIBDMO C[N@@H+](CCCc1ccccc1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000917454918 1122320825 /nfs/dbraw/zinc/32/08/25/1122320825.db2.gz MEGUMEIVRKVRKL-UHFFFAOYSA-N 1 1 357.435 4.394 20 5 FIBDMO CO[C@@H]1CC[NH2+][C@H](c2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001212240821 1123006228 /nfs/dbraw/zinc/00/62/28/1123006228.db2.gz CRRUKGLOATWNSG-QRWLVFNGSA-N 1 1 359.429 4.483 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[NH2+][C@@H](c2nccs2)c2ccccc2)cc1 ZINC000195073922 1123123721 /nfs/dbraw/zinc/12/37/21/1123123721.db2.gz MMDSENMFMGTYTA-GOSISDBHSA-N 1 1 369.446 4.199 20 5 FIBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 ZINC000064349190 1123706173 /nfs/dbraw/zinc/70/61/73/1123706173.db2.gz OAXJLHYEFJPRIV-CQSZACIVSA-N 1 1 367.405 4.363 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 ZINC000064349190 1123706179 /nfs/dbraw/zinc/70/61/79/1123706179.db2.gz OAXJLHYEFJPRIV-CQSZACIVSA-N 1 1 367.405 4.363 20 5 FIBDMO CCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000610133380 1123949953 /nfs/dbraw/zinc/94/99/53/1123949953.db2.gz LSIDWHKNGZJGKI-OIISXLGYSA-N 1 1 352.862 4.274 20 5 FIBDMO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+](C)Cc1ccccc1 ZINC000301246341 1123961797 /nfs/dbraw/zinc/96/17/97/1123961797.db2.gz LFVYSDUIBJMTAW-HNNXBMFYSA-N 1 1 350.422 4.075 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3nccn3C(F)F)s2)cc1 ZINC000237681104 1124023016 /nfs/dbraw/zinc/02/30/16/1124023016.db2.gz WCCUSUMBYWEJQA-UHFFFAOYSA-N 1 1 364.377 4.205 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000615724019 1124108593 /nfs/dbraw/zinc/10/85/93/1124108593.db2.gz KPZAICIZNUKOBW-BJMVGYQFSA-N 1 1 354.303 4.344 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC(C)(C)[C@H]1c1cccs1 ZINC000554311442 1124326482 /nfs/dbraw/zinc/32/64/82/1124326482.db2.gz ZXRCIOUFDFNNGN-GOSISDBHSA-N 1 1 373.478 4.376 20 5 FIBDMO C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000542820451 1124390915 /nfs/dbraw/zinc/39/09/15/1124390915.db2.gz ZLENPFJIWVCIMF-GDBMZVCRSA-N 1 1 374.412 4.119 20 5 FIBDMO CC(C)([NH2+]Cc1sccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000181332129 1124857748 /nfs/dbraw/zinc/85/77/48/1124857748.db2.gz SWRIASZAAYESCB-UHFFFAOYSA-N 1 1 355.257 4.444 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1OCC ZINC000181387712 1124898410 /nfs/dbraw/zinc/89/84/10/1124898410.db2.gz DTHURVPVOACBEP-ZDUSSCGKSA-N 1 1 362.401 4.382 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](Oc2ncccc2F)C1 ZINC000489005477 1125056367 /nfs/dbraw/zinc/05/63/67/1125056367.db2.gz QEOZCDAWNYDGBM-GOEBONIOSA-N 1 1 359.401 4.042 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCCC[C@H]3c3ccco3)o2)cc1 ZINC000077177053 1125138974 /nfs/dbraw/zinc/13/89/74/1125138974.db2.gz NUJPHULFDAKWPS-INIZCTEOSA-N 1 1 368.393 4.355 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCCC[C@H]3c3ccco3)o2)cc1 ZINC000077177053 1125138979 /nfs/dbraw/zinc/13/89/79/1125138979.db2.gz NUJPHULFDAKWPS-INIZCTEOSA-N 1 1 368.393 4.355 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000301750335 1125207435 /nfs/dbraw/zinc/20/74/35/1125207435.db2.gz UJPFVKKKRCNMDE-GFCCVEGCSA-N 1 1 366.874 4.029 20 5 FIBDMO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC(=O)Nc1c(C)cccc1C ZINC000255415206 1125317024 /nfs/dbraw/zinc/31/70/24/1125317024.db2.gz URGBZISUXMLHCT-WQLSENKSSA-N 1 1 367.449 4.185 20 5 FIBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC(=O)Nc1c(C)cccc1C ZINC000255415206 1125317031 /nfs/dbraw/zinc/31/70/31/1125317031.db2.gz URGBZISUXMLHCT-WQLSENKSSA-N 1 1 367.449 4.185 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000063484731 212032173 /nfs/dbraw/zinc/03/21/73/212032173.db2.gz XTTAMLXZNGPOCJ-LJQANCHMSA-N 1 1 371.412 4.208 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000481687516 568089357 /nfs/dbraw/zinc/08/93/57/568089357.db2.gz AMKUDJPHFOFKBJ-IBGZPJMESA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000481687516 568089358 /nfs/dbraw/zinc/08/93/58/568089358.db2.gz AMKUDJPHFOFKBJ-IBGZPJMESA-N 1 1 358.825 4.270 20 5 FIBDMO CCc1nn(-c2ccccc2)c(CC)c1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000570034642 568442521 /nfs/dbraw/zinc/44/25/21/568442521.db2.gz BSZRMRDGZNAVQU-UHFFFAOYSA-N 1 1 364.449 4.195 20 5 FIBDMO O=[N+]([O-])c1ccc(CNC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)c(F)c1 ZINC000312778835 1125488237 /nfs/dbraw/zinc/48/82/37/1125488237.db2.gz YRDFBCCANIHKPO-GOSISDBHSA-N 1 1 371.456 4.126 20 5 FIBDMO C[N@@H+](CCc1cccs1)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093685319 1125491501 /nfs/dbraw/zinc/49/15/01/1125491501.db2.gz FXUAMKIVDUZPDO-UHFFFAOYSA-N 1 1 359.476 4.454 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000619531350 1125609308 /nfs/dbraw/zinc/60/93/08/1125609308.db2.gz QXDJHPDPOREKCC-WIYYLYMNSA-N 1 1 370.449 4.203 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000619722720 1125668497 /nfs/dbraw/zinc/66/84/97/1125668497.db2.gz VDNJIQDJAWWSSA-DLBZAZTESA-N 1 1 368.481 4.377 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)c(Cl)c1 ZINC000619722733 1125668599 /nfs/dbraw/zinc/66/85/99/1125668599.db2.gz XFYXHOMCMVMHOK-OAHLLOKOSA-N 1 1 374.872 4.161 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(c4ccsc4)CC3)n2)c1 ZINC000186954024 1079751623 /nfs/dbraw/zinc/75/16/23/1079751623.db2.gz LEFMBPAIDDQHLL-UHFFFAOYSA-N 1 1 370.434 4.086 20 5 FIBDMO O=C(CC[N@@H+](Cc1ccc(Cl)cc1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC001167064999 1079908056 /nfs/dbraw/zinc/90/80/56/1079908056.db2.gz ZYTGDUCHMFBJRA-UHFFFAOYSA-N 1 1 373.840 4.241 20 5 FIBDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154124229 1079995246 /nfs/dbraw/zinc/99/52/46/1079995246.db2.gz BUJZSVZIJZLXHD-MCFWBGNESA-N 1 1 366.870 4.179 20 5 FIBDMO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154124229 1079995248 /nfs/dbraw/zinc/99/52/48/1079995248.db2.gz BUJZSVZIJZLXHD-MCFWBGNESA-N 1 1 366.870 4.179 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccccc1OC(F)F ZINC000430230850 1080044180 /nfs/dbraw/zinc/04/41/80/1080044180.db2.gz ZPNWLBJPQHHMCF-NSHDSACASA-N 1 1 352.337 4.056 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3c3cccs3)o2)cc1 ZINC000032811680 1080861378 /nfs/dbraw/zinc/86/13/78/1080861378.db2.gz HVKJSYCFYNLMHM-CQSZACIVSA-N 1 1 356.407 4.043 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]3c3cccs3)o2)cc1 ZINC000032811680 1080861380 /nfs/dbraw/zinc/86/13/80/1080861380.db2.gz HVKJSYCFYNLMHM-CQSZACIVSA-N 1 1 356.407 4.043 20 5 FIBDMO CC[C@@H](C)[N@@H+](CCc1ccccc1F)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001167244067 1080901816 /nfs/dbraw/zinc/90/18/16/1080901816.db2.gz FJYIHZFTANGGGT-FOIQADDNSA-N 1 1 360.429 4.111 20 5 FIBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000177553576 1081225494 /nfs/dbraw/zinc/22/54/94/1081225494.db2.gz WEYBDJZPNIWVDQ-KDOFPFPSSA-N 1 1 364.405 4.023 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H]2C[C@H](O)c2cccs2)c1 ZINC000175847555 1081455406 /nfs/dbraw/zinc/45/54/06/1081455406.db2.gz LKWLIPZZDBMRQP-BBRMVZONSA-N 1 1 366.870 4.398 20 5 FIBDMO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083199349 1081547767 /nfs/dbraw/zinc/54/77/67/1081547767.db2.gz JVORSEZERNLEFY-GXTWGEPZSA-N 1 1 355.369 4.253 20 5 FIBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001167406750 1081963210 /nfs/dbraw/zinc/96/32/10/1081963210.db2.gz VLKYRXGSBGYNCV-AWEZNQCLSA-N 1 1 364.833 4.309 20 5 FIBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H]1C[C@@H](OCC)C1(C)C ZINC001167446674 1082319869 /nfs/dbraw/zinc/31/98/69/1082319869.db2.gz BZYNZUXGVNVJMS-ZWKOTPCHSA-N 1 1 350.459 4.019 20 5 FIBDMO Cc1[nH+]cn(-c2ccc(NC(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)cc2)c1C ZINC000581462584 1082591836 /nfs/dbraw/zinc/59/18/36/1082591836.db2.gz UZDNWPPJIROKHI-CYBMUJFWSA-N 1 1 364.405 4.140 20 5 FIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(C(F)(F)F)c1 ZINC000510580936 1083179540 /nfs/dbraw/zinc/17/95/40/1083179540.db2.gz VMVPZAGXHGRXMB-JTQLQIEISA-N 1 1 364.327 4.341 20 5 FIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582732 1083220294 /nfs/dbraw/zinc/22/02/94/1083220294.db2.gz SRQSQOBFBCATPL-SJKOYZFVSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582732 1083220296 /nfs/dbraw/zinc/22/02/96/1083220296.db2.gz SRQSQOBFBCATPL-SJKOYZFVSA-N 1 1 355.369 4.458 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[NH2+]Cc2ccc(F)cn2)cc1[N+](=O)[O-] ZINC000610787830 1083510264 /nfs/dbraw/zinc/51/02/64/1083510264.db2.gz XQNNTFJVGVFQEP-UHFFFAOYSA-N 1 1 366.396 4.187 20 5 FIBDMO CCCO[C@H]1CCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000364529492 1083664950 /nfs/dbraw/zinc/66/49/50/1083664950.db2.gz PKLPVYJSMZWINS-SFHVURJKSA-N 1 1 373.453 4.073 20 5 FIBDMO C[C@@H]([NH2+][C@@H](CN1CCCCC1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610809708 1083718989 /nfs/dbraw/zinc/71/89/89/1083718989.db2.gz PVVYUSJOUKHGOU-UTKZUKDTSA-N 1 1 353.466 4.473 20 5 FIBDMO Cc1ccc(-c2cc(C[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)on2)cc1 ZINC000548934617 1083848229 /nfs/dbraw/zinc/84/82/29/1083848229.db2.gz MFLDBKVLCGCNHM-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO Cn1cc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179905906 1083869570 /nfs/dbraw/zinc/86/95/70/1083869570.db2.gz FRDDNKKHNMYOGK-HXUWFJFHSA-N 1 1 362.433 4.115 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCCC[C@H]1C[C@H](O)c1ccco1 ZINC000177451350 1083970672 /nfs/dbraw/zinc/97/06/72/1083970672.db2.gz PDBHFLMGZDKSQM-WMZOPIPTSA-N 1 1 362.401 4.195 20 5 FIBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+]1CCCC2(CCCC2)C1 ZINC000782636209 1084013499 /nfs/dbraw/zinc/01/34/99/1084013499.db2.gz FNMGYOLWQAVSKM-ZDUSSCGKSA-N 1 1 365.861 4.231 20 5 FIBDMO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1CCCC2(CCCC2)C1 ZINC000782636209 1084013515 /nfs/dbraw/zinc/01/35/15/1084013515.db2.gz FNMGYOLWQAVSKM-ZDUSSCGKSA-N 1 1 365.861 4.231 20 5 FIBDMO COC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000580910888 1084484279 /nfs/dbraw/zinc/48/42/79/1084484279.db2.gz LFYDJGIOMUWMNN-INIZCTEOSA-N 1 1 354.328 4.091 20 5 FIBDMO CCc1ccc([C@H](NCC[C@H]2CCC[N@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000414178951 1084744755 /nfs/dbraw/zinc/74/47/55/1084744755.db2.gz KNJKWGUZCHQFIS-IIBYNOLFSA-N 1 1 371.481 4.161 20 5 FIBDMO CCc1ccc([C@H](NCC[C@H]2CCC[N@@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000414178951 1084744760 /nfs/dbraw/zinc/74/47/60/1084744760.db2.gz KNJKWGUZCHQFIS-IIBYNOLFSA-N 1 1 371.481 4.161 20 5 FIBDMO COc1cc(C[N@@H+](C(C)C)C2CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000180190782 1084847327 /nfs/dbraw/zinc/84/73/27/1084847327.db2.gz KMTFNQSLJKXKTN-UHFFFAOYSA-N 1 1 358.385 4.010 20 5 FIBDMO Cc1ccc(C[N@@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1C ZINC000452047697 1085030391 /nfs/dbraw/zinc/03/03/91/1085030391.db2.gz ZJAZHVXZVJGCFA-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1C ZINC000452047697 1085030397 /nfs/dbraw/zinc/03/03/97/1085030397.db2.gz ZJAZHVXZVJGCFA-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1cc(F)ccc1F)C(C)C ZINC000479075695 1085080053 /nfs/dbraw/zinc/08/00/53/1085080053.db2.gz YAEJTDNUPVHDSW-GOSISDBHSA-N 1 1 350.365 4.369 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(OCC2CCCC2)CC1 ZINC001167598533 1085380291 /nfs/dbraw/zinc/38/02/91/1085380291.db2.gz IDAWPOWLEBKORM-UHFFFAOYSA-N 1 1 352.862 4.419 20 5 FIBDMO CC(C)[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cccnc1 ZINC000093223765 1085448083 /nfs/dbraw/zinc/44/80/83/1085448083.db2.gz GLWAGQGUXZGLHL-UHFFFAOYSA-N 1 1 366.421 4.098 20 5 FIBDMO CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H](C)Cc1ccsc1 ZINC000187796311 1085538014 /nfs/dbraw/zinc/53/80/14/1085538014.db2.gz FNLPERGPXVCHFV-CYBMUJFWSA-N 1 1 372.450 4.159 20 5 FIBDMO CC[C@H]([NH2+]Cc1ccn(-c2c(F)cccc2F)n1)c1cccc([N+](=O)[O-])c1 ZINC000181765587 1085541608 /nfs/dbraw/zinc/54/16/08/1085541608.db2.gz JHQZUOAWXCKQQV-SFHVURJKSA-N 1 1 372.375 4.300 20 5 FIBDMO C[C@@H](NC[C@H]1CCC[N@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178651806 1085584968 /nfs/dbraw/zinc/58/49/68/1085584968.db2.gz FWVYRNZLRBPSEC-HZPDHXFCSA-N 1 1 359.495 4.219 20 5 FIBDMO C[C@@H](NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178651806 1085584976 /nfs/dbraw/zinc/58/49/76/1085584976.db2.gz FWVYRNZLRBPSEC-HZPDHXFCSA-N 1 1 359.495 4.219 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@@H]2C[C@@H](O)c2ccco2)c(F)c1 ZINC000121874200 1085586719 /nfs/dbraw/zinc/58/67/19/1085586719.db2.gz BWNKJSPLXOHZJM-CRAIPNDOSA-N 1 1 362.401 4.195 20 5 FIBDMO CC[C@@H]([NH2+][C@@H](C(=O)N(CC)CC)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000178676078 1085785235 /nfs/dbraw/zinc/78/52/35/1085785235.db2.gz RCHDVLAWAFCTCW-WOJBJXKFSA-N 1 1 369.465 4.245 20 5 FIBDMO CCn1nc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c2ccccc21 ZINC000473150430 1085844772 /nfs/dbraw/zinc/84/47/72/1085844772.db2.gz XVCKUMXRWMTFDV-UHFFFAOYSA-N 1 1 352.438 4.375 20 5 FIBDMO CCn1nc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c2ccccc21 ZINC000473150430 1085844780 /nfs/dbraw/zinc/84/47/80/1085844780.db2.gz XVCKUMXRWMTFDV-UHFFFAOYSA-N 1 1 352.438 4.375 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC2(CCC2)Oc2ccccc21 ZINC000178729874 1085967723 /nfs/dbraw/zinc/96/77/23/1085967723.db2.gz KIHGGWNYFGJAIF-KRWDZBQOSA-N 1 1 354.406 4.140 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@@H](O)c3ccccc3)CC2)ccc1Cl ZINC000122067087 1086225886 /nfs/dbraw/zinc/22/58/86/1086225886.db2.gz UOJGIYJKJLUGGD-IBGZPJMESA-N 1 1 360.841 4.194 20 5 FIBDMO O=C(C[N@@H+]1CCC[C@@H]1c1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000105489945 1086559573 /nfs/dbraw/zinc/55/95/73/1086559573.db2.gz USEHVAPPNKOJLD-MRXNPFEDSA-N 1 1 359.813 4.024 20 5 FIBDMO O=C(C[N@H+]1CCC[C@@H]1c1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000105489945 1086559579 /nfs/dbraw/zinc/55/95/79/1086559579.db2.gz USEHVAPPNKOJLD-MRXNPFEDSA-N 1 1 359.813 4.024 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@H](CC(F)(F)F)C3)o2)c1 ZINC000278564206 1087097972 /nfs/dbraw/zinc/09/79/72/1087097972.db2.gz BQGIICUCDMDCCN-LBPRGKRZSA-N 1 1 369.343 4.067 20 5 FIBDMO COc1cc(C[NH2+][C@@H]2CCc3sc(Cl)cc32)c([N+](=O)[O-])cc1OC ZINC000584022809 1087115124 /nfs/dbraw/zinc/11/51/24/1087115124.db2.gz JJOAABPSUQWPAH-LLVKDONJSA-N 1 1 368.842 4.104 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1n1ccnc1 ZINC000180611044 1087980544 /nfs/dbraw/zinc/98/05/44/1087980544.db2.gz JBWQQRWQPNIUJO-KXBFYZLASA-N 1 1 366.421 4.134 20 5 FIBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000177553547 1088361242 /nfs/dbraw/zinc/36/12/42/1088361242.db2.gz WEYBDJZPNIWVDQ-RDTXWAMCSA-N 1 1 364.405 4.023 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1 ZINC000414550356 1088823502 /nfs/dbraw/zinc/82/35/02/1088823502.db2.gz IUDPPKPYWQUGPR-FQEVSTJZSA-N 1 1 352.434 4.257 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000549169448 1089105182 /nfs/dbraw/zinc/10/51/82/1089105182.db2.gz UZXLGYPVRXUEGO-HNNXBMFYSA-N 1 1 358.360 4.028 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(-c2cccs2)n1 ZINC000549172084 1089110575 /nfs/dbraw/zinc/11/05/75/1089110575.db2.gz QHYMXKFWMLJGRY-UHFFFAOYSA-N 1 1 359.476 4.454 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1csc(-c2cccs2)n1 ZINC000549172084 1089110579 /nfs/dbraw/zinc/11/05/79/1089110579.db2.gz QHYMXKFWMLJGRY-UHFFFAOYSA-N 1 1 359.476 4.454 20 5 FIBDMO CCC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000505605091 1089295717 /nfs/dbraw/zinc/29/57/17/1089295717.db2.gz GBEPJABVBGSAMB-UHFFFAOYSA-N 1 1 364.449 4.408 20 5 FIBDMO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000435373845 1089569810 /nfs/dbraw/zinc/56/98/10/1089569810.db2.gz GEESQKKHUMKNJX-FKEKPDDDSA-N 1 1 357.479 4.038 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000105503197 1091032115 /nfs/dbraw/zinc/03/21/15/1091032115.db2.gz WWPRGCCTRABJDG-MRXNPFEDSA-N 1 1 371.466 4.001 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000107657816 1091786270 /nfs/dbraw/zinc/78/62/70/1091786270.db2.gz URCZDPZBQYBLHH-DGCLKSJQSA-N 1 1 363.767 4.306 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2CC(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000500454803 1092089385 /nfs/dbraw/zinc/08/93/85/1092089385.db2.gz FDNVORMZWVNPIP-CYBMUJFWSA-N 1 1 358.385 4.215 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[NH+]1CCCC1 ZINC000520955673 1092381129 /nfs/dbraw/zinc/38/11/29/1092381129.db2.gz FUSNVQLMKJIKCL-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO C[NH+](C)Cc1cc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc32)ccc1Cl ZINC000500747705 1092480859 /nfs/dbraw/zinc/48/08/59/1092480859.db2.gz NFLDKQUXJJJSRW-UHFFFAOYSA-N 1 1 372.812 4.043 20 5 FIBDMO Cc1ccc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)cc1[N+](=O)[O-] ZINC000500758681 1092518948 /nfs/dbraw/zinc/51/89/48/1092518948.db2.gz MJTKNKRTPUJQOG-HNNXBMFYSA-N 1 1 367.449 4.387 20 5 FIBDMO COCC[N@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549750477 1092746422 /nfs/dbraw/zinc/74/64/22/1092746422.db2.gz ITATWQSDPJSVGQ-UHFFFAOYSA-N 1 1 374.384 4.324 20 5 FIBDMO COCC[N@@H+](Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549750477 1092746430 /nfs/dbraw/zinc/74/64/30/1092746430.db2.gz ITATWQSDPJSVGQ-UHFFFAOYSA-N 1 1 374.384 4.324 20 5 FIBDMO COc1ccc(F)c(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000549817397 1092819302 /nfs/dbraw/zinc/81/93/02/1092819302.db2.gz AMPUMOHKDPYSIH-UHFFFAOYSA-N 1 1 358.291 4.051 20 5 FIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000443075200 1092934988 /nfs/dbraw/zinc/93/49/88/1092934988.db2.gz ZEEULPWEPKMUPR-APWZRJJASA-N 1 1 369.465 4.362 20 5 FIBDMO Cc1ccnc(NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000522417561 1093548962 /nfs/dbraw/zinc/54/89/62/1093548962.db2.gz BFPZGCLRZPOPKH-OAHLLOKOSA-N 1 1 354.454 4.142 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1ccc(F)cc1)C(C)(C)C ZINC000474186504 1093561799 /nfs/dbraw/zinc/56/17/99/1093561799.db2.gz XRTWLQFKEBWAAE-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO Cc1ccc(C)c([C@H]2CCC[N@@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000474237197 1093605296 /nfs/dbraw/zinc/60/52/96/1093605296.db2.gz VBLRZIQSLYZQSV-GOSISDBHSA-N 1 1 367.449 4.296 20 5 FIBDMO Cc1ccc(C)c([C@H]2CCC[N@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000474237197 1093605307 /nfs/dbraw/zinc/60/53/07/1093605307.db2.gz VBLRZIQSLYZQSV-GOSISDBHSA-N 1 1 367.449 4.296 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]Cc2ccc(C(F)F)cc2)c1 ZINC000185186606 1093609881 /nfs/dbraw/zinc/60/98/81/1093609881.db2.gz NJELYJLZAKFIQB-UHFFFAOYSA-N 1 1 358.291 4.424 20 5 FIBDMO Cc1ccc(C[NH2+]Cc2cc(F)c(F)cc2Br)cc1[N+](=O)[O-] ZINC000513001573 1093662949 /nfs/dbraw/zinc/66/29/49/1093662949.db2.gz JXMPXNGIRBSPPG-UHFFFAOYSA-N 1 1 371.181 4.234 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000398169279 1093820118 /nfs/dbraw/zinc/82/01/18/1093820118.db2.gz HPQKOLVFWMPELM-ABSDTBQOSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)C[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000398169279 1093820127 /nfs/dbraw/zinc/82/01/27/1093820127.db2.gz HPQKOLVFWMPELM-ABSDTBQOSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000398194583 1093824350 /nfs/dbraw/zinc/82/43/50/1093824350.db2.gz NMPZRXNXJTUUJK-LLGFUMIMSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000398194583 1093824356 /nfs/dbraw/zinc/82/43/56/1093824356.db2.gz NMPZRXNXJTUUJK-LLGFUMIMSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000398194583 1093824362 /nfs/dbraw/zinc/82/43/62/1093824362.db2.gz NMPZRXNXJTUUJK-LLGFUMIMSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000398194583 1093824369 /nfs/dbraw/zinc/82/43/69/1093824369.db2.gz NMPZRXNXJTUUJK-LLGFUMIMSA-N 1 1 353.466 4.156 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)C[C@@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000513472417 1094151784 /nfs/dbraw/zinc/15/17/84/1094151784.db2.gz DYFUIJPSZKYNIN-SFHVURJKSA-N 1 1 369.465 4.221 20 5 FIBDMO C[C@@H]1C[C@H](CC[NH2+]Cc2csc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000513545576 1094205937 /nfs/dbraw/zinc/20/59/37/1094205937.db2.gz RIIGZUUCJZLXTO-WBVHZDCISA-N 1 1 359.495 4.047 20 5 FIBDMO C[N@H+](CCOc1ccc(C(F)(F)F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000501302409 1094611247 /nfs/dbraw/zinc/61/12/47/1094611247.db2.gz QYNCTMMWULDIDT-UHFFFAOYSA-N 1 1 354.328 4.124 20 5 FIBDMO C[N@@H+](CCOc1ccc(C(F)(F)F)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000501302409 1094611252 /nfs/dbraw/zinc/61/12/52/1094611252.db2.gz QYNCTMMWULDIDT-UHFFFAOYSA-N 1 1 354.328 4.124 20 5 FIBDMO Cc1ccc([C@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)c(C)c1 ZINC000501844207 1094958912 /nfs/dbraw/zinc/95/89/12/1094958912.db2.gz RWVULVBHQUSCSP-KRWDZBQOSA-N 1 1 367.449 4.030 20 5 FIBDMO COc1ncccc1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000237123887 1095059086 /nfs/dbraw/zinc/05/90/86/1095059086.db2.gz HWPZADMDPHDEKQ-UHFFFAOYSA-N 1 1 373.796 4.202 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1ccc(Br)cn1 ZINC000281318336 1095525291 /nfs/dbraw/zinc/52/52/91/1095525291.db2.gz ZQKMRTDGSMXQHW-NWDGAFQWSA-N 1 1 364.243 4.473 20 5 FIBDMO CC[C@H]1C[C@@]1([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1cccc(C)c1 ZINC000502555374 1095586705 /nfs/dbraw/zinc/58/67/05/1095586705.db2.gz YGMHYQFQCIPBPT-YWZLYKJASA-N 1 1 358.413 4.466 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ccc3c(n2)CCCC3)o1 ZINC000444011522 1095612207 /nfs/dbraw/zinc/61/22/07/1095612207.db2.gz QFDAGQQPSYEQRA-UHFFFAOYSA-N 1 1 363.417 4.418 20 5 FIBDMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(CC[N@H+](C)C2CC2)c1 ZINC000421506325 1095670033 /nfs/dbraw/zinc/67/00/33/1095670033.db2.gz JRGNXVDQAQPKJE-UHFFFAOYSA-N 1 1 367.449 4.101 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCCC[C@H]3c3ccco3)n2)c1 ZINC000121231857 1095713250 /nfs/dbraw/zinc/71/32/50/1095713250.db2.gz KPBCBCWCUSRLAT-INIZCTEOSA-N 1 1 368.393 4.355 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCCC[C@H]3c3ccco3)n2)c1 ZINC000121231857 1095713257 /nfs/dbraw/zinc/71/32/57/1095713257.db2.gz KPBCBCWCUSRLAT-INIZCTEOSA-N 1 1 368.393 4.355 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000444166753 1095805112 /nfs/dbraw/zinc/80/51/12/1095805112.db2.gz JYXQUSAGMATTDE-DJJJIMSYSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000444166753 1095805126 /nfs/dbraw/zinc/80/51/26/1095805126.db2.gz JYXQUSAGMATTDE-DJJJIMSYSA-N 1 1 371.412 4.064 20 5 FIBDMO COCC[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccco1 ZINC000503921134 1096588111 /nfs/dbraw/zinc/58/81/11/1096588111.db2.gz PIYVPRNILSAKLB-QGZVFWFLSA-N 1 1 356.378 4.315 20 5 FIBDMO CC[C@@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000504230909 1096714165 /nfs/dbraw/zinc/71/41/65/1096714165.db2.gz WQVGQMKAYIUTHO-MRXNPFEDSA-N 1 1 355.438 4.224 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1cccs1)C(C)C ZINC000532926733 1098596141 /nfs/dbraw/zinc/59/61/41/1098596141.db2.gz SCVCSGWECVYVSG-UHFFFAOYSA-N 1 1 361.467 4.204 20 5 FIBDMO Cc1cccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000532920530 1098610685 /nfs/dbraw/zinc/61/06/85/1098610685.db2.gz DAQCPWVXTKXFRQ-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1cccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000532920530 1098610691 /nfs/dbraw/zinc/61/06/91/1098610691.db2.gz DAQCPWVXTKXFRQ-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000532935218 1098628394 /nfs/dbraw/zinc/62/83/94/1098628394.db2.gz WEGKADBUJAAQRM-IBGZPJMESA-N 1 1 355.438 4.031 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](Cc1ccoc1)C1CCCCC1 ZINC000532970300 1098638249 /nfs/dbraw/zinc/63/82/49/1098638249.db2.gz GMBLWANJIMEWGH-UHFFFAOYSA-N 1 1 371.437 4.270 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](Cc1ccoc1)C1CCCCC1 ZINC000532970300 1098638259 /nfs/dbraw/zinc/63/82/59/1098638259.db2.gz GMBLWANJIMEWGH-UHFFFAOYSA-N 1 1 371.437 4.270 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]2CCCC[C@H]12 ZINC000079866250 1098731846 /nfs/dbraw/zinc/73/18/46/1098731846.db2.gz CXDPQLUKNNYLJA-XYPHTWIQSA-N 1 1 356.426 4.045 20 5 FIBDMO CCn1c(C)nc([N+](=O)[O-])c1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000515698615 1098859275 /nfs/dbraw/zinc/85/92/75/1098859275.db2.gz MZHXPFQMZRUEEJ-UHFFFAOYSA-N 1 1 356.430 4.047 20 5 FIBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C)c1 ZINC000533252075 1098912138 /nfs/dbraw/zinc/91/21/38/1098912138.db2.gz DMWFIPHCYABJMK-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C)c1 ZINC000533252075 1098912142 /nfs/dbraw/zinc/91/21/42/1098912142.db2.gz DMWFIPHCYABJMK-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436313823 1098922702 /nfs/dbraw/zinc/92/27/02/1098922702.db2.gz CLQZZNIFMWBFKK-GFCCVEGCSA-N 1 1 360.380 4.075 20 5 FIBDMO C[C@H](Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000436330640 1098934631 /nfs/dbraw/zinc/93/46/31/1098934631.db2.gz MCIAMLOULOHRGQ-NWDGAFQWSA-N 1 1 372.391 4.074 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCC2(C1)CCCCC2 ZINC000533427392 1099047157 /nfs/dbraw/zinc/04/71/57/1099047157.db2.gz MYMZIQSEDJQIHQ-ZDUSSCGKSA-N 1 1 365.861 4.231 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCC2(C1)CCCCC2 ZINC000533427392 1099047171 /nfs/dbraw/zinc/04/71/71/1099047171.db2.gz MYMZIQSEDJQIHQ-ZDUSSCGKSA-N 1 1 365.861 4.231 20 5 FIBDMO CC[N@H+]1CC[C@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000536658449 1100112658 /nfs/dbraw/zinc/11/26/58/1100112658.db2.gz AFJUUUKJYSLQQI-KXBFYZLASA-N 1 1 357.454 4.017 20 5 FIBDMO CCN1CC[C@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000536658449 1100112696 /nfs/dbraw/zinc/11/26/96/1100112696.db2.gz AFJUUUKJYSLQQI-KXBFYZLASA-N 1 1 357.454 4.017 20 5 FIBDMO CCN1CC[C@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000536658449 1100112703 /nfs/dbraw/zinc/11/27/03/1100112703.db2.gz AFJUUUKJYSLQQI-KXBFYZLASA-N 1 1 357.454 4.017 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC4(C3)CCOCC4)s2)cc1 ZINC000536663224 1100136829 /nfs/dbraw/zinc/13/68/29/1100136829.db2.gz DEXBKSZDUDODAN-UHFFFAOYSA-N 1 1 358.463 4.326 20 5 FIBDMO CC(C)[C@H]1C[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000536670264 1100152201 /nfs/dbraw/zinc/15/22/01/1100152201.db2.gz OQSULDXYZHFRDK-MRXNPFEDSA-N 1 1 363.508 4.292 20 5 FIBDMO CC(C)[C@H]1C[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000536670264 1100152206 /nfs/dbraw/zinc/15/22/06/1100152206.db2.gz OQSULDXYZHFRDK-MRXNPFEDSA-N 1 1 363.508 4.292 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c1 ZINC000536695333 1100196998 /nfs/dbraw/zinc/19/69/98/1100196998.db2.gz AQKPVKTUSOLARW-HIFRSBDPSA-N 1 1 358.410 4.056 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CCS[C@H]3CCCC[C@H]32)c1 ZINC000536695333 1100197002 /nfs/dbraw/zinc/19/70/02/1100197002.db2.gz AQKPVKTUSOLARW-HIFRSBDPSA-N 1 1 358.410 4.056 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC=C(c2ccc3c(c2)OCCO3)CC1 ZINC000536713465 1100214819 /nfs/dbraw/zinc/21/48/19/1100214819.db2.gz OETGDKXESNAHLI-OAHLLOKOSA-N 1 1 366.417 4.216 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H](c1ccccc1)C1(CO)CCCC1 ZINC000459529611 1100278096 /nfs/dbraw/zinc/27/80/96/1100278096.db2.gz MHXMCESCLSMTCG-LJQANCHMSA-N 1 1 358.413 4.118 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000536848562 1100361105 /nfs/dbraw/zinc/36/11/05/1100361105.db2.gz YOOSFXWGMHWYRL-NHYWBVRUSA-N 1 1 362.813 4.431 20 5 FIBDMO Cn1cc(C[N@H+]2CCC[C@@H]2c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000506294145 1100797961 /nfs/dbraw/zinc/79/79/61/1100797961.db2.gz IPSHMIJXQACRSF-HXUWFJFHSA-N 1 1 362.433 4.332 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@@H+](C3CCCC3)C2)s1 ZINC000518284640 1101068098 /nfs/dbraw/zinc/06/80/98/1101068098.db2.gz WAUZZICQWHYWTL-OAHLLOKOSA-N 1 1 371.506 4.430 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@H+](C3CCCC3)C2)s1 ZINC000518284640 1101068106 /nfs/dbraw/zinc/06/81/06/1101068106.db2.gz WAUZZICQWHYWTL-OAHLLOKOSA-N 1 1 371.506 4.430 20 5 FIBDMO CCOC[C@@H]1CCCC[N@@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000459667904 1101305577 /nfs/dbraw/zinc/30/55/77/1101305577.db2.gz AUBWENFJKSOSHY-KRWDZBQOSA-N 1 1 361.467 4.109 20 5 FIBDMO CCOC[C@@H]1CCCC[N@H+]1Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000459667904 1101305590 /nfs/dbraw/zinc/30/55/90/1101305590.db2.gz AUBWENFJKSOSHY-KRWDZBQOSA-N 1 1 361.467 4.109 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000537078614 1101443972 /nfs/dbraw/zinc/44/39/72/1101443972.db2.gz MFDAECNINURFKC-OAHLLOKOSA-N 1 1 354.328 4.387 20 5 FIBDMO COCCOc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000507168503 1101706089 /nfs/dbraw/zinc/70/60/89/1101706089.db2.gz DGNVJGDPYZKREA-UHFFFAOYSA-N 1 1 358.438 4.031 20 5 FIBDMO C[C@@H]1Cc2ccccc2C[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000532585292 1102506180 /nfs/dbraw/zinc/50/61/80/1102506180.db2.gz WXCHKKIOBNMBIV-OAHLLOKOSA-N 1 1 363.417 4.239 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1)C1CC1 ZINC000508787156 1102588764 /nfs/dbraw/zinc/58/87/64/1102588764.db2.gz ZPWBOQPNHVGZPS-UHFFFAOYSA-N 1 1 353.422 4.140 20 5 FIBDMO CCOc1ccc(C2=CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC001168243907 1102600671 /nfs/dbraw/zinc/60/06/71/1102600671.db2.gz HUZOCWXCAJKRDH-UHFFFAOYSA-N 1 1 356.397 4.422 20 5 FIBDMO CCOc1ccc(C2=CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 ZINC001168243907 1102600674 /nfs/dbraw/zinc/60/06/74/1102600674.db2.gz HUZOCWXCAJKRDH-UHFFFAOYSA-N 1 1 356.397 4.422 20 5 FIBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@@H](c3noc(C4CC4)n3)C2)cc1[N+](=O)[O-] ZINC000537656668 1102769439 /nfs/dbraw/zinc/76/94/39/1102769439.db2.gz JSZJTKOCSJKGRV-MRXNPFEDSA-N 1 1 370.453 4.358 20 5 FIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](c3noc(C4CC4)n3)C2)cc1[N+](=O)[O-] ZINC000537656668 1102769450 /nfs/dbraw/zinc/76/94/50/1102769450.db2.gz JSZJTKOCSJKGRV-MRXNPFEDSA-N 1 1 370.453 4.358 20 5 FIBDMO C[C@H](c1nc2ccccc2s1)[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000532662608 1102783113 /nfs/dbraw/zinc/78/31/13/1102783113.db2.gz XCBHRMXDBKQWLT-CYBMUJFWSA-N 1 1 357.435 4.276 20 5 FIBDMO C[C@H](c1nc2ccccc2s1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000532662608 1102783126 /nfs/dbraw/zinc/78/31/26/1102783126.db2.gz XCBHRMXDBKQWLT-CYBMUJFWSA-N 1 1 357.435 4.276 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000507165383 1103165248 /nfs/dbraw/zinc/16/52/48/1103165248.db2.gz POQZWEVEVKJOKK-QGZVFWFLSA-N 1 1 367.449 4.030 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(-n2cccn2)c1 ZINC000507151249 1103168922 /nfs/dbraw/zinc/16/89/22/1103168922.db2.gz CEDLIXOGKKXBEY-UHFFFAOYSA-N 1 1 350.422 4.191 20 5 FIBDMO CC(C)[N@H+](Cc1cccc(F)c1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507168917 1103187137 /nfs/dbraw/zinc/18/71/37/1103187137.db2.gz SOUJYSPVCNUUQH-UHFFFAOYSA-N 1 1 360.385 4.011 20 5 FIBDMO CC(C)[N@@H+](Cc1cccc(F)c1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507168917 1103187141 /nfs/dbraw/zinc/18/71/41/1103187141.db2.gz SOUJYSPVCNUUQH-UHFFFAOYSA-N 1 1 360.385 4.011 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cnc(-c3ccncc3)s2)C2CC2)cc1 ZINC000507170850 1103189911 /nfs/dbraw/zinc/18/99/11/1103189911.db2.gz QVRAYSNRKWGRNF-UHFFFAOYSA-N 1 1 366.446 4.278 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cnc(-c3ccncc3)s2)C2CC2)cc1 ZINC000507170850 1103189921 /nfs/dbraw/zinc/18/99/21/1103189921.db2.gz QVRAYSNRKWGRNF-UHFFFAOYSA-N 1 1 366.446 4.278 20 5 FIBDMO Cc1ccccc1[C@H](C)[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC(C)C ZINC000551423825 1103207409 /nfs/dbraw/zinc/20/74/09/1103207409.db2.gz OZWJHMSLNMJUMX-INIZCTEOSA-N 1 1 369.465 4.221 20 5 FIBDMO Cn1nccc1-c1ccccc1C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000507245009 1103247260 /nfs/dbraw/zinc/24/72/60/1103247260.db2.gz VQISXDGXCQSYGW-UHFFFAOYSA-N 1 1 362.433 4.160 20 5 FIBDMO C[N@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000507618709 1103556177 /nfs/dbraw/zinc/55/61/77/1103556177.db2.gz SYHXYZUIWXRVEF-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000507618709 1103556188 /nfs/dbraw/zinc/55/61/88/1103556188.db2.gz SYHXYZUIWXRVEF-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO CC(C)c1ccc(C[NH+]2CCC(Oc3ccccn3)CC2)cc1[N+](=O)[O-] ZINC000507673629 1103593925 /nfs/dbraw/zinc/59/39/25/1103593925.db2.gz PCGCOHKWZXZGSE-UHFFFAOYSA-N 1 1 355.438 4.157 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@@H]([C@H](C)O)C3)cc2[N+](=O)[O-])cc1 ZINC000507700951 1103630167 /nfs/dbraw/zinc/63/01/67/1103630167.db2.gz YBUKAKODIWJIAK-DOTOQJQBSA-N 1 1 372.490 4.257 20 5 FIBDMO Cc1c([C@@H](C)[NH2+][C@@H](CO)c2cccc(Cl)c2F)cccc1[N+](=O)[O-] ZINC000467414313 1104061827 /nfs/dbraw/zinc/06/18/27/1104061827.db2.gz SRJCMWZUYXBCPA-ABAIWWIYSA-N 1 1 352.793 4.080 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000441380545 1104321005 /nfs/dbraw/zinc/32/10/05/1104321005.db2.gz HKEAEDUXCQUQDP-VIFPVBQESA-N 1 1 356.266 4.473 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000441380545 1104321014 /nfs/dbraw/zinc/32/10/14/1104321014.db2.gz HKEAEDUXCQUQDP-VIFPVBQESA-N 1 1 356.266 4.473 20 5 FIBDMO CCC(C)(C)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441629329 1105051023 /nfs/dbraw/zinc/05/10/23/1105051023.db2.gz BEMYDUXLLIZYRD-OAHLLOKOSA-N 1 1 353.850 4.087 20 5 FIBDMO CCC(C)(C)[C@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000441629329 1105051030 /nfs/dbraw/zinc/05/10/30/1105051030.db2.gz BEMYDUXLLIZYRD-OAHLLOKOSA-N 1 1 353.850 4.087 20 5 FIBDMO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000025947357 1106747769 /nfs/dbraw/zinc/74/77/69/1106747769.db2.gz XUBKIVVLUUTWIH-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000025947357 1106747779 /nfs/dbraw/zinc/74/77/79/1106747779.db2.gz XUBKIVVLUUTWIH-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO C[C@@H](c1nc(C(C)(C)C)no1)[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544768 1107163530 /nfs/dbraw/zinc/16/35/30/1107163530.db2.gz FSUFXUXHDXSAMQ-DZGCQCFKSA-N 1 1 358.442 4.216 20 5 FIBDMO C[C@@H](c1nc(C(C)(C)C)no1)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544768 1107163541 /nfs/dbraw/zinc/16/35/41/1107163541.db2.gz FSUFXUXHDXSAMQ-DZGCQCFKSA-N 1 1 358.442 4.216 20 5 FIBDMO CO[C@H](C)c1nc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451543130 1107164219 /nfs/dbraw/zinc/16/42/19/1107164219.db2.gz AYLZMBYVRDHILB-HIFRSBDPSA-N 1 1 361.467 4.138 20 5 FIBDMO CO[C@H](C)c1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451543130 1107164228 /nfs/dbraw/zinc/16/42/28/1107164228.db2.gz AYLZMBYVRDHILB-HIFRSBDPSA-N 1 1 361.467 4.138 20 5 FIBDMO CCCCc1noc([C@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548488 1107168554 /nfs/dbraw/zinc/16/85/54/1107168554.db2.gz NSMFHUQYSMTGOB-HOCLYGCPSA-N 1 1 358.442 4.261 20 5 FIBDMO CCCCc1noc([C@H](C)[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548488 1107168561 /nfs/dbraw/zinc/16/85/61/1107168561.db2.gz NSMFHUQYSMTGOB-HOCLYGCPSA-N 1 1 358.442 4.261 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186669559 1107880433 /nfs/dbraw/zinc/88/04/33/1107880433.db2.gz ATLFVMCUAXGVKG-OAQYLSRUSA-N 1 1 368.433 4.013 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000186669559 1107880446 /nfs/dbraw/zinc/88/04/46/1107880446.db2.gz ATLFVMCUAXGVKG-OAQYLSRUSA-N 1 1 368.433 4.013 20 5 FIBDMO CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(Cl)cc1 ZINC000520173573 1107946289 /nfs/dbraw/zinc/94/62/89/1107946289.db2.gz QGKYQZCZSLONCU-UHFFFAOYSA-N 1 1 372.812 4.320 20 5 FIBDMO CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(Cl)cc1 ZINC000520173573 1107946293 /nfs/dbraw/zinc/94/62/93/1107946293.db2.gz QGKYQZCZSLONCU-UHFFFAOYSA-N 1 1 372.812 4.320 20 5 FIBDMO COc1ccc(C[NH2+]Cc2ccc(-c3ccc(C)cc3)o2)cc1[N+](=O)[O-] ZINC000520214637 1108054148 /nfs/dbraw/zinc/05/41/48/1108054148.db2.gz OYSCNGZTRQGEGA-UHFFFAOYSA-N 1 1 352.390 4.462 20 5 FIBDMO CC[N@@H+](CCNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C1CC1 ZINC000520218507 1108062500 /nfs/dbraw/zinc/06/25/00/1108062500.db2.gz GNYBCZHCJDFEMT-UHFFFAOYSA-N 1 1 373.428 4.100 20 5 FIBDMO CCN(CC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C1CC1 ZINC000520218507 1108062513 /nfs/dbraw/zinc/06/25/13/1108062513.db2.gz GNYBCZHCJDFEMT-UHFFFAOYSA-N 1 1 373.428 4.100 20 5 FIBDMO CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000444685455 1108063741 /nfs/dbraw/zinc/06/37/41/1108063741.db2.gz ABLPRCIEEMXMID-CYBMUJFWSA-N 1 1 354.410 4.109 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cc(F)cc(F)c1 ZINC000444695791 1108099818 /nfs/dbraw/zinc/09/98/18/1108099818.db2.gz GCLHAKCOWVZEAI-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(CO)(Cc3ccccc3)CC2)c(Cl)c1 ZINC000444786091 1108186111 /nfs/dbraw/zinc/18/61/11/1108186111.db2.gz MWKZQSWHWGPQRP-UHFFFAOYSA-N 1 1 374.868 4.065 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2ccccc2SC)c([N+](=O)[O-])cc1F ZINC000440610037 1108313812 /nfs/dbraw/zinc/31/38/12/1108313812.db2.gz IGEOTOYPHXHPPI-NSHDSACASA-N 1 1 350.415 4.315 20 5 FIBDMO CCC[N@H+](C)Cc1nc(-c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000445228843 1108539579 /nfs/dbraw/zinc/53/95/79/1108539579.db2.gz NZNOECMSNHTZBM-UHFFFAOYSA-N 1 1 368.393 4.279 20 5 FIBDMO CCC[N@@H+](C)Cc1nc(-c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000445228843 1108539589 /nfs/dbraw/zinc/53/95/89/1108539589.db2.gz NZNOECMSNHTZBM-UHFFFAOYSA-N 1 1 368.393 4.279 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCC1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000532166419 1108692417 /nfs/dbraw/zinc/69/24/17/1108692417.db2.gz ZZZWKIUFVAXFGC-HNNXBMFYSA-N 1 1 351.516 4.133 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000524036589 1108766334 /nfs/dbraw/zinc/76/63/34/1108766334.db2.gz DYVUKQFVJBRSEN-AUUYWEPGSA-N 1 1 358.463 4.282 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@H](C)[C@@H]1c1ccccc1 ZINC000524036589 1108766343 /nfs/dbraw/zinc/76/63/43/1108766343.db2.gz DYVUKQFVJBRSEN-AUUYWEPGSA-N 1 1 358.463 4.282 20 5 FIBDMO CC[C@H](Cc1ccccc1)[N@@H+](CC)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532351473 1108775346 /nfs/dbraw/zinc/77/53/46/1108775346.db2.gz IHTQFVNAESQLRJ-LJQANCHMSA-N 1 1 370.449 4.305 20 5 FIBDMO O=[N+]([O-])c1cccc(C[NH2+][C@@H](CO)c2ccc(Cl)cc2C(F)(F)F)c1 ZINC000475633990 1108951078 /nfs/dbraw/zinc/95/10/78/1108951078.db2.gz IETOQSFORQQRHY-HNNXBMFYSA-N 1 1 374.746 4.090 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C ZINC000524429500 1109016876 /nfs/dbraw/zinc/01/68/76/1109016876.db2.gz GMJCCYRROJGFKI-UHFFFAOYSA-N 1 1 355.438 4.102 20 5 FIBDMO CCc1oc2ccccc2c1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446847122 1109364168 /nfs/dbraw/zinc/36/41/68/1109364168.db2.gz ISZRAWBBVPAJIG-UHFFFAOYSA-N 1 1 350.378 4.070 20 5 FIBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000441220675 1109473379 /nfs/dbraw/zinc/47/33/79/1109473379.db2.gz CZEIZDJYLKYAIH-CQSZACIVSA-N 1 1 362.401 4.204 20 5 FIBDMO Cc1c(F)cccc1NC(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000441237494 1109504974 /nfs/dbraw/zinc/50/49/74/1109504974.db2.gz WUPKXBFIPUPSAC-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO Cc1c(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000447597152 1109591921 /nfs/dbraw/zinc/59/19/21/1109591921.db2.gz FKOQPUFRTJTJQO-WKCHPHFGSA-N 1 1 365.477 4.188 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000527054951 1109681424 /nfs/dbraw/zinc/68/14/24/1109681424.db2.gz BHTKVTJQTTWVHR-LPDYGMJQSA-N 1 1 358.360 4.041 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](OCC(F)(F)F)C1 ZINC000527054951 1109681426 /nfs/dbraw/zinc/68/14/26/1109681426.db2.gz BHTKVTJQTTWVHR-LPDYGMJQSA-N 1 1 358.360 4.041 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cnc(C(F)(F)F)s3)C2)cc1 ZINC000449504788 1110094958 /nfs/dbraw/zinc/09/49/58/1110094958.db2.gz WBFBRJRXMNRFNV-GFCCVEGCSA-N 1 1 371.384 4.450 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnc(C(F)(F)F)s3)C2)cc1 ZINC000449504788 1110094963 /nfs/dbraw/zinc/09/49/63/1110094963.db2.gz WBFBRJRXMNRFNV-GFCCVEGCSA-N 1 1 371.384 4.450 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCc3c2ccc(F)c3Br)cs1 ZINC000449547543 1110105753 /nfs/dbraw/zinc/10/57/53/1110105753.db2.gz INHPNOWSRPLOFK-LBPRGKRZSA-N 1 1 371.231 4.335 20 5 FIBDMO Cc1cc(CC(=O)Nc2cc3[nH+]c4cc(N(C)C)ccc4cc3cc2C)on1 ZINC001142213741 1110259157 /nfs/dbraw/zinc/25/91/57/1110259157.db2.gz RDKDVYWCDCLMDL-UHFFFAOYSA-N 1 1 374.444 4.240 20 5 FIBDMO CC[N@H+]1CC[C@@H](N(C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000538718096 1111260539 /nfs/dbraw/zinc/26/05/39/1111260539.db2.gz URSZNHBZTXIYMM-RHSMWYFYSA-N 1 1 374.510 4.023 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](Cc1c[nH]nc1-c1ccc(Cl)cc1)C2 ZINC000538728609 1111265586 /nfs/dbraw/zinc/26/55/86/1111265586.db2.gz LBWAHMVRXFMRBT-UHFFFAOYSA-N 1 1 368.824 4.197 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](Cc1c[nH]nc1-c1ccc(Cl)cc1)C2 ZINC000538728609 1111265592 /nfs/dbraw/zinc/26/55/92/1111265592.db2.gz LBWAHMVRXFMRBT-UHFFFAOYSA-N 1 1 368.824 4.197 20 5 FIBDMO CCC[N@@H+](C)C[C@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000461967245 1111444851 /nfs/dbraw/zinc/44/48/51/1111444851.db2.gz QGVYYZZKPLVJNQ-CYBMUJFWSA-N 1 1 359.392 4.090 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(Br)cn1 ZINC000479511290 1112055115 /nfs/dbraw/zinc/05/51/15/1112055115.db2.gz IZIDBORLDLLQPR-WDEREUQCSA-N 1 1 350.216 4.164 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000482437306 1113254637 /nfs/dbraw/zinc/25/46/37/1113254637.db2.gz DESVTWVCGGTBNG-AZUAARDMSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000482437306 1113254638 /nfs/dbraw/zinc/25/46/38/1113254638.db2.gz DESVTWVCGGTBNG-AZUAARDMSA-N 1 1 367.493 4.118 20 5 FIBDMO C[C@H](N[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000160762996 1113447093 /nfs/dbraw/zinc/44/70/93/1113447093.db2.gz NMPZRXNXJTUUJK-WWMYMODYSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000160762996 1113447095 /nfs/dbraw/zinc/44/70/95/1113447095.db2.gz NMPZRXNXJTUUJK-WWMYMODYSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC[N@H+](C2CCC2)C1 ZINC000488774510 1113993203 /nfs/dbraw/zinc/99/32/03/1113993203.db2.gz IDGVBYKJXADPTA-OAHLLOKOSA-N 1 1 361.486 4.083 20 5 FIBDMO Cc1c(F)cccc1NC(=O)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490200822 1114237436 /nfs/dbraw/zinc/23/74/36/1114237436.db2.gz JOAQAYZPSGEHTK-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000491083075 1114366105 /nfs/dbraw/zinc/36/61/05/1114366105.db2.gz FSJUBEZIIDVPMH-GFCCVEGCSA-N 1 1 360.401 4.114 20 5 FIBDMO COc1cc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000491116988 1114375943 /nfs/dbraw/zinc/37/59/43/1114375943.db2.gz WHTPLLHVSJICLM-NSHDSACASA-N 1 1 370.396 4.010 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000586778940 1114392118 /nfs/dbraw/zinc/39/21/18/1114392118.db2.gz GPNLULMFTSPMPN-CEXWTWQISA-N 1 1 372.852 4.253 20 5 FIBDMO CC(C)[N@@H+](C)Cc1ccccc1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000587235493 1114422343 /nfs/dbraw/zinc/42/23/43/1114422343.db2.gz KWJRZWXMOSSFAX-UHFFFAOYSA-N 1 1 371.466 4.052 20 5 FIBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000164798598 1114585470 /nfs/dbraw/zinc/58/54/70/1114585470.db2.gz CZVVPPPXNKZYHK-MRXNPFEDSA-N 1 1 373.478 4.303 20 5 FIBDMO Cc1cc(N[C@H](Cc2[nH+]ccn2C)c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000589688579 1114827903 /nfs/dbraw/zinc/82/79/03/1114827903.db2.gz DFOFGOADNCOPAT-MRXNPFEDSA-N 1 1 354.385 4.172 20 5 FIBDMO Cc1ccc(CNc2ccnc3c2cccc3[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000590083054 1114888195 /nfs/dbraw/zinc/88/81/95/1114888195.db2.gz BNSQWWLAVVUQOH-UHFFFAOYSA-N 1 1 363.421 4.059 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCOCC3(CCCC3)C2)c1 ZINC000590175340 1114907801 /nfs/dbraw/zinc/90/78/01/1114907801.db2.gz URSFKQQXYSFLCQ-UHFFFAOYSA-N 1 1 358.360 4.006 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCOCC3(CCCC3)C2)c1 ZINC000590175340 1114907804 /nfs/dbraw/zinc/90/78/04/1114907804.db2.gz URSFKQQXYSFLCQ-UHFFFAOYSA-N 1 1 358.360 4.006 20 5 FIBDMO C[C@H]1CC2(C[N@H+]1Cc1ccc(-c3ccccc3[N+](=O)[O-])o1)CCOCC2 ZINC000592527812 1115241201 /nfs/dbraw/zinc/24/12/01/1115241201.db2.gz QUOHTNCTKHLIIR-HNNXBMFYSA-N 1 1 356.422 4.246 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]3c3cccs3)n2)c1 ZINC000046502950 1115380328 /nfs/dbraw/zinc/38/03/28/1115380328.db2.gz NCMREHNJJSMTHH-CQSZACIVSA-N 1 1 356.407 4.043 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]3c3cccs3)n2)c1 ZINC000046502950 1115380331 /nfs/dbraw/zinc/38/03/31/1115380331.db2.gz NCMREHNJJSMTHH-CQSZACIVSA-N 1 1 356.407 4.043 20 5 FIBDMO CC(C)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1F ZINC000594968758 1115499126 /nfs/dbraw/zinc/49/91/26/1115499126.db2.gz KBOHCDKKYPGYGM-GOSISDBHSA-N 1 1 360.385 4.087 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCCOc2ccc(F)cc21 ZINC000595006266 1115507274 /nfs/dbraw/zinc/50/72/74/1115507274.db2.gz HXBASAARGCLJKS-PXAZEXFGSA-N 1 1 360.385 4.307 20 5 FIBDMO CC[NH+](CC)Cc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595003819 1115507530 /nfs/dbraw/zinc/50/75/30/1115507530.db2.gz KYJRXOKMRHHIHR-MRXNPFEDSA-N 1 1 371.481 4.296 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCOc2c(F)cccc21 ZINC000595034641 1115510514 /nfs/dbraw/zinc/51/05/14/1115510514.db2.gz RHVGNZATIGIZBL-YVEFUNNKSA-N 1 1 360.385 4.307 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(OC(C)(C)C)nc1 ZINC000595032792 1115510599 /nfs/dbraw/zinc/51/05/99/1115510599.db2.gz KNYSELDHSPCEEX-ZDUSSCGKSA-N 1 1 359.426 4.027 20 5 FIBDMO COc1cccc(OC)c1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000595074465 1115516480 /nfs/dbraw/zinc/51/64/80/1115516480.db2.gz SIBIETIRFYMSLF-GOSISDBHSA-N 1 1 356.422 4.169 20 5 FIBDMO Cn1ncc(C2CC2)c1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000595078047 1115517158 /nfs/dbraw/zinc/51/71/58/1115517158.db2.gz SIAVOUNEQRICGK-OAQYLSRUSA-N 1 1 362.433 4.085 20 5 FIBDMO C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000595298051 1115522009 /nfs/dbraw/zinc/52/20/09/1115522009.db2.gz NTSLCQPKSSNVJN-FXAWDEMLSA-N 1 1 358.413 4.334 20 5 FIBDMO COc1cc(C[NH2+][C@H](c2ccccc2F)C(C)C)c([N+](=O)[O-])cc1F ZINC000595686762 1115556751 /nfs/dbraw/zinc/55/67/51/1115556751.db2.gz BSBPXCORNMDTBN-SFHVURJKSA-N 1 1 350.365 4.369 20 5 FIBDMO COc1ccc(C[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)cc1[N+](=O)[O-] ZINC000593126561 1115567251 /nfs/dbraw/zinc/56/72/51/1115567251.db2.gz WETDCARVGYQTRE-YYWHXJBOSA-N 1 1 368.433 4.098 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCc2ccccc2-n2ccnc21 ZINC000596095302 1115574266 /nfs/dbraw/zinc/57/42/66/1115574266.db2.gz OSWHROKRPAAPJD-DNVCBOLYSA-N 1 1 362.433 4.427 20 5 FIBDMO CC[N@@H+](CCNc1ccc(C(F)F)cc1[N+](=O)[O-])CCC(F)(F)F ZINC000596209508 1115578663 /nfs/dbraw/zinc/57/86/63/1115578663.db2.gz GJXUFEXLQBGCHJ-UHFFFAOYSA-N 1 1 355.307 4.219 20 5 FIBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)CC1=CCCOC1 ZINC000597206356 1115647650 /nfs/dbraw/zinc/64/76/50/1115647650.db2.gz NWXDRPQKLAQSFZ-UHFFFAOYSA-N 1 1 372.396 4.305 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)CC2=CCCOC2)cc1[N+](=O)[O-] ZINC000597205779 1115649469 /nfs/dbraw/zinc/64/94/69/1115649469.db2.gz JDBFZAVCNPSKQR-UHFFFAOYSA-N 1 1 367.449 4.141 20 5 FIBDMO CC(C)(C)Oc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000602528883 1115710501 /nfs/dbraw/zinc/71/05/01/1115710501.db2.gz MWKUYBYLDDXKNX-UHFFFAOYSA-N 1 1 355.394 4.203 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCc2cc(F)c(Cl)cc21 ZINC000599025970 1115777857 /nfs/dbraw/zinc/77/78/57/1115777857.db2.gz GLNJWLGZMYZLKS-INIZCTEOSA-N 1 1 350.777 4.173 20 5 FIBDMO C[C@H](c1ccsc1)[NH+]1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599070571 1115786698 /nfs/dbraw/zinc/78/66/98/1115786698.db2.gz ZHZRDGOYPDZKEY-CQSZACIVSA-N 1 1 368.462 4.088 20 5 FIBDMO CC(C)(C)OC(=O)[C@@H]1C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000593687006 1115794609 /nfs/dbraw/zinc/79/46/09/1115794609.db2.gz FTWVLBWLMAHCSC-MSOLQXFVSA-N 1 1 368.433 4.255 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000603840570 1115818954 /nfs/dbraw/zinc/81/89/54/1115818954.db2.gz IESATUYXVPXNOE-UHFFFAOYSA-N 1 1 370.327 4.134 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576664 1115827894 /nfs/dbraw/zinc/82/78/94/1115827894.db2.gz QAANANBAUBIKND-YCRPNKLZSA-N 1 1 366.417 4.156 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576664 1115827895 /nfs/dbraw/zinc/82/78/95/1115827895.db2.gz QAANANBAUBIKND-YCRPNKLZSA-N 1 1 366.417 4.156 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](CC3CCCCC3)CC2)c2ccncc21 ZINC000603932120 1115830917 /nfs/dbraw/zinc/83/09/17/1115830917.db2.gz IZACXKSBIXRVRX-UHFFFAOYSA-N 1 1 368.481 4.235 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)c(OC)c1 ZINC000599601085 1115830996 /nfs/dbraw/zinc/83/09/96/1115830996.db2.gz QQKJLYPBZPTYRF-AWEZNQCLSA-N 1 1 374.437 4.250 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccc3c(c2)OCO3)C2CCCC2)cs1 ZINC000603933554 1115831153 /nfs/dbraw/zinc/83/11/53/1115831153.db2.gz MRRISSGIOQWRDE-UHFFFAOYSA-N 1 1 360.435 4.330 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2ccc3c(c2)OCO3)C2CCCC2)cs1 ZINC000603933554 1115831156 /nfs/dbraw/zinc/83/11/56/1115831156.db2.gz MRRISSGIOQWRDE-UHFFFAOYSA-N 1 1 360.435 4.330 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000604521709 1115867391 /nfs/dbraw/zinc/86/73/91/1115867391.db2.gz VEZKWMBZQUUUKT-FPOVZHCZSA-N 1 1 354.450 4.237 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000171954526 1115892701 /nfs/dbraw/zinc/89/27/01/1115892701.db2.gz YVNUNJZFOWPJEN-UHFFFAOYSA-N 1 1 358.413 4.163 20 5 FIBDMO CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccccc1 ZINC000063482228 1116073752 /nfs/dbraw/zinc/07/37/52/1116073752.db2.gz FKIQAHKLGTYYGP-UHFFFAOYSA-N 1 1 355.438 4.144 20 5 FIBDMO C[C@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@@H+]1CCCC[C@H]1C ZINC000608836451 1116131174 /nfs/dbraw/zinc/13/11/74/1116131174.db2.gz YOJKWFJRZYJBSD-HZPDHXFCSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@H+]1CCCC[C@H]1C ZINC000608836451 1116131176 /nfs/dbraw/zinc/13/11/76/1116131176.db2.gz YOJKWFJRZYJBSD-HZPDHXFCSA-N 1 1 357.454 4.207 20 5 FIBDMO C[N@H+](CCNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccc1 ZINC000608836828 1116131329 /nfs/dbraw/zinc/13/13/29/1116131329.db2.gz RJLOLMMEZTUICG-UHFFFAOYSA-N 1 1 365.433 4.076 20 5 FIBDMO C[N@@H+](CCNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccc1 ZINC000608836828 1116131331 /nfs/dbraw/zinc/13/13/31/1116131331.db2.gz RJLOLMMEZTUICG-UHFFFAOYSA-N 1 1 365.433 4.076 20 5 FIBDMO CC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)Cc1ccc(C)cc1 ZINC000535072334 1116267258 /nfs/dbraw/zinc/26/72/58/1116267258.db2.gz JANFQYOQSDSYPN-UHFFFAOYSA-N 1 1 364.449 4.326 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C2(c3cccc(F)c3)CCOCC2)c1 ZINC000174647829 1116327849 /nfs/dbraw/zinc/32/78/49/1116327849.db2.gz TXODQOMJNUUZRZ-UHFFFAOYSA-N 1 1 364.804 4.183 20 5 FIBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000535593283 1116329601 /nfs/dbraw/zinc/32/96/01/1116329601.db2.gz BHMLSRGMIPUHNT-UHFFFAOYSA-N 1 1 368.481 4.213 20 5 FIBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089907089 1116346976 /nfs/dbraw/zinc/34/69/76/1116346976.db2.gz LJQPJTWXTPTORL-IRXDYDNUSA-N 1 1 361.467 4.356 20 5 FIBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000539928293 1117752771 /nfs/dbraw/zinc/75/27/71/1117752771.db2.gz WSIZUKLVOWMWAX-JCVNQNCUSA-N 1 1 360.454 4.052 20 5 FIBDMO C[N@@H+](Cc1ccco1)Cc1ccccc1CNc1ccccc1[N+](=O)[O-] ZINC000462884789 1117839572 /nfs/dbraw/zinc/83/95/72/1117839572.db2.gz AJPRDBJGWFRAFG-UHFFFAOYSA-N 1 1 351.406 4.432 20 5 FIBDMO CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000540323787 1117992052 /nfs/dbraw/zinc/99/20/52/1117992052.db2.gz CEORGEJSQSTCPJ-CQSZACIVSA-N 1 1 372.421 4.099 20 5 FIBDMO Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]Cc1onc(C)c1[N+](=O)[O-] ZINC000595429582 1118250225 /nfs/dbraw/zinc/25/02/25/1118250225.db2.gz GLQQHGZVDHMPMB-OAHLLOKOSA-N 1 1 357.435 4.335 20 5 FIBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)n1 ZINC000541007205 1118343304 /nfs/dbraw/zinc/34/33/04/1118343304.db2.gz REVAIYSJRSZSMM-WMLDXEAASA-N 1 1 360.483 4.163 20 5 FIBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000541019595 1118356420 /nfs/dbraw/zinc/35/64/20/1118356420.db2.gz FJXIPSFLPBLOTB-FOIQADDNSA-N 1 1 355.438 4.304 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000122411585 1118397297 /nfs/dbraw/zinc/39/72/97/1118397297.db2.gz LDSXSMWHDCEBRP-INIZCTEOSA-N 1 1 362.813 4.260 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2ccccc2OC(F)F)c([N+](=O)[O-])cc1F ZINC000464492409 1118581989 /nfs/dbraw/zinc/58/19/89/1118581989.db2.gz CRUBAXLUCDMLHS-JTQLQIEISA-N 1 1 370.327 4.195 20 5 FIBDMO O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000464761335 1118684143 /nfs/dbraw/zinc/68/41/43/1118684143.db2.gz NBULVMKXUDDDMH-INIZCTEOSA-N 1 1 358.463 4.088 20 5 FIBDMO CC[C@@]1(C)CCC[N@@H+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])C1 ZINC000464774832 1118689811 /nfs/dbraw/zinc/68/98/11/1118689811.db2.gz KQSWCOUGWGYULD-KRWDZBQOSA-N 1 1 358.385 4.217 20 5 FIBDMO Cc1ccc(CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C[C@@H]2CCCO2)cc1 ZINC000464776361 1118690552 /nfs/dbraw/zinc/69/05/52/1118690552.db2.gz NIECJKSDNRYFJM-NRFANRHFSA-N 1 1 354.450 4.127 20 5 FIBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000609144641 1118771822 /nfs/dbraw/zinc/77/18/22/1118771822.db2.gz TZUAOUWLAFZFKU-JXFKEZNVSA-N 1 1 358.413 4.334 20 5 FIBDMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000172841697 1118983059 /nfs/dbraw/zinc/98/30/59/1118983059.db2.gz XZELXXQQAYWHGF-SFHVURJKSA-N 1 1 361.489 4.334 20 5 FIBDMO COc1cc(C[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000491890257 1118990525 /nfs/dbraw/zinc/99/05/25/1118990525.db2.gz NJUCYABMBVHYQM-UHFFFAOYSA-N 1 1 358.385 4.012 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000492107331 1119025651 /nfs/dbraw/zinc/02/56/51/1119025651.db2.gz OZWAORLIDUTWPQ-QLFBSQMISA-N 1 1 351.878 4.085 20 5 FIBDMO COc1ccc2nc(C[NH2+]C(C)(C)c3ccccc3[N+](=O)[O-])sc2c1 ZINC000492109465 1119026462 /nfs/dbraw/zinc/02/64/62/1119026462.db2.gz RVAVIBNAYKUQQB-UHFFFAOYSA-N 1 1 357.435 4.238 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1ccc(Cl)cc1 ZINC000031006293 1119211137 /nfs/dbraw/zinc/21/11/37/1119211137.db2.gz ALPPFEXUNCWQNF-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000492912786 1119212698 /nfs/dbraw/zinc/21/26/98/1119212698.db2.gz QCGWLFRTFLOPAQ-IERDGZPVSA-N 1 1 352.434 4.138 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCO[C@@]2(CCc3ccccc32)C1 ZINC000492912786 1119212706 /nfs/dbraw/zinc/21/27/06/1119212706.db2.gz QCGWLFRTFLOPAQ-IERDGZPVSA-N 1 1 352.434 4.138 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccs2)C[C@@H]2CCCO2)cc1Cl ZINC000761506034 1119406705 /nfs/dbraw/zinc/40/67/05/1119406705.db2.gz MUTOGTASSSSBFB-AWEZNQCLSA-N 1 1 366.870 4.491 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccs2)C[C@@H]2CCCO2)cc1Cl ZINC000761506034 1119406709 /nfs/dbraw/zinc/40/67/09/1119406709.db2.gz MUTOGTASSSSBFB-AWEZNQCLSA-N 1 1 366.870 4.491 20 5 FIBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761513685 1119407351 /nfs/dbraw/zinc/40/73/51/1119407351.db2.gz CCBQUYZBIMHMJC-ZDUSSCGKSA-N 1 1 368.861 4.192 20 5 FIBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761513685 1119407352 /nfs/dbraw/zinc/40/73/52/1119407352.db2.gz CCBQUYZBIMHMJC-ZDUSSCGKSA-N 1 1 368.861 4.192 20 5 FIBDMO Cc1ccccc1CN1CCC([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761520354 1119409457 /nfs/dbraw/zinc/40/94/57/1119409457.db2.gz BVPPJPYAQZCWPQ-UHFFFAOYSA-N 1 1 373.884 4.311 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000493252435 1119435427 /nfs/dbraw/zinc/43/54/27/1119435427.db2.gz HRIVIYJUWFILMV-INIZCTEOSA-N 1 1 360.841 4.287 20 5 FIBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000487739869 1119528094 /nfs/dbraw/zinc/52/80/94/1119528094.db2.gz NGKTWONDUXUHEI-AWEZNQCLSA-N 1 1 368.462 4.088 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494275416 1119811998 /nfs/dbraw/zinc/81/19/98/1119811998.db2.gz ZJSKHRUGHCUYJR-PEZBUJJGSA-N 1 1 367.449 4.267 20 5 FIBDMO CCc1ccc([C@H]([NH2+]CC2([C@H](O)C(C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542494067 1120065770 /nfs/dbraw/zinc/06/57/70/1120065770.db2.gz JQLGZMWTDKDPEI-WOJBJXKFSA-N 1 1 372.465 4.226 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC000495239678 1120564876 /nfs/dbraw/zinc/56/48/76/1120564876.db2.gz AXLZFRQQQMTMIL-GFCCVEGCSA-N 1 1 352.431 4.257 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCN(c2ccccc2)CC1 ZINC000303256821 1120742513 /nfs/dbraw/zinc/74/25/13/1120742513.db2.gz OKRMQPJVJPARPQ-UHFFFAOYSA-N 1 1 369.465 4.094 20 5 FIBDMO Cn1c(=O)c2cc3ccccc3cc2nc1SCC[C@@H]1CCCC[N@H+]1C ZINC000495389350 1120774665 /nfs/dbraw/zinc/77/46/65/1120774665.db2.gz JFNAZXWYXFQQSK-KRWDZBQOSA-N 1 1 367.518 4.053 20 5 FIBDMO Cc1c([C@H](C)N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000495440343 1120824643 /nfs/dbraw/zinc/82/46/43/1120824643.db2.gz RGBQZMXLZXTEOF-WSTZPKSXSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1c([C@H](C)N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000495440343 1120824645 /nfs/dbraw/zinc/82/46/45/1120824645.db2.gz RGBQZMXLZXTEOF-WSTZPKSXSA-N 1 1 367.493 4.464 20 5 FIBDMO CC(C)n1ncc2cc(C[N@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)cnc21 ZINC000153269933 1121009251 /nfs/dbraw/zinc/00/92/51/1121009251.db2.gz FCWWQELKWDYMIE-UHFFFAOYSA-N 1 1 365.437 4.085 20 5 FIBDMO CC(C)n1ncc2cc(C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)cnc21 ZINC000153269933 1121009256 /nfs/dbraw/zinc/00/92/56/1121009256.db2.gz FCWWQELKWDYMIE-UHFFFAOYSA-N 1 1 365.437 4.085 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCCCC[C@@H]1c1ccco1 ZINC000076803842 1121139386 /nfs/dbraw/zinc/13/93/86/1121139386.db2.gz DAYOGVDQQHNCFG-QGZVFWFLSA-N 1 1 357.410 4.052 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCCC[C@@H]1c1ccco1 ZINC000076803842 1121139390 /nfs/dbraw/zinc/13/93/90/1121139390.db2.gz DAYOGVDQQHNCFG-QGZVFWFLSA-N 1 1 357.410 4.052 20 5 FIBDMO CC(=O)c1ccc(NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301430585 1121156220 /nfs/dbraw/zinc/15/62/20/1121156220.db2.gz QIBGGKIAOYWZQY-BEFAXECRSA-N 1 1 373.478 4.354 20 5 FIBDMO C[C@@H](NCc1ccccc1C[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000153843052 1121412513 /nfs/dbraw/zinc/41/25/13/1121412513.db2.gz PGDBYRWRUFIVIK-QGZVFWFLSA-N 1 1 353.466 4.432 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)ccc1Cl ZINC000154166575 1121840356 /nfs/dbraw/zinc/84/03/56/1121840356.db2.gz ICUQQEZKQYFWMB-XJKSGUPXSA-N 1 1 366.870 4.398 20 5 FIBDMO CCOc1cc(NCc2ccc(-n3cc[nH+]c3C)c(F)c2)ccc1[N+](=O)[O-] ZINC000301455076 1122028789 /nfs/dbraw/zinc/02/87/89/1122028789.db2.gz WFOHYOHDMSALNO-UHFFFAOYSA-N 1 1 370.384 4.239 20 5 FIBDMO CC(=O)c1ccc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301542069 1122218982 /nfs/dbraw/zinc/21/89/82/1122218982.db2.gz NTIJRJMAFFYNPZ-BEFAXECRSA-N 1 1 367.449 4.262 20 5 FIBDMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000301560061 1122219868 /nfs/dbraw/zinc/21/98/68/1122219868.db2.gz UJOJRTFYPFPQCS-BXKDBHETSA-N 1 1 365.783 4.043 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000301551230 1122220200 /nfs/dbraw/zinc/22/02/00/1122220200.db2.gz QRKNULZEKKYDQI-QFBILLFUSA-N 1 1 369.465 4.206 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(Br)ccc1Cl ZINC000225257337 1122225664 /nfs/dbraw/zinc/22/56/64/1122225664.db2.gz YKLXDZCRUKPQAI-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO CC(=O)c1ccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000301597025 1122230507 /nfs/dbraw/zinc/23/05/07/1122230507.db2.gz SQPYLYDHCRMHGV-HNAYVOBHSA-N 1 1 367.449 4.120 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCC[C@H]2c2cc3ccccc3[nH]2)c1 ZINC000154526549 1122443571 /nfs/dbraw/zinc/44/35/71/1122443571.db2.gz QCLJUFNPOXPNAK-SFTDATJTSA-N 1 1 365.433 4.337 20 5 FIBDMO COc1cc(OC)c(OC)cc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000194999472 1123067927 /nfs/dbraw/zinc/06/79/27/1123067927.db2.gz HDYJEEKMCQKXKS-UHFFFAOYSA-N 1 1 374.437 4.031 20 5 FIBDMO COc1cc(OC)c(OC)cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000194999472 1123067932 /nfs/dbraw/zinc/06/79/32/1123067932.db2.gz HDYJEEKMCQKXKS-UHFFFAOYSA-N 1 1 374.437 4.031 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1c(F)cccc1N1CCCC1 ZINC000556913211 1123221896 /nfs/dbraw/zinc/22/18/96/1123221896.db2.gz RAMKOVFPRAVDAB-HNNXBMFYSA-N 1 1 357.429 4.493 20 5 FIBDMO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000609625681 1123773920 /nfs/dbraw/zinc/77/39/20/1123773920.db2.gz OAUMFVVNNIIFTR-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO CC[C@@H]1c2ccccc2CC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000609625681 1123773923 /nfs/dbraw/zinc/77/39/23/1123773923.db2.gz OAUMFVVNNIIFTR-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(Br)ccc2Cl)cc1 ZINC000135916473 1123814923 /nfs/dbraw/zinc/81/49/23/1123814923.db2.gz LOZMHIYDVUVAQE-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO Cc1cc(C[NH2+]Cc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)[nH]n1 ZINC000610009950 1123915782 /nfs/dbraw/zinc/91/57/82/1123915782.db2.gz JNEHPLYCDNXKCC-UHFFFAOYSA-N 1 1 368.462 4.376 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000067962739 1124004264 /nfs/dbraw/zinc/00/42/64/1124004264.db2.gz LWTLYZBMTMSNFM-CQSZACIVSA-N 1 1 367.405 4.281 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000067962739 1124004270 /nfs/dbraw/zinc/00/42/70/1124004270.db2.gz LWTLYZBMTMSNFM-CQSZACIVSA-N 1 1 367.405 4.281 20 5 FIBDMO Cn1cc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c(-c2cccs2)n1 ZINC000179695280 1124032354 /nfs/dbraw/zinc/03/23/54/1124032354.db2.gz QUFLOOREDCTBOJ-UHFFFAOYSA-N 1 1 368.462 4.221 20 5 FIBDMO Cn1cc[nH+]c1C[C@H](Nc1nc2ccccc2cc1[N+](=O)[O-])c1ccccc1 ZINC000616060031 1124214984 /nfs/dbraw/zinc/21/49/84/1124214984.db2.gz OYRRSXHFCGAKDA-SFHVURJKSA-N 1 1 373.416 4.272 20 5 FIBDMO CCn1c(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc2cc(F)ccc21 ZINC000181820650 1125143995 /nfs/dbraw/zinc/14/39/95/1125143995.db2.gz XFCSSZBKDJRIHS-CYBMUJFWSA-N 1 1 356.401 4.263 20 5 FIBDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182042407 1125215623 /nfs/dbraw/zinc/21/56/23/1125215623.db2.gz XDFBWCBALPWRCB-ZDUSSCGKSA-N 1 1 371.828 4.022 20 5 FIBDMO C[C@@H](c1ccc(-n2cncn2)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000182042407 1125215628 /nfs/dbraw/zinc/21/56/28/1125215628.db2.gz XDFBWCBALPWRCB-ZDUSSCGKSA-N 1 1 371.828 4.022 20 5 FIBDMO C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311850868 1125232698 /nfs/dbraw/zinc/23/26/98/1125232698.db2.gz SJRSXTIWISVEFY-ZIFCJYIRSA-N 1 1 353.466 4.156 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000301776035 1125264062 /nfs/dbraw/zinc/26/40/62/1125264062.db2.gz LHHOMUROKYFGNW-WFASDCNBSA-N 1 1 369.387 4.067 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000570607355 568490730 /nfs/dbraw/zinc/49/07/30/568490730.db2.gz RFCSOCWLWUUFKN-LPHOPBHVSA-N 1 1 351.450 4.101 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCc3cccnc32)cc(C(F)(F)F)c1 ZINC000619611404 1125634156 /nfs/dbraw/zinc/63/41/56/1125634156.db2.gz GQZCLALVISMMKD-OAHLLOKOSA-N 1 1 351.328 4.176 20 5 FIBDMO Cc1ccccc1[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)C ZINC000183224317 1125781089 /nfs/dbraw/zinc/78/10/89/1125781089.db2.gz IGZNBABNOSQLRI-IBGZPJMESA-N 1 1 366.421 4.440 20 5 FIBDMO CC[C@@H]1CC[N@H+]1Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000430207834 1079954124 /nfs/dbraw/zinc/95/41/24/1079954124.db2.gz RSOUBWLUJTZOSR-QGZVFWFLSA-N 1 1 356.422 4.167 20 5 FIBDMO COc1ccc(C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C2CC2)cc1 ZINC001167131407 1080661708 /nfs/dbraw/zinc/66/17/08/1080661708.db2.gz OQCJCDIFEVAHGH-INIZCTEOSA-N 1 1 370.449 4.283 20 5 FIBDMO Cc1nc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc2ccccc12 ZINC000579919000 1081005114 /nfs/dbraw/zinc/00/51/14/1081005114.db2.gz CPQXCWDQNHTGHR-KRWDZBQOSA-N 1 1 362.433 4.226 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@H](C(=O)c3ccc(F)cc3)C2)cccc1[N+](=O)[O-] ZINC000610004681 1081370219 /nfs/dbraw/zinc/37/02/19/1081370219.db2.gz XJUFFZOTWCDQBA-KRWDZBQOSA-N 1 1 356.397 4.137 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H](Cc3ccccc3)C2)cc1 ZINC001167333539 1081455945 /nfs/dbraw/zinc/45/59/45/1081455945.db2.gz XNBNWSPBNBWETA-LJQANCHMSA-N 1 1 354.450 4.318 20 5 FIBDMO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083199340 1081547673 /nfs/dbraw/zinc/54/76/73/1081547673.db2.gz JVORSEZERNLEFY-OCCSQVGLSA-N 1 1 355.369 4.253 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000610370761 1081554697 /nfs/dbraw/zinc/55/46/97/1081554697.db2.gz FNFAUHGFXBNSBL-BFUOFWGJSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2F)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000610370761 1081554701 /nfs/dbraw/zinc/55/47/01/1081554701.db2.gz FNFAUHGFXBNSBL-BFUOFWGJSA-N 1 1 372.396 4.184 20 5 FIBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H]1CCOC1 ZINC000463031559 1081983091 /nfs/dbraw/zinc/98/30/91/1081983091.db2.gz VWMAPDJCNZRRNJ-CYBMUJFWSA-N 1 1 350.802 4.119 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1 ZINC001167433373 1082125064 /nfs/dbraw/zinc/12/50/64/1082125064.db2.gz CEFZBHBXLILICZ-QGZVFWFLSA-N 1 1 358.413 4.067 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)c1 ZINC000175847539 1082131200 /nfs/dbraw/zinc/13/12/00/1082131200.db2.gz LKWLIPZZDBMRQP-XJKSGUPXSA-N 1 1 366.870 4.398 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2cccc(C)c2C)c([N+](=O)[O-])c1 ZINC001167464512 1082596749 /nfs/dbraw/zinc/59/67/49/1082596749.db2.gz NHUAUYCVZWOCCM-LJQANCHMSA-N 1 1 370.449 4.436 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC000510504103 1083109920 /nfs/dbraw/zinc/10/99/20/1083109920.db2.gz XTXHYRUYKXBRQA-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCC[C@@H]3Cc3ccccc3)nc2c1 ZINC000610581515 1083207397 /nfs/dbraw/zinc/20/73/97/1083207397.db2.gz OQXOCCXVUMVIKE-MRXNPFEDSA-N 1 1 351.406 4.333 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(c4ccc(F)c(F)c4)CC3)nc2c1 ZINC000610581956 1083211381 /nfs/dbraw/zinc/21/13/81/1083211381.db2.gz ZAULIAGENMINED-UHFFFAOYSA-N 1 1 373.359 4.394 20 5 FIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582733 1083220973 /nfs/dbraw/zinc/22/09/73/1083220973.db2.gz SRQSQOBFBCATPL-YVEFUNNKSA-N 1 1 355.369 4.458 20 5 FIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000610582733 1083220976 /nfs/dbraw/zinc/22/09/76/1083220976.db2.gz SRQSQOBFBCATPL-YVEFUNNKSA-N 1 1 355.369 4.458 20 5 FIBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000612137839 1083433127 /nfs/dbraw/zinc/43/31/27/1083433127.db2.gz XQAMPDBIJMEVLT-ACJLOTCBSA-N 1 1 367.405 4.328 20 5 FIBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000612137839 1083433130 /nfs/dbraw/zinc/43/31/30/1083433130.db2.gz XQAMPDBIJMEVLT-ACJLOTCBSA-N 1 1 367.405 4.328 20 5 FIBDMO CC[N@H+](Cc1cccc(F)c1)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000102696123 1083495419 /nfs/dbraw/zinc/49/54/19/1083495419.db2.gz QPOMWLBCKAICKC-ZDUSSCGKSA-N 1 1 370.384 4.367 20 5 FIBDMO CC[N@@H+](Cc1cccc(F)c1)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000102696123 1083495422 /nfs/dbraw/zinc/49/54/22/1083495422.db2.gz QPOMWLBCKAICKC-ZDUSSCGKSA-N 1 1 370.384 4.367 20 5 FIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(OC(F)F)cc1 ZINC000179606654 1083571074 /nfs/dbraw/zinc/57/10/74/1083571074.db2.gz ARHLVEZXICFERU-SNVBAGLBSA-N 1 1 363.320 4.188 20 5 FIBDMO O=[N+]([O-])c1sccc1N1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000610808054 1083717951 /nfs/dbraw/zinc/71/79/51/1083717951.db2.gz YBNIISUKXWAFJG-SJORKVTESA-N 1 1 357.479 4.147 20 5 FIBDMO C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](c2ccco2)C1 ZINC000247694582 1083865007 /nfs/dbraw/zinc/86/50/07/1083865007.db2.gz WMQMTBMUYOPGPN-CXAGYDPISA-N 1 1 358.394 4.028 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](c2ccco2)C1 ZINC000247694582 1083865019 /nfs/dbraw/zinc/86/50/19/1083865019.db2.gz WMQMTBMUYOPGPN-CXAGYDPISA-N 1 1 358.394 4.028 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCSC4(CCC4)CC3)o2)c1 ZINC000411862198 1083914766 /nfs/dbraw/zinc/91/47/66/1083914766.db2.gz AVIWNPJQUDWBAD-UHFFFAOYSA-N 1 1 373.478 4.154 20 5 FIBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])C12CCCCC2 ZINC001167539408 1084493827 /nfs/dbraw/zinc/49/38/27/1084493827.db2.gz MQIIWLUUIIIFGX-ROUUACIJSA-N 1 1 350.434 4.294 20 5 FIBDMO C[NH+](C)C[C@@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000563249734 1084633426 /nfs/dbraw/zinc/63/34/26/1084633426.db2.gz KIPHOGYGOSUOCL-SUQGKYDKSA-N 1 1 359.857 4.154 20 5 FIBDMO COc1cc(N[C@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c(F)cc1[N+](=O)[O-] ZINC000381226681 1084637233 /nfs/dbraw/zinc/63/72/33/1084637233.db2.gz XGCRAGMZDYOZJN-GDBMZVCRSA-N 1 1 373.428 4.065 20 5 FIBDMO Cn1ncc2c1CCC[C@H]2[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000180208870 1084898300 /nfs/dbraw/zinc/89/83/00/1084898300.db2.gz ICFGEBCSSDXXMN-GOSISDBHSA-N 1 1 366.421 4.098 20 5 FIBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])NC1CC([NH+]2CCCCC2)C1 ZINC000479509697 1085183495 /nfs/dbraw/zinc/18/34/95/1085183495.db2.gz CKHUXTIWQSIKQO-GTPINHCMSA-N 1 1 363.527 4.072 20 5 FIBDMO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC(N2CCCCC2)C1 ZINC000479509697 1085183501 /nfs/dbraw/zinc/18/35/01/1085183501.db2.gz CKHUXTIWQSIKQO-GTPINHCMSA-N 1 1 363.527 4.072 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](CCO)C2)ccc1Oc1ccc(F)cc1 ZINC000093106845 1085321633 /nfs/dbraw/zinc/32/16/33/1085321633.db2.gz NJSMNSJBRHIOHE-HNNXBMFYSA-N 1 1 374.412 4.121 20 5 FIBDMO CC[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[C@@H]1c1ccccc1 ZINC001167601540 1085422413 /nfs/dbraw/zinc/42/24/13/1085422413.db2.gz DHHDGDUOQIJPIH-YJBOKZPZSA-N 1 1 364.449 4.487 20 5 FIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C(F)F)C2)cc1OC ZINC000611668740 1085543799 /nfs/dbraw/zinc/54/37/99/1085543799.db2.gz TXIFBMMHDLJAOL-CHWSQXEVSA-N 1 1 372.412 4.115 20 5 FIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C(F)F)C2)cc1OC ZINC000611668740 1085543800 /nfs/dbraw/zinc/54/38/00/1085543800.db2.gz TXIFBMMHDLJAOL-CHWSQXEVSA-N 1 1 372.412 4.115 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+](Cc2ccccc2F)C2CC2)cccc1[N+](=O)[O-] ZINC000109093056 1085584671 /nfs/dbraw/zinc/58/46/71/1085584671.db2.gz PWMOEMBJDLMTSN-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1ccccc1C ZINC000109105317 1085588416 /nfs/dbraw/zinc/58/84/16/1085588416.db2.gz BQRUETJSEHYWIZ-UHFFFAOYSA-N 1 1 355.438 4.062 20 5 FIBDMO Cn1c2ccc(Nc3ncnc4ccc([N+](=O)[O-])cc43)cc2[nH+]c1C1CC1 ZINC000611712130 1085593889 /nfs/dbraw/zinc/59/38/89/1085593889.db2.gz GLDASPDGMPVNRS-UHFFFAOYSA-N 1 1 360.377 4.046 20 5 FIBDMO COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000612137847 1085783605 /nfs/dbraw/zinc/78/36/05/1085783605.db2.gz XQAMPDBIJMEVLT-UGSOOPFHSA-N 1 1 367.405 4.328 20 5 FIBDMO COc1cccc([C@@H]2C[C@H](C)C[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000612137847 1085783617 /nfs/dbraw/zinc/78/36/17/1085783617.db2.gz XQAMPDBIJMEVLT-UGSOOPFHSA-N 1 1 367.405 4.328 20 5 FIBDMO COc1ccc(C(=O)C2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000051380047 1085839129 /nfs/dbraw/zinc/83/91/29/1085839129.db2.gz IGKFQIUTPFTNRM-UHFFFAOYSA-N 1 1 368.433 4.007 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000178730762 1085968262 /nfs/dbraw/zinc/96/82/62/1085968262.db2.gz XWKMKYCLRHSDBT-LLVKDONJSA-N 1 1 370.327 4.353 20 5 FIBDMO Cc1ccnc(N[C@H]2CCCCC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000709632361 1085988678 /nfs/dbraw/zinc/98/86/78/1085988678.db2.gz LLSNNRUHXKCIHE-SFHVURJKSA-N 1 1 354.454 4.155 20 5 FIBDMO Cc1noc(C[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000759929076 1086143819 /nfs/dbraw/zinc/14/38/19/1086143819.db2.gz KQBMEWKLNAJDSI-MRXNPFEDSA-N 1 1 372.812 4.013 20 5 FIBDMO C[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000136827732 1086623240 /nfs/dbraw/zinc/62/32/40/1086623240.db2.gz RBZMNQPCIMVYNW-QWHCGFSZSA-N 1 1 364.829 4.101 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1)C1CC1 ZINC000512172942 1086883006 /nfs/dbraw/zinc/88/30/06/1086883006.db2.gz QMPUSQQZYVBIRU-OAHLLOKOSA-N 1 1 367.449 4.070 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000052803872 1087168417 /nfs/dbraw/zinc/16/84/17/1087168417.db2.gz BDIYNVVCHXKPDQ-CXAGYDPISA-N 1 1 359.451 4.129 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000052803872 1087168420 /nfs/dbraw/zinc/16/84/20/1087168420.db2.gz BDIYNVVCHXKPDQ-CXAGYDPISA-N 1 1 359.451 4.129 20 5 FIBDMO COC[C@H]1CC[N@H+]1Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000573214523 1087325082 /nfs/dbraw/zinc/32/50/82/1087325082.db2.gz XOZLJQLCYKRURO-OAHLLOKOSA-N 1 1 362.813 4.261 20 5 FIBDMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000065674975 1087386390 /nfs/dbraw/zinc/38/63/90/1087386390.db2.gz VQKVQPRSJJVXQY-IRXDYDNUSA-N 1 1 361.489 4.238 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000708585552 1087629285 /nfs/dbraw/zinc/62/92/85/1087629285.db2.gz HBSRQXWKLVEXOT-QAPCUYQASA-N 1 1 373.884 4.106 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000708585553 1087629381 /nfs/dbraw/zinc/62/93/81/1087629381.db2.gz HBSRQXWKLVEXOT-YJBOKZPZSA-N 1 1 373.884 4.106 20 5 FIBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c(Cl)c1 ZINC000424293208 1087901998 /nfs/dbraw/zinc/90/19/98/1087901998.db2.gz CQVPZAAXBVOJOZ-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000180714902 1088038512 /nfs/dbraw/zinc/03/85/12/1088038512.db2.gz FTBGQCOWZXHNAM-BLLLJJGKSA-N 1 1 360.385 4.307 20 5 FIBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C(c3ccccc3)c3ccccc3)C2)nc1 ZINC000514085615 1088728590 /nfs/dbraw/zinc/72/85/90/1088728590.db2.gz YNQIDVWWYAJXMX-LJQANCHMSA-N 1 1 374.444 4.266 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000434609401 1088847199 /nfs/dbraw/zinc/84/71/99/1088847199.db2.gz SOJXTJUEYBBNLK-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000434609401 1088847221 /nfs/dbraw/zinc/84/72/21/1088847221.db2.gz SOJXTJUEYBBNLK-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1CN1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000434682238 1088953195 /nfs/dbraw/zinc/95/31/95/1088953195.db2.gz BJGLJCDVSMJZAB-UHFFFAOYSA-N 1 1 374.872 4.161 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000434891567 1089097760 /nfs/dbraw/zinc/09/77/60/1089097760.db2.gz IYAINUNAZZKEDM-XYJFISCASA-N 1 1 367.449 4.108 20 5 FIBDMO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000434892614 1089099060 /nfs/dbraw/zinc/09/90/60/1089099060.db2.gz TUFWBPLJRIEKSB-XJKSGUPXSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000434892614 1089099078 /nfs/dbraw/zinc/09/90/78/1089099078.db2.gz TUFWBPLJRIEKSB-XJKSGUPXSA-N 1 1 373.840 4.065 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2ccccc2)s1 ZINC000549171832 1089112861 /nfs/dbraw/zinc/11/28/61/1089112861.db2.gz JSNNOHZDKGEYBK-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2ccccc2)s1 ZINC000549171832 1089112867 /nfs/dbraw/zinc/11/28/67/1089112867.db2.gz JSNNOHZDKGEYBK-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(OCC2CCCC2)CC1 ZINC000434896922 1089113250 /nfs/dbraw/zinc/11/32/50/1089113250.db2.gz UFCMRYIIXIHFOV-UHFFFAOYSA-N 1 1 352.862 4.419 20 5 FIBDMO C[C@@H]1[C@H](Cc2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000435039234 1089215153 /nfs/dbraw/zinc/21/51/53/1089215153.db2.gz CQVYDKANKNFWMC-ZBFHGGJFSA-N 1 1 351.406 4.189 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccc(F)cc1 ZINC000104662294 1090288959 /nfs/dbraw/zinc/28/89/59/1090288959.db2.gz BNNKGTKQEQXANW-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1cccc(F)c1 ZINC000500120480 1091051965 /nfs/dbraw/zinc/05/19/65/1091051965.db2.gz XSNWPMSPAQRCGL-JLTOFOAXSA-N 1 1 371.412 4.146 20 5 FIBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728900685 1091800706 /nfs/dbraw/zinc/80/07/06/1091800706.db2.gz PHFNSKKZMIPOKR-SFHVURJKSA-N 1 1 362.433 4.214 20 5 FIBDMO CC[C@@H]1C[C@]1([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccc(C)c1 ZINC000500532866 1092195187 /nfs/dbraw/zinc/19/51/87/1092195187.db2.gz LUNJQUVNJLROHF-DYESRHJHSA-N 1 1 368.433 4.185 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000432769962 1092313472 /nfs/dbraw/zinc/31/34/72/1092313472.db2.gz FMORIIINZMFSAX-CQSZACIVSA-N 1 1 367.405 4.281 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000432769962 1092313484 /nfs/dbraw/zinc/31/34/84/1092313484.db2.gz FMORIIINZMFSAX-CQSZACIVSA-N 1 1 367.405 4.281 20 5 FIBDMO COc1cc(C[N@H+]2CC3(CCC3)C[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000432788817 1092367323 /nfs/dbraw/zinc/36/73/23/1092367323.db2.gz MRAQEAHVPGUMEW-GFCCVEGCSA-N 1 1 370.396 4.012 20 5 FIBDMO Cc1ccc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)cc1[N+](=O)[O-] ZINC000500758682 1092518613 /nfs/dbraw/zinc/51/86/13/1092518613.db2.gz MJTKNKRTPUJQOG-OAHLLOKOSA-N 1 1 367.449 4.387 20 5 FIBDMO Cc1ccccc1C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000521187184 1092565583 /nfs/dbraw/zinc/56/55/83/1092565583.db2.gz AAMXZHYXUDGJSW-UHFFFAOYSA-N 1 1 364.405 4.118 20 5 FIBDMO Cc1ccccc1C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000521187184 1092565587 /nfs/dbraw/zinc/56/55/87/1092565587.db2.gz AAMXZHYXUDGJSW-UHFFFAOYSA-N 1 1 364.405 4.118 20 5 FIBDMO C[N@@H+](CCc1cccc(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1)C1CC1 ZINC000573741118 1092967100 /nfs/dbraw/zinc/96/71/00/1092967100.db2.gz DWZCJOOKXYNWCF-HXUWFJFHSA-N 1 1 351.450 4.331 20 5 FIBDMO C[N@@H+]1CCC[C@H](CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000522013415 1093028058 /nfs/dbraw/zinc/02/80/58/1093028058.db2.gz GPWFEEFNVUBUOT-WIBUTAKZSA-N 1 1 371.506 4.316 20 5 FIBDMO C[N@H+]1CCC[C@H](CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000522013415 1093028075 /nfs/dbraw/zinc/02/80/75/1093028075.db2.gz GPWFEEFNVUBUOT-WIBUTAKZSA-N 1 1 371.506 4.316 20 5 FIBDMO CCc1ccc([C@@H]2CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000433057246 1093174527 /nfs/dbraw/zinc/17/45/27/1093174527.db2.gz KPBWRVNBHJZJQG-MRXNPFEDSA-N 1 1 351.406 4.288 20 5 FIBDMO Cc1ccc2[nH]c(C[NH2+][C@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000433288418 1093545565 /nfs/dbraw/zinc/54/55/65/1093545565.db2.gz NRGYKALADJDFLM-SFHVURJKSA-N 1 1 350.422 4.292 20 5 FIBDMO Cc1ccc2nc(C[NH2+][C@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)[nH]c2c1 ZINC000433288418 1093545569 /nfs/dbraw/zinc/54/55/69/1093545569.db2.gz NRGYKALADJDFLM-SFHVURJKSA-N 1 1 350.422 4.292 20 5 FIBDMO Cc1ccnc(NCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000522417891 1093552767 /nfs/dbraw/zinc/55/27/67/1093552767.db2.gz VOSSASXPXMRXDM-INIZCTEOSA-N 1 1 354.454 4.285 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](c4cccc(Cl)c4)C3)nc2c1 ZINC000433318954 1093579835 /nfs/dbraw/zinc/57/98/35/1093579835.db2.gz PNXXPGIKNMHXMF-ZDUSSCGKSA-N 1 1 356.813 4.114 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](c4cccc(Cl)c4)C3)nc2c1 ZINC000433318954 1093579841 /nfs/dbraw/zinc/57/98/41/1093579841.db2.gz PNXXPGIKNMHXMF-ZDUSSCGKSA-N 1 1 356.813 4.114 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[C@H]1C(C)(C)C ZINC000419325688 1093635575 /nfs/dbraw/zinc/63/55/75/1093635575.db2.gz LIYIVCCLLKWOPN-CVEARBPZSA-N 1 1 358.442 4.291 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](c4c(F)cccc4F)C3)nc2c1 ZINC000185326163 1093702561 /nfs/dbraw/zinc/70/25/61/1093702561.db2.gz HTXFDTPAJXNRQJ-NSHDSACASA-N 1 1 359.332 4.004 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](c4c(F)cccc4F)C3)nc2c1 ZINC000185326163 1093702569 /nfs/dbraw/zinc/70/25/69/1093702569.db2.gz HTXFDTPAJXNRQJ-NSHDSACASA-N 1 1 359.332 4.004 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](n3cccn3)C2)s1 ZINC000513123133 1093861606 /nfs/dbraw/zinc/86/16/06/1093861606.db2.gz RVRFOMBACXTDCO-HNNXBMFYSA-N 1 1 368.462 4.357 20 5 FIBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2c2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000513129231 1093868207 /nfs/dbraw/zinc/86/82/07/1093868207.db2.gz WNSCAYJXYICMPV-KRWDZBQOSA-N 1 1 354.406 4.012 20 5 FIBDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000513129231 1093868212 /nfs/dbraw/zinc/86/82/12/1093868212.db2.gz WNSCAYJXYICMPV-KRWDZBQOSA-N 1 1 354.406 4.012 20 5 FIBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000473512384 1093905713 /nfs/dbraw/zinc/90/57/13/1093905713.db2.gz HSSHTZPEROQQEL-DLBZAZTESA-N 1 1 368.481 4.234 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000513256909 1094040136 /nfs/dbraw/zinc/04/01/36/1094040136.db2.gz OKOGUIDEMRCSBI-KDOFPFPSSA-N 1 1 364.405 4.228 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2ccc(C)s2)c([N+](=O)[O-])cc1OC ZINC000513485272 1094165274 /nfs/dbraw/zinc/16/52/74/1094165274.db2.gz PHVJAEIQYGNRBS-AWEZNQCLSA-N 1 1 362.451 4.319 20 5 FIBDMO CCC[C@H]([NH2+][C@@H]1CCCn2nc(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000167982425 1094284273 /nfs/dbraw/zinc/28/42/73/1094284273.db2.gz TXASDSIJLJFBFU-DLBZAZTESA-N 1 1 357.458 4.276 20 5 FIBDMO O=C(CC[N@H+]1CCC[C@@H]1/C=C/c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000500989011 1094403293 /nfs/dbraw/zinc/40/32/93/1094403293.db2.gz JVSCMJRPDACMND-QFQMRYFISA-N 1 1 365.433 4.101 20 5 FIBDMO O=C(CC[N@@H+](Cc1ccc(Cl)cc1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000501111702 1094513281 /nfs/dbraw/zinc/51/32/81/1094513281.db2.gz NFTNEXUQOSURTA-UHFFFAOYSA-N 1 1 373.840 4.241 20 5 FIBDMO Cc1ccc([C@@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)c(C)c1 ZINC000501844210 1094958793 /nfs/dbraw/zinc/95/87/93/1094958793.db2.gz RWVULVBHQUSCSP-QGZVFWFLSA-N 1 1 367.449 4.030 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](C2CCCC2)C1 ZINC000420959454 1095200614 /nfs/dbraw/zinc/20/06/14/1095200614.db2.gz DZJFBIIEDPQCMH-CZUORRHYSA-N 1 1 356.426 4.218 20 5 FIBDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccsc1 ZINC000421009250 1095222708 /nfs/dbraw/zinc/22/27/08/1095222708.db2.gz MXRYKBNAVGGPBM-CQSZACIVSA-N 1 1 361.467 4.457 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000502342895 1095377982 /nfs/dbraw/zinc/37/79/82/1095377982.db2.gz DGKBNSLFCIGBPF-MOTZXUDYSA-N 1 1 366.465 4.020 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccncc2OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000281770279 1095697180 /nfs/dbraw/zinc/69/71/80/1095697180.db2.gz WUOIXDMXVLMJKH-GFCCVEGCSA-N 1 1 369.343 4.090 20 5 FIBDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000522849844 1095781207 /nfs/dbraw/zinc/78/12/07/1095781207.db2.gz ZTWPCHDYUDWWBM-AWEZNQCLSA-N 1 1 368.865 4.024 20 5 FIBDMO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000502890452 1095925013 /nfs/dbraw/zinc/92/50/13/1095925013.db2.gz AFILSRPVJOBGCX-CQSZACIVSA-N 1 1 361.467 4.286 20 5 FIBDMO COc1cc(C[NH2+][C@]2(c3ccc(Cl)cc3)C[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000503369930 1096369718 /nfs/dbraw/zinc/36/97/18/1096369718.db2.gz GNIKPXMWONVGKU-BBATYDOGSA-N 1 1 364.804 4.421 20 5 FIBDMO COc1ccc(C[NH2+]Cc2ccc(Oc3ccccc3)o2)cc1[N+](=O)[O-] ZINC000503569701 1096478458 /nfs/dbraw/zinc/47/84/58/1096478458.db2.gz WDDHYJRHVPPFDD-UHFFFAOYSA-N 1 1 354.362 4.279 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+](CC3CC3)C3CCCCC3)n2)cc1 ZINC000532955634 1098641445 /nfs/dbraw/zinc/64/14/45/1098641445.db2.gz STIMEFPNFDKHBC-UHFFFAOYSA-N 1 1 356.426 4.190 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532977191 1098647196 /nfs/dbraw/zinc/64/71/96/1098647196.db2.gz TZIIQEASTHKTPE-UKRRQHHQSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532977191 1098647205 /nfs/dbraw/zinc/64/72/05/1098647205.db2.gz TZIIQEASTHKTPE-UKRRQHHQSA-N 1 1 373.840 4.065 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000532978555 1098648934 /nfs/dbraw/zinc/64/89/34/1098648934.db2.gz VQDBAYMHZONZSK-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000533148526 1098820849 /nfs/dbraw/zinc/82/08/49/1098820849.db2.gz QVDWZCOLBLPTRB-UHFFFAOYSA-N 1 1 355.438 4.103 20 5 FIBDMO COc1ccc(-c2ccc(C[NH2+]Cc3cc(F)ccc3F)o2)c([N+](=O)[O-])c1 ZINC000237431368 1099508266 /nfs/dbraw/zinc/50/82/66/1099508266.db2.gz MTLUHYGVHGCVFA-UHFFFAOYSA-N 1 1 374.343 4.431 20 5 FIBDMO Cc1ccc(CN2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)cc1[N+](=O)[O-] ZINC000516815282 1099824602 /nfs/dbraw/zinc/82/46/02/1099824602.db2.gz MLUQKWWPAZJJQT-JOCHJYFZSA-N 1 1 365.477 4.001 20 5 FIBDMO C[C@@H]1CN(C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000516814878 1099824777 /nfs/dbraw/zinc/82/47/77/1099824777.db2.gz JAVIPOMJYVCKRC-KDOFPFPSSA-N 1 1 359.495 4.095 20 5 FIBDMO C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000536667727 1100126410 /nfs/dbraw/zinc/12/64/10/1100126410.db2.gz OJWHBZHYXGCNNB-STQMWFEESA-N 1 1 364.829 4.244 20 5 FIBDMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3c(Cl)oc4ccccc43)C2)nc1 ZINC000536682495 1100149589 /nfs/dbraw/zinc/14/95/89/1100149589.db2.gz RXZQAOAGNHXCQT-GFCCVEGCSA-N 1 1 372.812 4.076 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000536848564 1100360513 /nfs/dbraw/zinc/36/05/13/1100360513.db2.gz YOOSFXWGMHWYRL-XHDPSFHLSA-N 1 1 362.813 4.431 20 5 FIBDMO CC(=O)c1cc(NC[C@H](c2ccco2)[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000517594555 1100520017 /nfs/dbraw/zinc/52/00/17/1100520017.db2.gz CMGGAGALDHLHPG-GOSISDBHSA-N 1 1 357.410 4.030 20 5 FIBDMO CC(=O)c1cc(NC[C@H](C2CC2)[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000517767309 1100649502 /nfs/dbraw/zinc/64/95/02/1100649502.db2.gz TZMMSPWXMOPRCF-OAQYLSRUSA-N 1 1 367.449 4.120 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000439312461 1101326178 /nfs/dbraw/zinc/32/61/78/1101326178.db2.gz FDJUYLGLSILTPI-SJLPKXTDSA-N 1 1 367.449 4.110 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000439316096 1101329769 /nfs/dbraw/zinc/32/97/69/1101329769.db2.gz JDLMFIYTPAWNAH-GOEBONIOSA-N 1 1 350.422 4.239 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000439316096 1101329786 /nfs/dbraw/zinc/32/97/86/1101329786.db2.gz JDLMFIYTPAWNAH-GOEBONIOSA-N 1 1 350.422 4.239 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCSCC2)ccc1Oc1ccc(F)cc1 ZINC000508640397 1101625824 /nfs/dbraw/zinc/62/58/24/1101625824.db2.gz PANHZGCDSPHJTJ-UHFFFAOYSA-N 1 1 362.426 4.465 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000519033473 1101851940 /nfs/dbraw/zinc/85/19/40/1101851940.db2.gz OOTVNNJZONQBNN-UHFFFAOYSA-N 1 1 370.840 4.313 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+](C)[C@@H](C)c3ccccn3)o2)c([N+](=O)[O-])c1 ZINC000508648752 1102028388 /nfs/dbraw/zinc/02/83/88/1102028388.db2.gz OBBVQANQFWYABU-AWEZNQCLSA-N 1 1 367.405 4.451 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)[C@@H](C)c3ccccn3)o2)c([N+](=O)[O-])c1 ZINC000508648752 1102028401 /nfs/dbraw/zinc/02/84/01/1102028401.db2.gz OBBVQANQFWYABU-AWEZNQCLSA-N 1 1 367.405 4.451 20 5 FIBDMO C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C[N@H+]1Cc1ccccc1 ZINC001168192118 1102256792 /nfs/dbraw/zinc/25/67/92/1102256792.db2.gz IDSBPNXSXASJIP-CVEARBPZSA-N 1 1 373.884 4.343 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1ccc(Cl)s1 ZINC000026250761 1102303104 /nfs/dbraw/zinc/30/31/04/1102303104.db2.gz DCAFEVOKCHUBNT-UHFFFAOYSA-N 1 1 367.858 4.079 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000532450941 1102341160 /nfs/dbraw/zinc/34/11/60/1102341160.db2.gz PRBNFOVHTHQRCZ-SFHVURJKSA-N 1 1 367.493 4.261 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])ccc2OC(C)C)n1 ZINC000532538365 1102453074 /nfs/dbraw/zinc/45/30/74/1102453074.db2.gz TYVZPZARVZDHDG-IBGZPJMESA-N 1 1 355.438 4.423 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc([N+](=O)[O-])ccc2OC(C)C)n1 ZINC000532538365 1102453083 /nfs/dbraw/zinc/45/30/83/1102453083.db2.gz TYVZPZARVZDHDG-IBGZPJMESA-N 1 1 355.438 4.423 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](c3nc4c(s3)CCCC4)C2)c1 ZINC000532638031 1102627163 /nfs/dbraw/zinc/62/71/63/1102627163.db2.gz WNRDBFYDBIWSQW-OAHLLOKOSA-N 1 1 357.479 4.310 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nc4c(s3)CCCC4)C2)cc1 ZINC000532637963 1102641066 /nfs/dbraw/zinc/64/10/66/1102641066.db2.gz MPKKSBRSUJZIMQ-OAHLLOKOSA-N 1 1 357.479 4.310 20 5 FIBDMO CC(C)[N@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000507152407 1103171431 /nfs/dbraw/zinc/17/14/31/1103171431.db2.gz TUKDKTHGTROAOD-UHFFFAOYSA-N 1 1 350.422 4.191 20 5 FIBDMO CC(C)[N@@H+](Cc1cnn(-c2ccccc2)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000507152407 1103171436 /nfs/dbraw/zinc/17/14/36/1103171436.db2.gz TUKDKTHGTROAOD-UHFFFAOYSA-N 1 1 350.422 4.191 20 5 FIBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@H](OCC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000536638811 1103177009 /nfs/dbraw/zinc/17/70/09/1103177009.db2.gz JVWCHDZGVPWWAG-AWEZNQCLSA-N 1 1 360.376 4.262 20 5 FIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H](OCC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000536638811 1103177013 /nfs/dbraw/zinc/17/70/13/1103177013.db2.gz JVWCHDZGVPWWAG-AWEZNQCLSA-N 1 1 360.376 4.262 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1 ZINC000507201539 1103199985 /nfs/dbraw/zinc/19/99/85/1103199985.db2.gz GPDYNMKWCCTLRB-HNNXBMFYSA-N 1 1 356.422 4.271 20 5 FIBDMO COc1cccc(OC(F)(F)F)c1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000507263681 1103260068 /nfs/dbraw/zinc/26/00/68/1103260068.db2.gz CFTWVWWBMJKUCH-LLVKDONJSA-N 1 1 370.327 4.353 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1csc([N+](=O)[O-])c1 ZINC000507616221 1103551105 /nfs/dbraw/zinc/55/11/05/1103551105.db2.gz KIXOZYBMQJMEFH-UHFFFAOYSA-N 1 1 356.451 4.111 20 5 FIBDMO COc1ccc(C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H](C)C2CC2)cc1 ZINC000507711516 1103650253 /nfs/dbraw/zinc/65/02/53/1103650253.db2.gz ZDGIHOAVURZMCI-MRXNPFEDSA-N 1 1 370.449 4.283 20 5 FIBDMO CC[N@@H+](CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1)CC1CC1 ZINC000537846710 1103967591 /nfs/dbraw/zinc/96/75/91/1103967591.db2.gz NGBGHTYIBTXFTK-UHFFFAOYSA-N 1 1 363.477 4.068 20 5 FIBDMO CC[N@H+](CCC1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1)CC1CC1 ZINC000537846710 1103967599 /nfs/dbraw/zinc/96/75/99/1103967599.db2.gz NGBGHTYIBTXFTK-UHFFFAOYSA-N 1 1 363.477 4.068 20 5 FIBDMO CC[N@@H+](CCC1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1)CC1CC1 ZINC000537846710 1103967601 /nfs/dbraw/zinc/96/76/01/1103967601.db2.gz NGBGHTYIBTXFTK-UHFFFAOYSA-N 1 1 363.477 4.068 20 5 FIBDMO COCc1nc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c(-c2ccccc2)s1 ZINC000441359949 1104298323 /nfs/dbraw/zinc/29/83/23/1104298323.db2.gz RXXQHUKPUVRCGR-UHFFFAOYSA-N 1 1 369.446 4.155 20 5 FIBDMO Cc1ccccc1[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441456370 1104759282 /nfs/dbraw/zinc/75/92/82/1104759282.db2.gz ZJXZGVRMWWDCBT-DYESRHJHSA-N 1 1 370.449 4.134 20 5 FIBDMO Cc1ccccc1[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441456370 1104759285 /nfs/dbraw/zinc/75/92/85/1104759285.db2.gz ZJXZGVRMWWDCBT-DYESRHJHSA-N 1 1 370.449 4.134 20 5 FIBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]2CCCC[C@@H]21 ZINC000543906032 1104791043 /nfs/dbraw/zinc/79/10/43/1104791043.db2.gz QRAAUPGEECQNQG-ZTFGCOKTSA-N 1 1 355.438 4.303 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H](Cc4ccccc4)C3)co2)cc1 ZINC000536365419 1104819855 /nfs/dbraw/zinc/81/98/55/1104819855.db2.gz JVJPJGLTQTVYMV-KRWDZBQOSA-N 1 1 363.417 4.314 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2ccc(OC(F)(F)F)cc2)CC1 ZINC000451145326 1106945526 /nfs/dbraw/zinc/94/55/26/1106945526.db2.gz JHLJDUUEBLMGGW-UHFFFAOYSA-N 1 1 352.312 4.272 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c1 ZINC000451358073 1107051931 /nfs/dbraw/zinc/05/19/31/1107051931.db2.gz ZQLCWKXOLAVBEB-USXIJHARSA-N 1 1 372.387 4.129 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(c4ccccc4F)CC3)nc2c1 ZINC000530962935 1107427076 /nfs/dbraw/zinc/42/70/76/1107427076.db2.gz CCKRUXWZHKHYQD-UHFFFAOYSA-N 1 1 355.369 4.255 20 5 FIBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1C ZINC000452047692 1107443923 /nfs/dbraw/zinc/44/39/23/1107443923.db2.gz ZJAZHVXZVJGCFA-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1C ZINC000452047692 1107443928 /nfs/dbraw/zinc/44/39/28/1107443928.db2.gz ZJAZHVXZVJGCFA-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccccc1C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000444624960 1108034177 /nfs/dbraw/zinc/03/41/77/1108034177.db2.gz GSEKYNILMSEZFT-UHFFFAOYSA-N 1 1 350.422 4.159 20 5 FIBDMO CC1(c2ccccc2)CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000444664051 1108066634 /nfs/dbraw/zinc/06/66/34/1108066634.db2.gz MNJJAKLKCZDGSN-UHFFFAOYSA-N 1 1 350.422 4.025 20 5 FIBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(C(F)(F)F)cc1 ZINC000444681262 1108083638 /nfs/dbraw/zinc/08/36/38/1108083638.db2.gz TVAAMPZNHVDVFT-JTQLQIEISA-N 1 1 364.327 4.341 20 5 FIBDMO CC[C@@H]1CCCCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000523554260 1108317772 /nfs/dbraw/zinc/31/77/72/1108317772.db2.gz IFDQCWAKWSZNQQ-CYBMUJFWSA-N 1 1 358.385 4.359 20 5 FIBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)C1=CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000453407323 1108507802 /nfs/dbraw/zinc/50/78/02/1108507802.db2.gz UUMOCBHKGSAEKA-GOSISDBHSA-N 1 1 354.454 4.144 20 5 FIBDMO Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)o1 ZINC000524752947 1109138677 /nfs/dbraw/zinc/13/86/77/1109138677.db2.gz MEELWDUPZIFESX-SCLBCKFNSA-N 1 1 372.421 4.336 20 5 FIBDMO Cc1ccc([C@H]2C[C@@H](C)CC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)o1 ZINC000524752947 1109138678 /nfs/dbraw/zinc/13/86/78/1109138678.db2.gz MEELWDUPZIFESX-SCLBCKFNSA-N 1 1 372.421 4.336 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc(-c4ccccc4)cc3)nc2c1 ZINC000446837044 1109356602 /nfs/dbraw/zinc/35/66/02/1109356602.db2.gz UWIRLWGXYDYTTK-UHFFFAOYSA-N 1 1 358.401 4.428 20 5 FIBDMO CCOc1ccccc1OCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000441195635 1109440475 /nfs/dbraw/zinc/44/04/75/1109440475.db2.gz AWEUISDBPZCHTB-UHFFFAOYSA-N 1 1 358.438 4.283 20 5 FIBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000441220672 1109469344 /nfs/dbraw/zinc/46/93/44/1109469344.db2.gz CZEIZDJYLKYAIH-AWEZNQCLSA-N 1 1 362.401 4.204 20 5 FIBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000441215910 1109473698 /nfs/dbraw/zinc/47/36/98/1109473698.db2.gz BHSDGVCSDCIHFF-CYBMUJFWSA-N 1 1 364.829 4.329 20 5 FIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525783992 1109517710 /nfs/dbraw/zinc/51/77/10/1109517710.db2.gz HSDUORZRHYVBEV-ORAYPTAESA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525783992 1109517713 /nfs/dbraw/zinc/51/77/13/1109517713.db2.gz HSDUORZRHYVBEV-ORAYPTAESA-N 1 1 372.396 4.184 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H](NC1CC[NH+](Cc3ccccc3)CC1)CCC2 ZINC000447522381 1109559939 /nfs/dbraw/zinc/55/99/39/1109559939.db2.gz YLGDQJUSHTXOND-JOCHJYFZSA-N 1 1 365.477 4.226 20 5 FIBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])Nc1cccc([C@H](C)[NH+]2CCOCC2)c1 ZINC000449053672 1109969495 /nfs/dbraw/zinc/96/94/95/1109969495.db2.gz LLVBZYZKPMVNPS-SJORKVTESA-N 1 1 369.465 4.031 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1nc(C2CCCCC2)no1 ZINC000449277193 1110013715 /nfs/dbraw/zinc/01/37/15/1110013715.db2.gz FFRMGEAUYOLWAE-UONOGXRCSA-N 1 1 358.442 4.307 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3cnc([C@@H]4CCCO4)s3)C2)cc1 ZINC000449495736 1110092683 /nfs/dbraw/zinc/09/26/83/1110092683.db2.gz DWPQQYQWCAGIOY-QAPCUYQASA-N 1 1 373.478 4.282 20 5 FIBDMO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2nccn21 ZINC000449572347 1110114194 /nfs/dbraw/zinc/11/41/94/1110114194.db2.gz NAJHEMJSHAVGSM-LRDDRELGSA-N 1 1 354.435 4.315 20 5 FIBDMO CC[N@H+]1CC[C@H](N(C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000538718098 1111260500 /nfs/dbraw/zinc/26/05/00/1111260500.db2.gz URSZNHBZTXIYMM-YOEHRIQHSA-N 1 1 374.510 4.023 20 5 FIBDMO COc1cc(C[N@H+]2C[C@H](c3ccc(F)cc3)C[C@H]2C)c([N+](=O)[O-])cc1OC ZINC000538721072 1111262342 /nfs/dbraw/zinc/26/23/42/1111262342.db2.gz MIMIUDILAJAACG-UKRRQHHQSA-N 1 1 374.412 4.129 20 5 FIBDMO C[C@H]1OCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@@H]1C ZINC000538726313 1111276275 /nfs/dbraw/zinc/27/62/75/1111276275.db2.gz JVAMTAUTECJELC-VXGBXAGGSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@H]1OCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@@H]1C ZINC000538726313 1111276281 /nfs/dbraw/zinc/27/62/81/1111276281.db2.gz JVAMTAUTECJELC-VXGBXAGGSA-N 1 1 350.802 4.117 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](CC(C)C)c1ccccc1OC ZINC000539379771 1111544093 /nfs/dbraw/zinc/54/40/93/1111544093.db2.gz RLTKJWZXNKNERQ-GOSISDBHSA-N 1 1 358.438 4.489 20 5 FIBDMO Cc1nc2ccccc2nc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000138398934 1111663105 /nfs/dbraw/zinc/66/31/05/1111663105.db2.gz IRXZEFGARJSZDR-UHFFFAOYSA-N 1 1 350.422 4.257 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1Cl ZINC000478046149 1111663506 /nfs/dbraw/zinc/66/35/06/1111663506.db2.gz ILZCWRPYMKAUOM-UHFFFAOYSA-N 1 1 373.796 4.308 20 5 FIBDMO CCn1nc(C)c([N+](=O)[O-])c1Nc1ccc2c(c1)[nH+]c(C(C)(C)C)n2C ZINC000480094282 1112276446 /nfs/dbraw/zinc/27/64/46/1112276446.db2.gz LJSDWSYESLDXQC-UHFFFAOYSA-N 1 1 356.430 4.047 20 5 FIBDMO CC(C)c1ccccc1NC(=O)[C@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554848956 1112528709 /nfs/dbraw/zinc/52/87/09/1112528709.db2.gz ULGNQWNAVWOPCR-INIZCTEOSA-N 1 1 369.465 4.220 20 5 FIBDMO CC(C)c1ccccc1NC(=O)[C@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554848956 1112528711 /nfs/dbraw/zinc/52/87/11/1112528711.db2.gz ULGNQWNAVWOPCR-INIZCTEOSA-N 1 1 369.465 4.220 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2nc3cccc(Cl)c3n2C)cc1[N+](=O)[O-] ZINC000480695223 1112558329 /nfs/dbraw/zinc/55/83/29/1112558329.db2.gz QUVYRUUMMLVUAG-LBPRGKRZSA-N 1 1 358.829 4.294 20 5 FIBDMO COCC[C@@H]1CCCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000555427564 1112836592 /nfs/dbraw/zinc/83/65/92/1112836592.db2.gz BAPMVHONVHDKEC-ZDUSSCGKSA-N 1 1 360.376 4.252 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000482437312 1113254592 /nfs/dbraw/zinc/25/45/92/1113254592.db2.gz DESVTWVCGGTBNG-UYAOXDASSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000482437312 1113254596 /nfs/dbraw/zinc/25/45/96/1113254596.db2.gz DESVTWVCGGTBNG-UYAOXDASSA-N 1 1 367.493 4.118 20 5 FIBDMO COCC1=CC[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000482487743 1113275085 /nfs/dbraw/zinc/27/50/85/1113275085.db2.gz PGHVOSRRLKGCAM-UHFFFAOYSA-N 1 1 372.396 4.305 20 5 FIBDMO COCC1=CC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000482487743 1113275087 /nfs/dbraw/zinc/27/50/87/1113275087.db2.gz PGHVOSRRLKGCAM-UHFFFAOYSA-N 1 1 372.396 4.305 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](CSc4ccccc4)C3)nc2c1 ZINC000482699336 1113335268 /nfs/dbraw/zinc/33/52/68/1113335268.db2.gz TZQHIBZWOBPIJO-CQSZACIVSA-N 1 1 368.462 4.085 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](CSc4ccccc4)C3)nc2c1 ZINC000482699336 1113335271 /nfs/dbraw/zinc/33/52/71/1113335271.db2.gz TZQHIBZWOBPIJO-CQSZACIVSA-N 1 1 368.462 4.085 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483240513 1113469688 /nfs/dbraw/zinc/46/96/88/1113469688.db2.gz RIZCLZXBVFSEOJ-HIFRSBDPSA-N 1 1 358.442 4.464 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccnc(Oc2ccccc2F)c1 ZINC000486791922 1113646660 /nfs/dbraw/zinc/64/66/60/1113646660.db2.gz BDAUZAKFWRBPRI-UHFFFAOYSA-N 1 1 353.353 4.211 20 5 FIBDMO CCC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)c1nnc2ccccn21 ZINC000129193309 1113659389 /nfs/dbraw/zinc/65/93/89/1113659389.db2.gz XQWIANXTRREHSC-GOEBONIOSA-N 1 1 353.426 4.138 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000486924132 1113677604 /nfs/dbraw/zinc/67/76/04/1113677604.db2.gz CAWHIMVPSGIEGS-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO Cc1cc(F)ccc1C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000487964578 1113832689 /nfs/dbraw/zinc/83/26/89/1113832689.db2.gz UTTZCMOUWIIGMN-UHFFFAOYSA-N 1 1 369.396 4.372 20 5 FIBDMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC[N@H+](C2CCC2)C1 ZINC000488774508 1113992983 /nfs/dbraw/zinc/99/29/83/1113992983.db2.gz IDGVBYKJXADPTA-HNNXBMFYSA-N 1 1 361.486 4.083 20 5 FIBDMO COC[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490059074 1114211750 /nfs/dbraw/zinc/21/17/50/1114211750.db2.gz KNDSICSYIZOPRX-KRWDZBQOSA-N 1 1 364.829 4.076 20 5 FIBDMO COC[C@@H](c1ccc(Cl)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490059074 1114211752 /nfs/dbraw/zinc/21/17/52/1114211752.db2.gz KNDSICSYIZOPRX-KRWDZBQOSA-N 1 1 364.829 4.076 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@H]2c2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000490207730 1114232658 /nfs/dbraw/zinc/23/26/58/1114232658.db2.gz LVZYFKIEJQCZKQ-IBGZPJMESA-N 1 1 350.422 4.127 20 5 FIBDMO Cc1c(C[N@@H+]2CCC[C@H]2c2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000490207730 1114232662 /nfs/dbraw/zinc/23/26/62/1114232662.db2.gz LVZYFKIEJQCZKQ-IBGZPJMESA-N 1 1 350.422 4.127 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000164133204 1114436325 /nfs/dbraw/zinc/43/63/25/1114436325.db2.gz NCJWSDNTSASPOX-AYHJJNSGSA-N 1 1 355.413 4.341 20 5 FIBDMO C[N@@H+](CCc1ccccc1O)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000571444422 1114471393 /nfs/dbraw/zinc/47/13/93/1114471393.db2.gz LYNWPYUVCIYKOC-UHFFFAOYSA-N 1 1 352.390 4.235 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000055460367 1114474765 /nfs/dbraw/zinc/47/47/65/1114474765.db2.gz ZHVHXOJKQCNZCQ-CQSZACIVSA-N 1 1 371.412 4.361 20 5 FIBDMO Cc1ccc(-c2nnc([C@@H](C)[N@@H+](C)CCc3cccc([N+](=O)[O-])c3)o2)cc1 ZINC000571703739 1114492787 /nfs/dbraw/zinc/49/27/87/1114492787.db2.gz CUSMFRVNNYOOQJ-OAHLLOKOSA-N 1 1 366.421 4.189 20 5 FIBDMO CC[C@H]1c2ccsc2CC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000164798027 1114585169 /nfs/dbraw/zinc/58/51/69/1114585169.db2.gz ZLRZNQKDKJPUFP-KRWDZBQOSA-N 1 1 373.478 4.303 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000165629050 1114855576 /nfs/dbraw/zinc/85/55/76/1114855576.db2.gz MUCKQRZFVCFEDA-IBGZPJMESA-N 1 1 371.412 4.208 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1sccc1Br ZINC000573338538 1115096857 /nfs/dbraw/zinc/09/68/57/1115096857.db2.gz QGHHMJVZGPDPHY-GFCCVEGCSA-N 1 1 353.241 4.196 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+]C1(c2ccccc2Cl)CCC1 ZINC000593039206 1115281401 /nfs/dbraw/zinc/28/14/01/1115281401.db2.gz CAEKAGPACDRLSK-UHFFFAOYSA-N 1 1 373.840 4.164 20 5 FIBDMO COc1ccc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3Cl)CC2)nc1 ZINC000593041435 1115281850 /nfs/dbraw/zinc/28/18/50/1115281850.db2.gz OVCQLKZAQCGQBY-UHFFFAOYSA-N 1 1 361.829 4.031 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cccc(F)c2OC(F)F)cc1[N+](=O)[O-] ZINC000594941864 1115501332 /nfs/dbraw/zinc/50/13/32/1115501332.db2.gz VKWXYIFTYHQBTK-NSHDSACASA-N 1 1 354.328 4.495 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(OC2CCCC2)nc1 ZINC000595013710 1115504043 /nfs/dbraw/zinc/50/40/43/1115504043.db2.gz RMQDMLKSEBBNLN-CQSZACIVSA-N 1 1 371.437 4.171 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1sccc1Br ZINC000595014405 1115504298 /nfs/dbraw/zinc/50/42/98/1115504298.db2.gz PGAKQTOMYXEKEF-VIFPVBQESA-N 1 1 371.256 4.278 20 5 FIBDMO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000595007839 1115507993 /nfs/dbraw/zinc/50/79/93/1115507993.db2.gz PTGUEGFCHNDDRX-AWEZNQCLSA-N 1 1 374.437 4.252 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCOc2cc(F)ccc21 ZINC000595026736 1115510127 /nfs/dbraw/zinc/51/01/27/1115510127.db2.gz IGIVSDSXPABTLV-SJKOYZFVSA-N 1 1 360.385 4.307 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+](Cc1ccccc1)CC1CCOCC1 ZINC000595317044 1115524884 /nfs/dbraw/zinc/52/48/84/1115524884.db2.gz LVFGBXUTZJYWDY-UHFFFAOYSA-N 1 1 358.413 4.163 20 5 FIBDMO CCOc1ccccc1[C@H](CC)[NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593021321 1115539611 /nfs/dbraw/zinc/53/96/11/1115539611.db2.gz VGIVUWUUZYDUOO-KRWDZBQOSA-N 1 1 372.421 4.021 20 5 FIBDMO Cc1ccc2c(c1)C[N@H+]([C@@H](C)c1nnc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000595659252 1115555586 /nfs/dbraw/zinc/55/55/86/1115555586.db2.gz YZCFSEPHZCWFJL-AWEZNQCLSA-N 1 1 364.405 4.073 20 5 FIBDMO Cc1ccc2c(c1)C[N@@H+]([C@@H](C)c1nnc(-c3ccc([N+](=O)[O-])cc3)o1)CC2 ZINC000595659252 1115555588 /nfs/dbraw/zinc/55/55/88/1115555588.db2.gz YZCFSEPHZCWFJL-AWEZNQCLSA-N 1 1 364.405 4.073 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)cc1 ZINC000593122927 1115563035 /nfs/dbraw/zinc/56/30/35/1115563035.db2.gz BQYIJKMUCYIQFC-ACRUOGEOSA-N 1 1 352.434 4.132 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@@H]([C@@H]4CCCCO4)C3)co2)cc1 ZINC000595786907 1115563529 /nfs/dbraw/zinc/56/35/29/1115563529.db2.gz IXLWUKGFTZCFHL-APWZRJJASA-N 1 1 371.437 4.031 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3ccccc3-n3ccnc32)cc1[N+](=O)[O-] ZINC000596095899 1115572030 /nfs/dbraw/zinc/57/20/30/1115572030.db2.gz QVXJSSCTMDVPNZ-YJBOKZPZSA-N 1 1 362.433 4.427 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000597218259 1115648599 /nfs/dbraw/zinc/64/85/99/1115648599.db2.gz OHXFQNRJFDDQQS-ORUDLHBZSA-N 1 1 354.406 4.055 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000597218259 1115648600 /nfs/dbraw/zinc/64/86/00/1115648600.db2.gz OHXFQNRJFDDQQS-ORUDLHBZSA-N 1 1 354.406 4.055 20 5 FIBDMO CC[C@](C)([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(F)cc1 ZINC000602927492 1115732744 /nfs/dbraw/zinc/73/27/44/1115732744.db2.gz SUTCTOXLGWSCNB-IBGZPJMESA-N 1 1 370.384 4.199 20 5 FIBDMO Cc1nn(-c2cccc(C)c2)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000593629821 1115761028 /nfs/dbraw/zinc/76/10/28/1115761028.db2.gz QFWPVWMGRHRCIX-UHFFFAOYSA-N 1 1 364.449 4.422 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1cc(-c2ccccc2)n(C)n1 ZINC000599024998 1115778116 /nfs/dbraw/zinc/77/81/16/1115778116.db2.gz WDPPDISUHJVAFJ-HUUCEWRRSA-N 1 1 350.422 4.407 20 5 FIBDMO CCC(F)(F)C(C)(C)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000599082562 1115788041 /nfs/dbraw/zinc/78/80/41/1115788041.db2.gz ZNZVXBOMAAQQOH-OAHLLOKOSA-N 1 1 366.412 4.079 20 5 FIBDMO Cc1cccc2c1CC[N@@H+]([C@@H](C)c1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000170922598 1115803730 /nfs/dbraw/zinc/80/37/30/1115803730.db2.gz ZEYBCFQYEKDGQS-AWEZNQCLSA-N 1 1 364.405 4.073 20 5 FIBDMO Cc1cccc2c1CC[N@H+]([C@@H](C)c1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000170922598 1115803731 /nfs/dbraw/zinc/80/37/31/1115803731.db2.gz ZEYBCFQYEKDGQS-AWEZNQCLSA-N 1 1 364.405 4.073 20 5 FIBDMO Cc1c([C@H](C)[NH2+][C@H](Cc2ccccc2)c2nccn2C)cccc1[N+](=O)[O-] ZINC000593722281 1115804999 /nfs/dbraw/zinc/80/49/99/1115804999.db2.gz MVFKPKAMQOUXOX-QFBILLFUSA-N 1 1 364.449 4.271 20 5 FIBDMO Cc1c(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000603843214 1115820374 /nfs/dbraw/zinc/82/03/74/1115820374.db2.gz GFTGCUNRAUNKMX-SFHVURJKSA-N 1 1 354.406 4.012 20 5 FIBDMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000603846154 1115820809 /nfs/dbraw/zinc/82/08/09/1115820809.db2.gz WVZQKXPKLFNUIR-IBGZPJMESA-N 1 1 356.422 4.258 20 5 FIBDMO O=[N+]([O-])c1ncccc1NC[C@@H](c1c(F)cccc1Cl)[NH+]1CCCC1 ZINC000603851183 1115821669 /nfs/dbraw/zinc/82/16/69/1115821669.db2.gz RWWXAKLSWVGDAS-HNNXBMFYSA-N 1 1 364.808 4.031 20 5 FIBDMO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000603882089 1115825560 /nfs/dbraw/zinc/82/55/60/1115825560.db2.gz MHBHMCXWMORQGZ-CYBMUJFWSA-N 1 1 361.829 4.188 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000603882089 1115825563 /nfs/dbraw/zinc/82/55/63/1115825563.db2.gz MHBHMCXWMORQGZ-CYBMUJFWSA-N 1 1 361.829 4.188 20 5 FIBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1cccc(Cl)c1 ZINC000603882091 1115825723 /nfs/dbraw/zinc/82/57/23/1115825723.db2.gz NPCIVLVTCYGGCD-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1cccc(Cl)c1 ZINC000603882091 1115825727 /nfs/dbraw/zinc/82/57/27/1115825727.db2.gz NPCIVLVTCYGGCD-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576808 1115827902 /nfs/dbraw/zinc/82/79/02/1115827902.db2.gz USDZGCCHMGCOOF-BTYIYWSLSA-N 1 1 366.417 4.156 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576808 1115827904 /nfs/dbraw/zinc/82/79/04/1115827904.db2.gz USDZGCCHMGCOOF-BTYIYWSLSA-N 1 1 366.417 4.156 20 5 FIBDMO C[C@@H](c1ccc(F)c(F)c1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012522 1115840812 /nfs/dbraw/zinc/84/08/12/1115840812.db2.gz LNGOPYGOXLJEEY-ZDUSSCGKSA-N 1 1 350.365 4.335 20 5 FIBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(C)c1 ZINC000604080757 1115846922 /nfs/dbraw/zinc/84/69/22/1115846922.db2.gz CPDPKHGYKOQELF-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(C)c1 ZINC000604080757 1115846927 /nfs/dbraw/zinc/84/69/27/1115846927.db2.gz CPDPKHGYKOQELF-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1N1CCCC1 ZINC000604070681 1115847637 /nfs/dbraw/zinc/84/76/37/1115847637.db2.gz SCICKIYXYOLRIR-UHFFFAOYSA-N 1 1 369.465 4.096 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[NH+]2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 ZINC000604275955 1115861468 /nfs/dbraw/zinc/86/14/68/1115861468.db2.gz CVBHNHBTGNCXIH-RYUDHWBXSA-N 1 1 370.293 4.200 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1ccccc1F)C(C)C ZINC000604491883 1115867562 /nfs/dbraw/zinc/86/75/62/1115867562.db2.gz RGIOWCBTYNVQRE-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO CCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccccc1F ZINC000604493454 1115867620 /nfs/dbraw/zinc/86/76/20/1115867620.db2.gz ZMTGPZYZJPUGMJ-UHFFFAOYSA-N 1 1 373.428 4.283 20 5 FIBDMO Cc1ccc(C[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C(C)C)s1 ZINC000172897560 1116001680 /nfs/dbraw/zinc/00/16/80/1116001680.db2.gz MZEIRULSGNIHSB-UHFFFAOYSA-N 1 1 371.466 4.091 20 5 FIBDMO Cc1ccc(C[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C(C)C)s1 ZINC000172897560 1116001681 /nfs/dbraw/zinc/00/16/81/1116001681.db2.gz MZEIRULSGNIHSB-UHFFFAOYSA-N 1 1 371.466 4.091 20 5 FIBDMO CCN(Cc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000608788723 1116130187 /nfs/dbraw/zinc/13/01/87/1116130187.db2.gz QSCZSXQUDNSWHA-UWJYYQICSA-N 1 1 353.466 4.252 20 5 FIBDMO C[N@@H+](CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000608836606 1116131254 /nfs/dbraw/zinc/13/12/54/1116131254.db2.gz XVBKTZFFJSNZPB-UHFFFAOYSA-N 1 1 357.454 4.209 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@@H+]1CCC[C@@H](C)C1 ZINC000608836397 1116131313 /nfs/dbraw/zinc/13/13/13/1116131313.db2.gz WCGZRJZXIXSHGS-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@H+]1CCC[C@@H](C)C1 ZINC000608836397 1116131315 /nfs/dbraw/zinc/13/13/15/1116131315.db2.gz WCGZRJZXIXSHGS-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1ccccc1OCC[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534076665 1116156382 /nfs/dbraw/zinc/15/63/82/1116156382.db2.gz JSMHBDOYVNNXQD-UHFFFAOYSA-N 1 1 367.405 4.069 20 5 FIBDMO Cc1ccccc1OCC[N@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000534076665 1116156383 /nfs/dbraw/zinc/15/63/83/1116156383.db2.gz JSMHBDOYVNNXQD-UHFFFAOYSA-N 1 1 367.405 4.069 20 5 FIBDMO CC(C)c1ccc([C@H]2CCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1 ZINC000535383162 1116301431 /nfs/dbraw/zinc/30/14/31/1116301431.db2.gz ONPZJMUMHWAYJA-LJQANCHMSA-N 1 1 367.449 4.154 20 5 FIBDMO Cc1cccc(C[NH2+]Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)n1 ZINC000539427681 1116335621 /nfs/dbraw/zinc/33/56/21/1116335621.db2.gz ANTOJZVYDZJRKU-UHFFFAOYSA-N 1 1 362.433 4.356 20 5 FIBDMO CCO[C@H]1C[C@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C12CCC2 ZINC000089909910 1116351934 /nfs/dbraw/zinc/35/19/34/1116351934.db2.gz NFJULJVCPGNJHT-ROUUACIJSA-N 1 1 371.437 4.029 20 5 FIBDMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000539928287 1117752692 /nfs/dbraw/zinc/75/26/92/1117752692.db2.gz WSIZUKLVOWMWAX-BJIFSAINSA-N 1 1 360.454 4.052 20 5 FIBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000462786796 1117771105 /nfs/dbraw/zinc/77/11/05/1117771105.db2.gz BYEPRGVSFGYGNQ-ZDUSSCGKSA-N 1 1 357.401 4.120 20 5 FIBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@H]1CCOC1 ZINC000463031560 1117936978 /nfs/dbraw/zinc/93/69/78/1117936978.db2.gz VWMAPDJCNZRRNJ-ZDUSSCGKSA-N 1 1 350.802 4.119 20 5 FIBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)Cc3ccccc3[N+](=O)[O-])c2C1 ZINC000076171328 1118135167 /nfs/dbraw/zinc/13/51/67/1118135167.db2.gz ARFHFOZFSKIAJI-UHFFFAOYSA-N 1 1 367.449 4.138 20 5 FIBDMO CC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000463482452 1118178250 /nfs/dbraw/zinc/17/82/50/1118178250.db2.gz BWPQZQTWQBHOSX-ZDUSSCGKSA-N 1 1 362.401 4.334 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000463482452 1118178255 /nfs/dbraw/zinc/17/82/55/1118178255.db2.gz BWPQZQTWQBHOSX-ZDUSSCGKSA-N 1 1 362.401 4.334 20 5 FIBDMO CC(C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000491300936 1118274425 /nfs/dbraw/zinc/27/44/25/1118274425.db2.gz PNUNWPAFLGFGTQ-UHFFFAOYSA-N 1 1 353.850 4.230 20 5 FIBDMO Cc1cc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2cccnc2)ccc1F ZINC000541545688 1118550375 /nfs/dbraw/zinc/55/03/75/1118550375.db2.gz JDFIPGNEZXPKHR-FQEVSTJZSA-N 1 1 351.381 4.317 20 5 FIBDMO CCc1ccc([C@@H]([NH2+][C@@H](C)Cc2cc(C)[nH]n2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541564643 1118556683 /nfs/dbraw/zinc/55/66/83/1118556683.db2.gz AONUZFYZJMJYFV-RBZFPXEDSA-N 1 1 368.437 4.092 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CCCc2cn(C3CCCC3)nc21 ZINC000541780742 1118640192 /nfs/dbraw/zinc/64/01/92/1118640192.db2.gz QLYBDOOAOXPWCE-IBGZPJMESA-N 1 1 354.454 4.382 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000464858896 1118726737 /nfs/dbraw/zinc/72/67/37/1118726737.db2.gz XEMYLJGEDXUHOU-RDTXWAMCSA-N 1 1 371.437 4.298 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)C[C@@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000464862010 1118727729 /nfs/dbraw/zinc/72/77/29/1118727729.db2.gz WGMHJGHFCSXNCJ-KBXCAEBGSA-N 1 1 371.437 4.298 20 5 FIBDMO COc1cccc([C@H]2C[C@H](C)C[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000542247182 1118866348 /nfs/dbraw/zinc/86/63/48/1118866348.db2.gz PMODCCAOWGTOHB-KBXCAEBGSA-N 1 1 356.422 4.195 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]C2(c3nc(C)cs3)CCC2)cc1[N+](=O)[O-] ZINC000271939388 1119003792 /nfs/dbraw/zinc/00/37/92/1119003792.db2.gz GWTJRWZHEAWVLL-CYBMUJFWSA-N 1 1 361.467 4.488 20 5 FIBDMO CCOc1cc(C[N@H+](Cc2ccccc2OC)C2CC2)ccc1[N+](=O)[O-] ZINC000492377469 1119078888 /nfs/dbraw/zinc/07/88/88/1119078888.db2.gz PVCXEBOFEHLSPJ-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CCOc1cc(C[N@@H+](Cc2ccccc2OC)C2CC2)ccc1[N+](=O)[O-] ZINC000492377469 1119078893 /nfs/dbraw/zinc/07/88/93/1119078893.db2.gz PVCXEBOFEHLSPJ-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CCOc1cc(C[N@@H+](C)[C@H]2CCCc3nc(C)sc32)ccc1[N+](=O)[O-] ZINC000492533204 1119119995 /nfs/dbraw/zinc/11/99/95/1119119995.db2.gz IXDFHWVYKOUIPH-INIZCTEOSA-N 1 1 361.467 4.268 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000492771372 1119190188 /nfs/dbraw/zinc/19/01/88/1119190188.db2.gz MCGFLPLYVNMHMC-LZQZEXGQSA-N 1 1 362.470 4.019 20 5 FIBDMO O=[N+]([O-])c1ccc(CNC[C@H](c2ccccc2)[NH+]2CCCC2)cc1Cl ZINC000761518111 1119407888 /nfs/dbraw/zinc/40/78/88/1119407888.db2.gz XMOFCVALGHJGRQ-LJQANCHMSA-N 1 1 359.857 4.175 20 5 FIBDMO C[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C[N@@H+]1Cc1ccccc1 ZINC000761526502 1119410060 /nfs/dbraw/zinc/41/00/60/1119410060.db2.gz FDENJPUGQSEMJT-WMLDXEAASA-N 1 1 359.857 4.001 20 5 FIBDMO C[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C[N@H+]1Cc1ccccc1 ZINC000761526502 1119410062 /nfs/dbraw/zinc/41/00/62/1119410062.db2.gz FDENJPUGQSEMJT-WMLDXEAASA-N 1 1 359.857 4.001 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000494293251 1119821439 /nfs/dbraw/zinc/82/14/39/1119821439.db2.gz NMISTDQWOVUAQA-GXDHUFHOSA-N 1 1 373.840 4.222 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000494293251 1119821442 /nfs/dbraw/zinc/82/14/42/1119821442.db2.gz NMISTDQWOVUAQA-GXDHUFHOSA-N 1 1 373.840 4.222 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]CC2([C@@H](O)C(C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542494064 1120065620 /nfs/dbraw/zinc/06/56/20/1120065620.db2.gz JQLGZMWTDKDPEI-PMACEKPBSA-N 1 1 372.465 4.226 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000494794872 1120250787 /nfs/dbraw/zinc/25/07/87/1120250787.db2.gz ZPTOJYLAUGHAMK-AWEZNQCLSA-N 1 1 356.813 4.045 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000494794872 1120250791 /nfs/dbraw/zinc/25/07/91/1120250791.db2.gz ZPTOJYLAUGHAMK-AWEZNQCLSA-N 1 1 356.813 4.045 20 5 FIBDMO Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000495412557 1120789152 /nfs/dbraw/zinc/78/91/52/1120789152.db2.gz BJAAFBUAEYKWDY-MNOVXSKESA-N 1 1 370.375 4.382 20 5 FIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000076776757 1121098423 /nfs/dbraw/zinc/09/84/23/1121098423.db2.gz KGZHZSYTVSPLBI-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000488058787 1121346568 /nfs/dbraw/zinc/34/65/68/1121346568.db2.gz QSUZJEKNJLVVGF-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2C[C@H](O)c2cccs2)ccc1Cl ZINC000154166677 1121841085 /nfs/dbraw/zinc/84/10/85/1121841085.db2.gz ICUQQEZKQYFWMB-BBRMVZONSA-N 1 1 366.870 4.398 20 5 FIBDMO C[C@@H]1C[C@H](N(C)c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000301452184 1121966031 /nfs/dbraw/zinc/96/60/31/1121966031.db2.gz XQNMYBPHNVFKEA-NXEZZACHSA-N 1 1 365.783 4.186 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(C4CCCCC4)CC3)o2)cc1 ZINC000917059542 1122040281 /nfs/dbraw/zinc/04/02/81/1122040281.db2.gz ITPHVKHVMNBIQZ-UHFFFAOYSA-N 1 1 370.453 4.437 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000301534467 1122207884 /nfs/dbraw/zinc/20/78/84/1122207884.db2.gz LHOBUQJYUJIELY-LBPRGKRZSA-N 1 1 367.365 4.170 20 5 FIBDMO C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000301544736 1122218551 /nfs/dbraw/zinc/21/85/51/1122218551.db2.gz OPADDSUAMSUSOR-HIFRSBDPSA-N 1 1 360.845 4.108 20 5 FIBDMO Cc1c([C@H](C)NCc2cccc(C[NH+]3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000123035041 1122243205 /nfs/dbraw/zinc/24/32/05/1122243205.db2.gz SMDPONDLHYCJMG-KRWDZBQOSA-N 1 1 353.466 4.350 20 5 FIBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000273411201 1122254525 /nfs/dbraw/zinc/25/45/25/1122254525.db2.gz IIGGXFAZOKPLHQ-YLJYHZDGSA-N 1 1 374.412 4.095 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1c1ccccc1OC ZINC000609280824 1122680145 /nfs/dbraw/zinc/68/01/45/1122680145.db2.gz QMSSZLAKYNPVFG-GOSISDBHSA-N 1 1 356.422 4.339 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1c1ccccc1OC ZINC000609280824 1122680148 /nfs/dbraw/zinc/68/01/48/1122680148.db2.gz QMSSZLAKYNPVFG-GOSISDBHSA-N 1 1 356.422 4.339 20 5 FIBDMO C[C@H](CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000556872375 1123155415 /nfs/dbraw/zinc/15/54/15/1123155415.db2.gz XJRHPMUGTNQSKG-UZLBHIALSA-N 1 1 364.449 4.201 20 5 FIBDMO COCCc1cc[nH+]c(N[C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000556914326 1123223429 /nfs/dbraw/zinc/22/34/29/1123223429.db2.gz ZRQDYBNYWASXAV-AEFFLSMTSA-N 1 1 355.438 4.002 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(CN2CCc3ccccc32)CC1 ZINC000609541521 1123747870 /nfs/dbraw/zinc/74/78/70/1123747870.db2.gz YXDWAXMRGSRBJZ-UHFFFAOYSA-N 1 1 369.440 4.009 20 5 FIBDMO O=[N+]([O-])c1sccc1N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000609625335 1123773027 /nfs/dbraw/zinc/77/30/27/1123773027.db2.gz IRNWDHCOYVGXJX-CYBMUJFWSA-N 1 1 371.384 4.362 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609705126 1123803134 /nfs/dbraw/zinc/80/31/34/1123803134.db2.gz SBHLMHHHMTWOKM-UHFFFAOYSA-N 1 1 353.894 4.192 20 5 FIBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])c3cnccc23)c1 ZINC000067903456 1123987412 /nfs/dbraw/zinc/98/74/12/1123987412.db2.gz HLDLYMWRHJTJCZ-UHFFFAOYSA-N 1 1 350.422 4.207 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000067962738 1124004513 /nfs/dbraw/zinc/00/45/13/1124004513.db2.gz LWTLYZBMTMSNFM-AWEZNQCLSA-N 1 1 367.405 4.281 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000067962738 1124004518 /nfs/dbraw/zinc/00/45/18/1124004518.db2.gz LWTLYZBMTMSNFM-AWEZNQCLSA-N 1 1 367.405 4.281 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(Oc2ccc(F)cc2)nc1 ZINC000237883060 1124152260 /nfs/dbraw/zinc/15/22/60/1124152260.db2.gz ALGWJDFQHLFRFV-UHFFFAOYSA-N 1 1 353.353 4.211 20 5 FIBDMO COC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000091414007 1124385457 /nfs/dbraw/zinc/38/54/57/1124385457.db2.gz UEONOKWEUNLJMW-SJKOYZFVSA-N 1 1 350.365 4.220 20 5 FIBDMO Cc1cc(NCc2ccccc2C[N@@H+](C)Cc2ccco2)ncc1[N+](=O)[O-] ZINC000080605816 1124722695 /nfs/dbraw/zinc/72/26/95/1124722695.db2.gz IHVBSEYAAUSDQX-UHFFFAOYSA-N 1 1 366.421 4.135 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+]2Cc2ccccc2)cc1C(F)(F)F ZINC000715721253 1125044961 /nfs/dbraw/zinc/04/49/61/1125044961.db2.gz KWWDCAAOVKCGTC-OAHLLOKOSA-N 1 1 365.355 4.300 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)c(Cl)c1 ZINC000542974432 1125084342 /nfs/dbraw/zinc/08/43/42/1125084342.db2.gz CMDAUIMLUXWFOF-LJQANCHMSA-N 1 1 360.841 4.021 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)[C@H](CO)C2CC2)c(Cl)c1 ZINC000542974432 1125084351 /nfs/dbraw/zinc/08/43/51/1125084351.db2.gz CMDAUIMLUXWFOF-LJQANCHMSA-N 1 1 360.841 4.021 20 5 FIBDMO C[C@H]1C[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301740802 1125190869 /nfs/dbraw/zinc/19/08/69/1125190869.db2.gz KQQNUODPIQCBJE-XJKSGUPXSA-N 1 1 360.845 4.108 20 5 FIBDMO C[C@@H]1C[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301740801 1125197665 /nfs/dbraw/zinc/19/76/65/1125197665.db2.gz KQQNUODPIQCBJE-CZUORRHYSA-N 1 1 360.845 4.108 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)c1ccncc1 ZINC000602561689 567991664 /nfs/dbraw/zinc/99/16/64/567991664.db2.gz ZHWQCWSCCYJNKU-GFCCVEGCSA-N 1 1 356.245 4.055 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000481687517 568088990 /nfs/dbraw/zinc/08/89/90/568088990.db2.gz AMKUDJPHFOFKBJ-LJQANCHMSA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(C2)OCc2ccccc23)c(Cl)c1 ZINC000481687517 568088991 /nfs/dbraw/zinc/08/89/91/568088991.db2.gz AMKUDJPHFOFKBJ-LJQANCHMSA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000568933743 568253579 /nfs/dbraw/zinc/25/35/79/568253579.db2.gz RJUIENSMWASPLR-ZBKGLNQESA-N 1 1 364.445 4.113 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000604434694 568292267 /nfs/dbraw/zinc/29/22/67/568292267.db2.gz NCYKKUVHVLHZDW-HXUWFJFHSA-N 1 1 367.449 4.241 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@@H]3CCCOC3)o2)c1 ZINC000517937068 568340282 /nfs/dbraw/zinc/34/02/82/568340282.db2.gz KZIVHBJKZWUOMY-VQIMIIECSA-N 1 1 356.422 4.246 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C)c1cccc([N+](=O)[O-])c1 ZINC000453080011 568390798 /nfs/dbraw/zinc/39/07/98/568390798.db2.gz YONLSXPMWVPLPZ-CABCVRRESA-N 1 1 350.422 4.407 20 5 FIBDMO C[C@]12CC[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@H]1C2(F)F ZINC000570531329 568484593 /nfs/dbraw/zinc/48/45/93/568484593.db2.gz ASJJANVZXJPFHS-OLZOCXBDSA-N 1 1 350.287 4.091 20 5 FIBDMO C[C@]12CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C[C@H]1C2(F)F ZINC000570531329 568484594 /nfs/dbraw/zinc/48/45/94/568484594.db2.gz ASJJANVZXJPFHS-OLZOCXBDSA-N 1 1 350.287 4.091 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000619722884 1125669468 /nfs/dbraw/zinc/66/94/68/1125669468.db2.gz PYWJBCZYFFEFIG-NVXWUHKLSA-N 1 1 354.454 4.068 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c(F)cccc1N1CCCC1 ZINC000559073128 1079932748 /nfs/dbraw/zinc/93/27/48/1079932748.db2.gz QYQDYNJAHXRLLB-UHFFFAOYSA-N 1 1 357.429 4.009 20 5 FIBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154124102 1079995435 /nfs/dbraw/zinc/99/54/35/1079995435.db2.gz BUJZSVZIJZLXHD-OIRASMEMSA-N 1 1 366.870 4.179 20 5 FIBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154124102 1079995440 /nfs/dbraw/zinc/99/54/40/1079995440.db2.gz BUJZSVZIJZLXHD-OIRASMEMSA-N 1 1 366.870 4.179 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1cccc(N(C)C)c1 ZINC000430218734 1080009430 /nfs/dbraw/zinc/00/94/30/1080009430.db2.gz KWCDFBBJDIMFQN-IBGZPJMESA-N 1 1 355.438 4.007 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Br)cc1F ZINC000126943594 1080035540 /nfs/dbraw/zinc/03/55/40/1080035540.db2.gz SSSINPIODQAUNB-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO Cc1cc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cc([N+](=O)[O-])c1 ZINC000157712360 1080116357 /nfs/dbraw/zinc/11/63/57/1080116357.db2.gz GMDBQCGGMBDYOW-QGZVFWFLSA-N 1 1 373.497 4.020 20 5 FIBDMO Cc1c(NC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000118792958 1080179682 /nfs/dbraw/zinc/17/96/82/1080179682.db2.gz BWZBKMLQGFNWQL-RDJZCZTQSA-N 1 1 374.485 4.022 20 5 FIBDMO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)on1 ZINC000509813219 1080277366 /nfs/dbraw/zinc/27/73/66/1080277366.db2.gz PPDFRCSUNWYXJX-KRWDZBQOSA-N 1 1 353.378 4.488 20 5 FIBDMO COc1ccc(C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)C2CC2)cc1 ZINC001167131171 1080660102 /nfs/dbraw/zinc/66/01/02/1080660102.db2.gz LLJDZDFWVAUTKL-INIZCTEOSA-N 1 1 354.450 4.447 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000610370764 1081554810 /nfs/dbraw/zinc/55/48/10/1081554810.db2.gz FNFAUHGFXBNSBL-YJYMSZOUSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000610370764 1081554817 /nfs/dbraw/zinc/55/48/17/1081554817.db2.gz FNFAUHGFXBNSBL-YJYMSZOUSA-N 1 1 372.396 4.184 20 5 FIBDMO COc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(Br)c1 ZINC000389229528 1081916207 /nfs/dbraw/zinc/91/62/07/1081916207.db2.gz XGIZZVZLEUNZLK-LLVKDONJSA-N 1 1 365.227 4.217 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000119122199 1081961957 /nfs/dbraw/zinc/96/19/57/1081961957.db2.gz AQJSAUYTIHENIY-AWEZNQCLSA-N 1 1 357.410 4.050 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)ccc1O ZINC000125979808 1082010627 /nfs/dbraw/zinc/01/06/27/1082010627.db2.gz CJWBNPGLSCONST-UHFFFAOYSA-N 1 1 368.389 4.201 20 5 FIBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000610476340 1082300408 /nfs/dbraw/zinc/30/04/08/1082300408.db2.gz OKXFMBDBWPSEGS-FXAWDEMLSA-N 1 1 358.413 4.334 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c(F)c1 ZINC000610481366 1082329457 /nfs/dbraw/zinc/32/94/57/1082329457.db2.gz VKQBYDFXSQEGOG-AWEZNQCLSA-N 1 1 355.369 4.255 20 5 FIBDMO CC[N@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000510468155 1082923763 /nfs/dbraw/zinc/92/37/63/1082923763.db2.gz XOFZCBBJELVZGH-CYBMUJFWSA-N 1 1 362.401 4.334 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 ZINC000510468155 1082923765 /nfs/dbraw/zinc/92/37/65/1082923765.db2.gz XOFZCBBJELVZGH-CYBMUJFWSA-N 1 1 362.401 4.334 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H]3CCc3ccccc3)nc2c1 ZINC000610581205 1083210232 /nfs/dbraw/zinc/21/02/32/1083210232.db2.gz NEZBEDLYAQGWMM-INIZCTEOSA-N 1 1 351.406 4.333 20 5 FIBDMO COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000612137842 1083433523 /nfs/dbraw/zinc/43/35/23/1083433523.db2.gz XQAMPDBIJMEVLT-FZKQIMNGSA-N 1 1 367.405 4.328 20 5 FIBDMO COc1cccc([C@H]2C[C@@H](C)C[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000612137842 1083433531 /nfs/dbraw/zinc/43/35/31/1083433531.db2.gz XQAMPDBIJMEVLT-FZKQIMNGSA-N 1 1 367.405 4.328 20 5 FIBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(C(F)(F)F)cc1 ZINC000065208725 1083892708 /nfs/dbraw/zinc/89/27/08/1083892708.db2.gz KEWXZKRPCUGECD-UHFFFAOYSA-N 1 1 354.328 4.124 20 5 FIBDMO C[C@@H](c1cccs1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000472440975 1083910628 /nfs/dbraw/zinc/91/06/28/1083910628.db2.gz SVKWOJKJJXQFDN-HNNXBMFYSA-N 1 1 356.451 4.116 20 5 FIBDMO Cn1nc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)c2ccccc21 ZINC000612692043 1083989551 /nfs/dbraw/zinc/98/95/51/1083989551.db2.gz IXVSBMYDYWRBLA-UHFFFAOYSA-N 1 1 362.389 4.031 20 5 FIBDMO Cn1cc(C[N@@H+]2CC=C(C(C)(C)C)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538796186 1084194392 /nfs/dbraw/zinc/19/43/92/1084194392.db2.gz TWYALXSTUMHFMZ-UHFFFAOYSA-N 1 1 354.454 4.174 20 5 FIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C[C@H]1CCCOC1 ZINC000119701647 1084358167 /nfs/dbraw/zinc/35/81/67/1084358167.db2.gz ZDLWJEFFFDHUNI-CYBMUJFWSA-N 1 1 364.829 4.367 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc2ccccc2n1C(F)F ZINC000511066119 1084569573 /nfs/dbraw/zinc/56/95/73/1084569573.db2.gz QIMHRRFBRQMMFZ-UHFFFAOYSA-N 1 1 360.364 4.014 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc2ccccc2n1C(F)F ZINC000511066119 1084569581 /nfs/dbraw/zinc/56/95/81/1084569581.db2.gz QIMHRRFBRQMMFZ-UHFFFAOYSA-N 1 1 360.364 4.014 20 5 FIBDMO C[NH+](C)C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000563249726 1084633186 /nfs/dbraw/zinc/63/31/86/1084633186.db2.gz KIPHOGYGOSUOCL-FZMUQLTDSA-N 1 1 359.857 4.154 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000551737503 1084706779 /nfs/dbraw/zinc/70/67/79/1084706779.db2.gz KCQVFWYXXQAPRD-CQSZACIVSA-N 1 1 361.392 4.146 20 5 FIBDMO CCn1ccc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)n1 ZINC000414210557 1084825109 /nfs/dbraw/zinc/82/51/09/1084825109.db2.gz OSZSQFMQCZWEMJ-ZDUSSCGKSA-N 1 1 356.451 4.391 20 5 FIBDMO CCn1ccc(C[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)n1 ZINC000414210554 1084825208 /nfs/dbraw/zinc/82/52/08/1084825208.db2.gz OSZSQFMQCZWEMJ-CYBMUJFWSA-N 1 1 356.451 4.391 20 5 FIBDMO C[C@@H](c1ccccc1)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000170906039 1084978280 /nfs/dbraw/zinc/97/82/80/1084978280.db2.gz RBHQEYPCJTUYKR-HNNXBMFYSA-N 1 1 351.406 4.485 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2[C@@H]3CC[C@@H](C3)[C@@]2(C)C1 ZINC000452044521 1085047131 /nfs/dbraw/zinc/04/71/31/1085047131.db2.gz JCAXLKYKWSTQGN-RCWVKNBDSA-N 1 1 368.437 4.074 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@]3(CCCc4ccccc43)C2)cc1 ZINC001167582040 1085104277 /nfs/dbraw/zinc/10/42/77/1085104277.db2.gz JIJWRYYYUQBDHB-QFIPXVFZSA-N 1 1 366.461 4.344 20 5 FIBDMO CC[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc(C)cc1 ZINC000181701945 1085207457 /nfs/dbraw/zinc/20/74/57/1085207457.db2.gz RELBFSGIKKWEOE-QGZVFWFLSA-N 1 1 352.394 4.194 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N(C)c2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000158618883 1085228539 /nfs/dbraw/zinc/22/85/39/1085228539.db2.gz ZIFMSKSSVNSTDX-UHFFFAOYSA-N 1 1 355.438 4.102 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@H](c4ccccc4)[C@H]4CCC[C@@H]43)nc2c1 ZINC000511878136 1085275653 /nfs/dbraw/zinc/27/56/53/1085275653.db2.gz WTBNMVWHEBAPLZ-HLIPFELVSA-N 1 1 362.433 4.239 20 5 FIBDMO CC[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[C@H]1c1ccccc1 ZINC001167601538 1085423612 /nfs/dbraw/zinc/42/36/12/1085423612.db2.gz DHHDGDUOQIJPIH-MAUKXSAKSA-N 1 1 364.449 4.487 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](OC(F)F)C2)o1 ZINC000611609463 1085513646 /nfs/dbraw/zinc/51/36/46/1085513646.db2.gz JFXLFNUHWIFFQQ-LBPRGKRZSA-N 1 1 352.337 4.058 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1c(C)noc1C ZINC000549544910 1085540194 /nfs/dbraw/zinc/54/01/94/1085540194.db2.gz QMRVGSQAFREQQL-CQSZACIVSA-N 1 1 357.332 4.459 20 5 FIBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000047959732 1085752188 /nfs/dbraw/zinc/75/21/88/1085752188.db2.gz PAZBEJZCPGQDFK-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000047959732 1085752192 /nfs/dbraw/zinc/75/21/92/1085752192.db2.gz PAZBEJZCPGQDFK-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO COC1CCC([N@@H+](C)Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000093414833 1085783775 /nfs/dbraw/zinc/78/37/75/1085783775.db2.gz JGDRJBAWFQNWDU-UHFFFAOYSA-N 1 1 361.467 4.108 20 5 FIBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000112699402 1085950690 /nfs/dbraw/zinc/95/06/90/1085950690.db2.gz NSCSLBWZQMISCZ-LJQANCHMSA-N 1 1 356.422 4.290 20 5 FIBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000112699401 1085950880 /nfs/dbraw/zinc/95/08/80/1085950880.db2.gz NSCSLBWZQMISCZ-IBGZPJMESA-N 1 1 356.422 4.290 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc(Cl)ccc1OC ZINC000178730303 1085968400 /nfs/dbraw/zinc/96/84/00/1085968400.db2.gz HLQKKJGNGNZQBL-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC001167799443 1086429903 /nfs/dbraw/zinc/42/99/03/1086429903.db2.gz ZNUXSCVFMIAPKH-SWLSCSKDSA-N 1 1 353.850 4.087 20 5 FIBDMO COc1ccc(C[N@H+]2CC[C@H](C)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000511972693 1086473299 /nfs/dbraw/zinc/47/32/99/1086473299.db2.gz OMUPHUAKTZCTJA-HNNXBMFYSA-N 1 1 356.422 4.024 20 5 FIBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C12CCC2 ZINC001167664834 1086520570 /nfs/dbraw/zinc/52/05/70/1086520570.db2.gz VGBRZRKQNCDONM-JKSUJKDBSA-N 1 1 372.387 4.393 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3SC)c2C1 ZINC001143528807 1086703775 /nfs/dbraw/zinc/70/37/75/1086703775.db2.gz VLBUFZRWTNPFDQ-UHFFFAOYSA-N 1 1 371.462 4.295 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3SC)c2C1 ZINC001143528807 1086703779 /nfs/dbraw/zinc/70/37/79/1086703779.db2.gz VLBUFZRWTNPFDQ-UHFFFAOYSA-N 1 1 371.462 4.295 20 5 FIBDMO COCCC[N@H+]1Cc2cccc(N[C@@H](C)c3ccccc3[N+](=O)[O-])c2C1 ZINC000080467630 1086775729 /nfs/dbraw/zinc/77/57/29/1086775729.db2.gz VRNHDWOZVFEMFN-HNNXBMFYSA-N 1 1 355.438 4.120 20 5 FIBDMO Cc1cc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cc([N+](=O)[O-])c1 ZINC000157712164 1086967570 /nfs/dbraw/zinc/96/75/70/1086967570.db2.gz GMDBQCGGMBDYOW-KRWDZBQOSA-N 1 1 373.497 4.020 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000472319487 1087295951 /nfs/dbraw/zinc/29/59/51/1087295951.db2.gz UWZFVVBRPQVOJE-RBZFPXEDSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]1c1cccc(F)c1 ZINC000472319487 1087295956 /nfs/dbraw/zinc/29/59/56/1087295956.db2.gz UWZFVVBRPQVOJE-RBZFPXEDSA-N 1 1 371.412 4.064 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402701 1088641241 /nfs/dbraw/zinc/64/12/41/1088641241.db2.gz UCZSZLWUZPEMMY-PKOBYXMFSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H](NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402701 1088641244 /nfs/dbraw/zinc/64/12/44/1088641244.db2.gz UCZSZLWUZPEMMY-PKOBYXMFSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H]([NH2+]C[C@H]1CCCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000311402701 1088641246 /nfs/dbraw/zinc/64/12/46/1088641246.db2.gz UCZSZLWUZPEMMY-PKOBYXMFSA-N 1 1 353.466 4.158 20 5 FIBDMO CCOC1(C)CC[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000430109134 1088998466 /nfs/dbraw/zinc/99/84/66/1088998466.db2.gz XAIKNDHKTZBUSS-UHFFFAOYSA-N 1 1 361.467 4.109 20 5 FIBDMO C[N@@H+](CCCCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435044929 1089232859 /nfs/dbraw/zinc/23/28/59/1089232859.db2.gz IBKJYRPSGNEVGX-UHFFFAOYSA-N 1 1 352.818 4.103 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](c4ccc(Cl)cc4)C3)nc2c1 ZINC000435049138 1089235011 /nfs/dbraw/zinc/23/50/11/1089235011.db2.gz LZACZPSOORULLL-ZDUSSCGKSA-N 1 1 357.797 4.379 20 5 FIBDMO COc1ccc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)cc1[N+](=O)[O-] ZINC000378133567 1090137313 /nfs/dbraw/zinc/13/73/13/1090137313.db2.gz ZBJCHJLATPPHHM-UHFFFAOYSA-N 1 1 373.409 4.156 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(Br)nc1)c1ccccc1[N+](=O)[O-] ZINC000290632934 1090141528 /nfs/dbraw/zinc/14/15/28/1090141528.db2.gz JBZOLODWMWZPMV-WDEREUQCSA-N 1 1 350.216 4.164 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCc3ccccc3F)CC2)c(F)c1 ZINC000091865964 1090858973 /nfs/dbraw/zinc/85/89/73/1090858973.db2.gz OWMINJPYFLGAFR-UHFFFAOYSA-N 1 1 362.376 4.054 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@@H](C)[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500119716 1091051581 /nfs/dbraw/zinc/05/15/81/1091051581.db2.gz AHNOCBSTDMBEJI-SJORKVTESA-N 1 1 367.449 4.110 20 5 FIBDMO C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1cccc(F)c1 ZINC000500120484 1091052083 /nfs/dbraw/zinc/05/20/83/1091052083.db2.gz XSNWPMSPAQRCGL-VLIAUNLRSA-N 1 1 371.412 4.146 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)s1 ZINC000436410257 1091484114 /nfs/dbraw/zinc/48/41/14/1091484114.db2.gz NHNVXCLMIMUCIF-QMMMGPOBSA-N 1 1 359.220 4.409 20 5 FIBDMO CCC(CC)([NH2+]Cn1nc(C)c([N+](=O)[O-])c1C)c1ccc(Cl)cc1 ZINC000728900130 1091815256 /nfs/dbraw/zinc/81/52/56/1091815256.db2.gz CSMJKSRJIDIUAJ-UHFFFAOYSA-N 1 1 350.850 4.324 20 5 FIBDMO CCN1CCN([C@@H](C)C[NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000236848525 1091933338 /nfs/dbraw/zinc/93/33/38/1091933338.db2.gz ZHYKMHIZJHUAQD-IBGZPJMESA-N 1 1 361.533 4.109 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512263470 1091981725 /nfs/dbraw/zinc/98/17/25/1091981725.db2.gz WAMBNZUGNRCPTB-OAHLLOKOSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512263470 1091981732 /nfs/dbraw/zinc/98/17/32/1091981732.db2.gz WAMBNZUGNRCPTB-OAHLLOKOSA-N 1 1 353.422 4.067 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCc4ccc(O)cc4C3)o2)c1 ZINC000509533416 1092338825 /nfs/dbraw/zinc/33/88/25/1092338825.db2.gz RHSDSBLOSHABOL-UHFFFAOYSA-N 1 1 350.374 4.119 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCc4ccc(O)cc4C3)o2)c1 ZINC000509533416 1092338838 /nfs/dbraw/zinc/33/88/38/1092338838.db2.gz RHSDSBLOSHABOL-UHFFFAOYSA-N 1 1 350.374 4.119 20 5 FIBDMO COc1cc(C[N@H+]2CC3(CCC3)C[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000432788818 1092367749 /nfs/dbraw/zinc/36/77/49/1092367749.db2.gz MRAQEAHVPGUMEW-LBPRGKRZSA-N 1 1 370.396 4.012 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(Br)cn1 ZINC000279949717 1092657698 /nfs/dbraw/zinc/65/76/98/1092657698.db2.gz BPIFAOBRUHQVPN-QWRGUYRKSA-N 1 1 350.216 4.164 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CCC(F)(F)[C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000522044761 1093053811 /nfs/dbraw/zinc/05/38/11/1093053811.db2.gz KUXFXTZKNJGGIY-LBPRGKRZSA-N 1 1 366.364 4.341 20 5 FIBDMO CCc1ccc([C@H]2CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000433057245 1093174735 /nfs/dbraw/zinc/17/47/35/1093174735.db2.gz KPBWRVNBHJZJQG-INIZCTEOSA-N 1 1 351.406 4.288 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 ZINC000443639578 1093364565 /nfs/dbraw/zinc/36/45/65/1093364565.db2.gz LGLYZAVMRIWMAW-GFCCVEGCSA-N 1 1 373.359 4.394 20 5 FIBDMO Cc1ccc(C)c([C@@H]2CCC[N@@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000474237199 1093606051 /nfs/dbraw/zinc/60/60/51/1093606051.db2.gz VBLRZIQSLYZQSV-SFHVURJKSA-N 1 1 367.449 4.296 20 5 FIBDMO Cc1ccc(C)c([C@@H]2CCC[N@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000474237199 1093606061 /nfs/dbraw/zinc/60/60/61/1093606061.db2.gz VBLRZIQSLYZQSV-SFHVURJKSA-N 1 1 367.449 4.296 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[C@@H]1C(C)(C)C ZINC000419325691 1093635632 /nfs/dbraw/zinc/63/56/32/1093635632.db2.gz LIYIVCCLLKWOPN-JKSUJKDBSA-N 1 1 358.442 4.291 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[C@@H]1C(C)(C)C ZINC000419325689 1093635836 /nfs/dbraw/zinc/63/58/36/1093635836.db2.gz LIYIVCCLLKWOPN-HOTGVXAUSA-N 1 1 358.442 4.291 20 5 FIBDMO CC[C@H]1CCCC[N@H+]1CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000237036717 1093695224 /nfs/dbraw/zinc/69/52/24/1093695224.db2.gz UCZOBVXUPOTZBJ-KRWDZBQOSA-N 1 1 374.510 4.072 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000397994580 1093799594 /nfs/dbraw/zinc/79/95/94/1093799594.db2.gz RTWHSRYXVYHRIN-KXBFYZLASA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000397994580 1093799602 /nfs/dbraw/zinc/79/96/02/1093799602.db2.gz RTWHSRYXVYHRIN-KXBFYZLASA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1c(Cl)cccc1[N+](=O)[O-] ZINC000397988087 1093805193 /nfs/dbraw/zinc/80/51/93/1093805193.db2.gz PEEVHPFSIHJGLR-KXBFYZLASA-N 1 1 373.884 4.248 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(Br)s1 ZINC000542706229 1093887199 /nfs/dbraw/zinc/88/71/99/1093887199.db2.gz RRGAUUFRXVBKEP-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(Br)s1 ZINC000542706229 1093887204 /nfs/dbraw/zinc/88/72/04/1093887204.db2.gz RRGAUUFRXVBKEP-UHFFFAOYSA-N 1 1 355.257 4.359 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2cccnc2OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000151113805 1093904388 /nfs/dbraw/zinc/90/43/88/1093904388.db2.gz WKONZBMEWIOCPM-LBPRGKRZSA-N 1 1 369.343 4.090 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@H](c2c(F)cccc2Cl)[NH+]2CCCC2)cn1 ZINC000513190358 1093997848 /nfs/dbraw/zinc/99/78/48/1093997848.db2.gz SYYYCRSHLOZBFR-OAHLLOKOSA-N 1 1 364.808 4.031 20 5 FIBDMO CC(=O)c1ccccc1OCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513398430 1094101507 /nfs/dbraw/zinc/10/15/07/1094101507.db2.gz SFUPLYRJRPECMJ-UHFFFAOYSA-N 1 1 356.422 4.087 20 5 FIBDMO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000513406193 1094104435 /nfs/dbraw/zinc/10/44/35/1094104435.db2.gz OAXJLHYEFJPRIV-AWEZNQCLSA-N 1 1 367.405 4.363 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000513406193 1094104441 /nfs/dbraw/zinc/10/44/41/1094104441.db2.gz OAXJLHYEFJPRIV-AWEZNQCLSA-N 1 1 367.405 4.363 20 5 FIBDMO CC(C)Oc1cccc(C[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000120690441 1094275850 /nfs/dbraw/zinc/27/58/50/1094275850.db2.gz ZWIZCZQVKYHEJS-UHFFFAOYSA-N 1 1 355.394 4.155 20 5 FIBDMO CC(C)Oc1cccc(C[N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000120690441 1094275855 /nfs/dbraw/zinc/27/58/55/1094275855.db2.gz ZWIZCZQVKYHEJS-UHFFFAOYSA-N 1 1 355.394 4.155 20 5 FIBDMO CC(C)CC1(C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000513696955 1094360317 /nfs/dbraw/zinc/36/03/17/1094360317.db2.gz HJPGJFZZROEVSP-SFHVURJKSA-N 1 1 356.470 4.224 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000522535675 1095119366 /nfs/dbraw/zinc/11/93/66/1095119366.db2.gz VUSCPTVCTIAREE-HNNXBMFYSA-N 1 1 366.870 4.491 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000522535675 1095119372 /nfs/dbraw/zinc/11/93/72/1095119372.db2.gz VUSCPTVCTIAREE-HNNXBMFYSA-N 1 1 366.870 4.491 20 5 FIBDMO CC(C)C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCc2cccnc21 ZINC000127045403 1095419486 /nfs/dbraw/zinc/41/94/86/1095419486.db2.gz TUDFZYNYGFAYMT-UXHICEINSA-N 1 1 369.465 4.059 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000444166752 1095806742 /nfs/dbraw/zinc/80/67/42/1095806742.db2.gz JYXQUSAGMATTDE-BFUOFWGJSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000444166752 1095806767 /nfs/dbraw/zinc/80/67/67/1095806767.db2.gz JYXQUSAGMATTDE-BFUOFWGJSA-N 1 1 371.412 4.064 20 5 FIBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000444239937 1095895066 /nfs/dbraw/zinc/89/50/66/1095895066.db2.gz CUTLIIQQFIWKEG-RVKKMQEKSA-N 1 1 355.438 4.445 20 5 FIBDMO CC[C@@H](Cc1ccc(C)cc1)[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000444243307 1095902383 /nfs/dbraw/zinc/90/23/83/1095902383.db2.gz PSESOXOIVAKFOO-SFHVURJKSA-N 1 1 369.465 4.103 20 5 FIBDMO CC[C@@H](NC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000423471483 1096694695 /nfs/dbraw/zinc/69/46/95/1096694695.db2.gz MFRHVZFDMCCXST-IOMROCGXSA-N 1 1 371.456 4.168 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)cc1 ZINC000532904391 1098579868 /nfs/dbraw/zinc/57/98/68/1098579868.db2.gz VTANZIOJIBISMS-QGZVFWFLSA-N 1 1 369.446 4.420 20 5 FIBDMO CC[C@H](c1ccccc1)[N@@H+](CC)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000532935230 1098628542 /nfs/dbraw/zinc/62/85/42/1098628542.db2.gz YJSRCJNCQMSHRZ-GOSISDBHSA-N 1 1 371.437 4.015 20 5 FIBDMO Cc1ccc(C)c([C@H](C)[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000532976725 1098646129 /nfs/dbraw/zinc/64/61/29/1098646129.db2.gz DIZJOFZAMWRSEG-INIZCTEOSA-N 1 1 355.438 4.152 20 5 FIBDMO COc1ccc2cc(C[N@@H+](C)CCOc3ccccc3[N+](=O)[O-])ccc2c1 ZINC000515549565 1098691927 /nfs/dbraw/zinc/69/19/27/1098691927.db2.gz AMKNWNGDHHKEHB-UHFFFAOYSA-N 1 1 366.417 4.267 20 5 FIBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C)c1 ZINC000533252074 1098912465 /nfs/dbraw/zinc/91/24/65/1098912465.db2.gz DMWFIPHCYABJMK-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C)c1 ZINC000533252074 1098912469 /nfs/dbraw/zinc/91/24/69/1098912469.db2.gz DMWFIPHCYABJMK-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000533295318 1098950026 /nfs/dbraw/zinc/95/00/26/1098950026.db2.gz UTMUHBCOKVCRGE-FQEVSTJZSA-N 1 1 367.449 4.012 20 5 FIBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000533301041 1098953188 /nfs/dbraw/zinc/95/31/88/1098953188.db2.gz CMUOVWPALZWMFX-SFHVURJKSA-N 1 1 369.465 4.185 20 5 FIBDMO Cc1ccc(C[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C2CC2)cc1C ZINC000533429076 1099049638 /nfs/dbraw/zinc/04/96/38/1099049638.db2.gz BYWBUAIZFQDHRW-UHFFFAOYSA-N 1 1 367.449 4.123 20 5 FIBDMO Cc1ccc(C[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C2CC2)cc1C ZINC000533429076 1099049651 /nfs/dbraw/zinc/04/96/51/1099049651.db2.gz BYWBUAIZFQDHRW-UHFFFAOYSA-N 1 1 367.449 4.123 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000533511771 1099118102 /nfs/dbraw/zinc/11/81/02/1099118102.db2.gz IGLFWSQGHOYVPZ-JKIFEVAISA-N 1 1 351.878 4.085 20 5 FIBDMO C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000536667725 1100125231 /nfs/dbraw/zinc/12/52/31/1100125231.db2.gz OJWHBZHYXGCNNB-OLZOCXBDSA-N 1 1 364.829 4.244 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000536673980 1100165101 /nfs/dbraw/zinc/16/51/01/1100165101.db2.gz HZKJIMRAAYLGRU-HNNXBMFYSA-N 1 1 356.422 4.167 20 5 FIBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1N1CCCC1 ZINC000506140492 1100229827 /nfs/dbraw/zinc/22/98/27/1100229827.db2.gz CQYXKSSEDLFRPW-FLIBITNWSA-N 1 1 351.450 4.340 20 5 FIBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1N1CCCC1 ZINC000506140491 1100230236 /nfs/dbraw/zinc/23/02/36/1100230236.db2.gz CQYXKSSEDLFRPW-DHZHZOJOSA-N 1 1 351.450 4.340 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000459650294 1100391892 /nfs/dbraw/zinc/39/18/92/1100391892.db2.gz XLLPIRSQQQPIQC-CJNGLKHVSA-N 1 1 372.387 4.337 20 5 FIBDMO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H]1CCSC1 ZINC000506207820 1100597212 /nfs/dbraw/zinc/59/72/12/1100597212.db2.gz SSBFFLVCRDOPOZ-HNNXBMFYSA-N 1 1 362.426 4.464 20 5 FIBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000506400004 1100965348 /nfs/dbraw/zinc/96/53/48/1100965348.db2.gz ADDMYTIANZLOHH-QGZVFWFLSA-N 1 1 360.385 4.137 20 5 FIBDMO CC(C)[N@H+](Cc1cccs1)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000518595885 1101332703 /nfs/dbraw/zinc/33/27/03/1101332703.db2.gz BRTOYXVNDZLBMD-UHFFFAOYSA-N 1 1 358.423 4.117 20 5 FIBDMO CC(C)[N@@H+](Cc1cccs1)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000518595885 1101332717 /nfs/dbraw/zinc/33/27/17/1101332717.db2.gz BRTOYXVNDZLBMD-UHFFFAOYSA-N 1 1 358.423 4.117 20 5 FIBDMO CC(C)[N@@H+](Cc1cn(C)nc1-c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000537164603 1101511394 /nfs/dbraw/zinc/51/13/94/1101511394.db2.gz QGZDFWTXODTBAO-UHFFFAOYSA-N 1 1 364.449 4.406 20 5 FIBDMO CC(C)c1ccc(C(=O)N2CCC[C@H]([N@@H+]3[C@H](C)CC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000473614576 1102254249 /nfs/dbraw/zinc/25/42/49/1102254249.db2.gz ALEAWJZSRXPZRH-JZXOWHBKSA-N 1 1 373.497 4.196 20 5 FIBDMO Cc1ccc([C@@H]2CCCC[N@@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000532575146 1102498145 /nfs/dbraw/zinc/49/81/45/1102498145.db2.gz RWWHLOFLOIJXCN-SFHVURJKSA-N 1 1 367.449 4.377 20 5 FIBDMO Cc1ccc([C@@H]2CCCC[N@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000532575146 1102498154 /nfs/dbraw/zinc/49/81/54/1102498154.db2.gz RWWHLOFLOIJXCN-SFHVURJKSA-N 1 1 367.449 4.377 20 5 FIBDMO COc1cc(C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)c([N+](=O)[O-])cc1F ZINC000184302236 1102804376 /nfs/dbraw/zinc/80/43/76/1102804376.db2.gz IYLZGTANMGGRNH-JTQLQIEISA-N 1 1 370.327 4.195 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)C1CC1 ZINC000507123544 1103130456 /nfs/dbraw/zinc/13/04/56/1103130456.db2.gz ZNRAWXNYMGMYTE-UHFFFAOYSA-N 1 1 351.200 4.212 20 5 FIBDMO Cc1ccccc1[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000507166437 1103166985 /nfs/dbraw/zinc/16/69/85/1103166985.db2.gz WRHXDNYMBFVNAB-DLBZAZTESA-N 1 1 367.449 4.028 20 5 FIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ncccc1C(F)(F)F ZINC000507152543 1103169339 /nfs/dbraw/zinc/16/93/39/1103169339.db2.gz VVOGYCQMGVMODF-UHFFFAOYSA-N 1 1 353.344 4.419 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ncccc1C(F)(F)F ZINC000507152543 1103169346 /nfs/dbraw/zinc/16/93/46/1103169346.db2.gz VVOGYCQMGVMODF-UHFFFAOYSA-N 1 1 353.344 4.419 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(F)c3cccnc23)C2CC2)c1 ZINC000507170271 1103191303 /nfs/dbraw/zinc/19/13/03/1103191303.db2.gz MURLULXOALPUMO-UHFFFAOYSA-N 1 1 351.381 4.447 20 5 FIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C[C@H]1CCC[C@@H]1O ZINC000537709487 1103870861 /nfs/dbraw/zinc/87/08/61/1103870861.db2.gz FVDUEXMXTDHWEM-PXAZEXFGSA-N 1 1 364.829 4.101 20 5 FIBDMO CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000441229728 1104216725 /nfs/dbraw/zinc/21/67/25/1104216725.db2.gz JHPRFDXFHBIKBV-OAHLLOKOSA-N 1 1 374.437 4.074 20 5 FIBDMO COc1ccc(OCC[N@H+]2C[C@H](C)C[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000441338168 1104282305 /nfs/dbraw/zinc/28/23/05/1104282305.db2.gz SHXVDYDTCUTSQQ-RDTXWAMCSA-N 1 1 374.412 4.204 20 5 FIBDMO O=C(C[C@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000441404133 1104344927 /nfs/dbraw/zinc/34/49/27/1104344927.db2.gz MTKANUQVUDULMW-OAHLLOKOSA-N 1 1 360.360 4.110 20 5 FIBDMO O=C(C[C@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000441404133 1104344939 /nfs/dbraw/zinc/34/49/39/1104344939.db2.gz MTKANUQVUDULMW-OAHLLOKOSA-N 1 1 360.360 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000441403297 1104345325 /nfs/dbraw/zinc/34/53/25/1104345325.db2.gz KQHVLVCEUIXTMV-GDBMZVCRSA-N 1 1 356.397 4.390 20 5 FIBDMO COc1ccc(C[N@@H+](C[C@@H]2CCCO2)C2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000441457695 1104755368 /nfs/dbraw/zinc/75/53/68/1104755368.db2.gz ONZMUOXQFLLTHJ-VJFUWPCTSA-N 1 1 362.470 4.163 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000520525565 1104975507 /nfs/dbraw/zinc/97/55/07/1104975507.db2.gz QQEGRMZFGAAOPV-WCQYABFASA-N 1 1 358.385 4.215 20 5 FIBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+](Cc4ccc([N+](=O)[O-])cc4)C3)nc2c1 ZINC000536472963 1105152795 /nfs/dbraw/zinc/15/27/95/1105152795.db2.gz RQQOHXWTECYZBN-MRXNPFEDSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@H+](Cc4ccc([N+](=O)[O-])cc4)C3)[nH]c2c1 ZINC000536472963 1105152803 /nfs/dbraw/zinc/15/28/03/1105152803.db2.gz RQQOHXWTECYZBN-MRXNPFEDSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@@H+](Cc4ccc([N+](=O)[O-])cc4)C3)[nH]c2c1 ZINC000536472963 1105152808 /nfs/dbraw/zinc/15/28/08/1105152808.db2.gz RQQOHXWTECYZBN-MRXNPFEDSA-N 1 1 350.422 4.159 20 5 FIBDMO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@H](C)CO1 ZINC000508016245 1105301124 /nfs/dbraw/zinc/30/11/24/1105301124.db2.gz OPJCUQNFZXVYFZ-VXGBXAGGSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[C@H](C)CO1 ZINC000508016245 1105301130 /nfs/dbraw/zinc/30/11/30/1105301130.db2.gz OPJCUQNFZXVYFZ-VXGBXAGGSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000451144603 1106945073 /nfs/dbraw/zinc/94/50/73/1106945073.db2.gz IVXQJUNNQBHBTG-AXFHLTTASA-N 1 1 356.348 4.022 20 5 FIBDMO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000451144603 1106945074 /nfs/dbraw/zinc/94/50/74/1106945074.db2.gz IVXQJUNNQBHBTG-AXFHLTTASA-N 1 1 356.348 4.022 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530522896 1107102141 /nfs/dbraw/zinc/10/21/41/1107102141.db2.gz UNEKZONFAOGVHV-IEBWSBKVSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000530522896 1107102158 /nfs/dbraw/zinc/10/21/58/1107102158.db2.gz UNEKZONFAOGVHV-IEBWSBKVSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCN(Cc2ccccc2)C1 ZINC000530522896 1107102167 /nfs/dbraw/zinc/10/21/67/1107102167.db2.gz UNEKZONFAOGVHV-IEBWSBKVSA-N 1 1 353.466 4.076 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nc(-c4ccsc4)no3)C2)cc1 ZINC000451575504 1107190022 /nfs/dbraw/zinc/19/00/22/1107190022.db2.gz SYLXPUINGLOBQH-CQSZACIVSA-N 1 1 370.434 4.086 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc(-c4ccsc4)no3)C2)cc1 ZINC000451575504 1107190030 /nfs/dbraw/zinc/19/00/30/1107190030.db2.gz SYLXPUINGLOBQH-CQSZACIVSA-N 1 1 370.434 4.086 20 5 FIBDMO C[C@@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000248753955 1107375914 /nfs/dbraw/zinc/37/59/14/1107375914.db2.gz CJPTVENTAJLCDW-OTNPHJDUSA-N 1 1 365.477 4.441 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC000452078949 1107461391 /nfs/dbraw/zinc/46/13/91/1107461391.db2.gz MPQJEPUSCJAMJK-KBPBESRZSA-N 1 1 358.442 4.464 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)Cc1ccc(O)cc1 ZINC001168135011 1107488288 /nfs/dbraw/zinc/48/82/88/1107488288.db2.gz UGGQEDIPZVOQQE-HNNXBMFYSA-N 1 1 358.438 4.151 20 5 FIBDMO COc1cccc(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000475503496 1107590895 /nfs/dbraw/zinc/59/08/95/1107590895.db2.gz NIDRHIQKNWILHX-SUMWQHHRSA-N 1 1 361.467 4.160 20 5 FIBDMO Cc1nc2ccccc2n1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000475508085 1107610889 /nfs/dbraw/zinc/61/08/89/1107610889.db2.gz LOKYFCSDUFABMD-UHFFFAOYSA-N 1 1 368.412 4.229 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000523133671 1107929982 /nfs/dbraw/zinc/92/99/82/1107929982.db2.gz QIWMABIIYZCQSR-UHFFFAOYSA-N 1 1 367.449 4.030 20 5 FIBDMO CC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1nnc2n1CCCCC2 ZINC000531707978 1108087502 /nfs/dbraw/zinc/08/75/02/1108087502.db2.gz SFLOPTKGLSMSHR-WMLDXEAASA-N 1 1 357.458 4.023 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000523451607 1108214101 /nfs/dbraw/zinc/21/41/01/1108214101.db2.gz LJADJUASULHGJA-RHSMWYFYSA-N 1 1 356.397 4.390 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000523451609 1108214385 /nfs/dbraw/zinc/21/43/85/1108214385.db2.gz LJADJUASULHGJA-YOEHRIQHSA-N 1 1 356.397 4.390 20 5 FIBDMO Cc1c(-c2noc([C@@H]3CCC[N@@H+]3Cc3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000453255141 1108327552 /nfs/dbraw/zinc/32/75/52/1108327552.db2.gz LJVDXUVSYGONPN-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1c(-c2noc([C@@H]3CCC[N@H+]3Cc3ccccc3)n2)cccc1[N+](=O)[O-] ZINC000453255141 1108327571 /nfs/dbraw/zinc/32/75/71/1108327571.db2.gz LJVDXUVSYGONPN-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO CCC[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CC(C)(C)C(N)=O)C1 ZINC000453282839 1108358444 /nfs/dbraw/zinc/35/84/44/1108358444.db2.gz OIRVTEFUUOPZHJ-QAPCUYQASA-N 1 1 361.486 4.050 20 5 FIBDMO CC(C)c1nnc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000453292893 1108370225 /nfs/dbraw/zinc/37/02/25/1108370225.db2.gz PAMDRFOIBMXYJM-LBPRGKRZSA-N 1 1 371.466 4.416 20 5 FIBDMO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)C1=CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000453393828 1108523573 /nfs/dbraw/zinc/52/35/73/1108523573.db2.gz ILMDEZMNZCTWHP-SFHVURJKSA-N 1 1 354.454 4.144 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](CO)c2ccc(Cl)cc2C(F)(F)F)cc1 ZINC000475633902 1108951191 /nfs/dbraw/zinc/95/11/91/1108951191.db2.gz KKGQPMVGBCPAPN-OAHLLOKOSA-N 1 1 374.746 4.090 20 5 FIBDMO O=C(Nc1ccccc1)C1CC[NH+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000163278486 1108984487 /nfs/dbraw/zinc/98/44/87/1108984487.db2.gz JSXNFYFLYDAQEZ-UHFFFAOYSA-N 1 1 373.840 4.099 20 5 FIBDMO CC(C)[N@H+](Cc1cncn1Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000445797550 1108999945 /nfs/dbraw/zinc/99/99/45/1108999945.db2.gz APHXXZOSGPGKFV-UHFFFAOYSA-N 1 1 364.449 4.250 20 5 FIBDMO CC(C)[N@@H+](Cc1cncn1Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000445797550 1108999950 /nfs/dbraw/zinc/99/99/50/1108999950.db2.gz APHXXZOSGPGKFV-UHFFFAOYSA-N 1 1 364.449 4.250 20 5 FIBDMO O=[N+]([O-])c1cnc(Nc2ccc3c(c2)[nH+]c2n3CCCCC2)c(Cl)c1 ZINC000524579984 1109084945 /nfs/dbraw/zinc/08/49/45/1109084945.db2.gz HVIFGLKDZKWQIV-UHFFFAOYSA-N 1 1 357.801 4.463 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@H]1c1ccccc1 ZINC000525639664 1109465186 /nfs/dbraw/zinc/46/51/86/1109465186.db2.gz VWXGQLQMRITJBT-FOIQADDNSA-N 1 1 368.433 4.087 20 5 FIBDMO C[C@@H]1C[C@@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000525709014 1109488282 /nfs/dbraw/zinc/48/82/82/1109488282.db2.gz DCFGVVLHPVLAAA-PBHICJAKSA-N 1 1 373.428 4.099 20 5 FIBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCN1C ZINC000525709014 1109488286 /nfs/dbraw/zinc/48/82/86/1109488286.db2.gz DCFGVVLHPVLAAA-PBHICJAKSA-N 1 1 373.428 4.099 20 5 FIBDMO C[C@H]1C[C@@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000525709017 1109488444 /nfs/dbraw/zinc/48/84/44/1109488444.db2.gz DCFGVVLHPVLAAA-YOEHRIQHSA-N 1 1 373.428 4.099 20 5 FIBDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCN1C ZINC000525709017 1109488447 /nfs/dbraw/zinc/48/84/47/1109488447.db2.gz DCFGVVLHPVLAAA-YOEHRIQHSA-N 1 1 373.428 4.099 20 5 FIBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1 ZINC000441252266 1109529789 /nfs/dbraw/zinc/52/97/89/1109529789.db2.gz ATMHXBOEUWUZFL-CQSZACIVSA-N 1 1 370.405 4.421 20 5 FIBDMO COC[C@]1(C)CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000449394684 1110050174 /nfs/dbraw/zinc/05/01/74/1110050174.db2.gz OLJVFESELRNBSY-GOSISDBHSA-N 1 1 364.829 4.367 20 5 FIBDMO CO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@H]1C ZINC000449492918 1110087544 /nfs/dbraw/zinc/08/75/44/1110087544.db2.gz CUQAUINPSIYPCN-SJKOYZFVSA-N 1 1 364.829 4.365 20 5 FIBDMO CSCc1cnc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449500325 1110094149 /nfs/dbraw/zinc/09/41/49/1110094149.db2.gz NLMIRMBZWJXDFF-AWEZNQCLSA-N 1 1 363.508 4.294 20 5 FIBDMO CSCc1cnc(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449500325 1110094153 /nfs/dbraw/zinc/09/41/53/1110094153.db2.gz NLMIRMBZWJXDFF-AWEZNQCLSA-N 1 1 363.508 4.294 20 5 FIBDMO Cn1cc(C[NH2+]Cc2c(F)cccc2Cl)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538396232 1111122448 /nfs/dbraw/zinc/12/24/48/1111122448.db2.gz OQWMJSYZDJQRID-UHFFFAOYSA-N 1 1 374.803 4.078 20 5 FIBDMO COC[C@H]1CCC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000538729769 1111266566 /nfs/dbraw/zinc/26/65/66/1111266566.db2.gz SUJHRZMEIXQNBW-SFHVURJKSA-N 1 1 369.465 4.221 20 5 FIBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000538731046 1111268255 /nfs/dbraw/zinc/26/82/55/1111268255.db2.gz RBFNADOEHQIYBL-MRXNPFEDSA-N 1 1 374.412 4.385 20 5 FIBDMO COc1ccc(C[N@H+]2CCC2(C)C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000538736241 1111270776 /nfs/dbraw/zinc/27/07/76/1111270776.db2.gz LFRTXTAUWZUMGL-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CC[N@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000538738173 1111271421 /nfs/dbraw/zinc/27/14/21/1111271421.db2.gz DRFGHHJCASADIF-CRAIPNDOSA-N 1 1 357.454 4.159 20 5 FIBDMO CCN1CC[C@@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000538738173 1111271443 /nfs/dbraw/zinc/27/14/43/1111271443.db2.gz DRFGHHJCASADIF-CRAIPNDOSA-N 1 1 357.454 4.159 20 5 FIBDMO CCN1CC[C@@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000538738173 1111271447 /nfs/dbraw/zinc/27/14/47/1111271447.db2.gz DRFGHHJCASADIF-CRAIPNDOSA-N 1 1 357.454 4.159 20 5 FIBDMO Cc1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461772584 1111350477 /nfs/dbraw/zinc/35/04/77/1111350477.db2.gz GKYXEIWRHBNJHI-LLVKDONJSA-N 1 1 354.332 4.029 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(OC(C)C)c(OC)c1 ZINC000539252480 1111487605 /nfs/dbraw/zinc/48/76/05/1111487605.db2.gz GIJZRTRJTHTRCH-CQSZACIVSA-N 1 1 374.437 4.250 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC000480204259 1112330861 /nfs/dbraw/zinc/33/08/61/1112330861.db2.gz SSYLIEVEGLALSP-HIFRSBDPSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000480204259 1112330867 /nfs/dbraw/zinc/33/08/67/1112330867.db2.gz SSYLIEVEGLALSP-HIFRSBDPSA-N 1 1 373.840 4.065 20 5 FIBDMO CC[C@H]([NH2+][C@H](CN1CCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000480278553 1112370778 /nfs/dbraw/zinc/37/07/78/1112370778.db2.gz PAHYEOBISPWQIK-LEWJYISDSA-N 1 1 353.466 4.473 20 5 FIBDMO Cc1c([C@@H](C)[NH2+]Cc2nc3cccc(Cl)c3n2C)cccc1[N+](=O)[O-] ZINC000480697110 1112558741 /nfs/dbraw/zinc/55/87/41/1112558741.db2.gz KPCYYHJWZOTNLD-GFCCVEGCSA-N 1 1 358.829 4.294 20 5 FIBDMO C[C@@H]1C[NH+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](C)C1(F)F ZINC000600183741 1112918929 /nfs/dbraw/zinc/91/89/29/1112918929.db2.gz LSECVYSIYXFLKG-VXGBXAGGSA-N 1 1 367.421 4.441 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+](Cc3ccc(F)cc3)CC3CC3)nc2c1 ZINC000482686178 1113331208 /nfs/dbraw/zinc/33/12/08/1113331208.db2.gz GIGWJIDOLFCMBU-UHFFFAOYSA-N 1 1 354.385 4.022 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](Cc3ccc(F)cc3)CC3CC3)nc2c1 ZINC000482686178 1113331212 /nfs/dbraw/zinc/33/12/12/1113331212.db2.gz GIGWJIDOLFCMBU-UHFFFAOYSA-N 1 1 354.385 4.022 20 5 FIBDMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482700414 1113335345 /nfs/dbraw/zinc/33/53/45/1113335345.db2.gz XJYJOBPYWXMSAJ-LBPRGKRZSA-N 1 1 358.829 4.188 20 5 FIBDMO C[C@H](N[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000160763127 1113447458 /nfs/dbraw/zinc/44/74/58/1113447458.db2.gz NMPZRXNXJTUUJK-FIKGOQFSSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000160763127 1113447460 /nfs/dbraw/zinc/44/74/60/1113447460.db2.gz NMPZRXNXJTUUJK-FIKGOQFSSA-N 1 1 353.466 4.156 20 5 FIBDMO CC(C)N(C)c1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000483182198 1113459020 /nfs/dbraw/zinc/45/90/20/1113459020.db2.gz XZFCISVRSUZJPF-UHFFFAOYSA-N 1 1 356.470 4.245 20 5 FIBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CSc3ccc(Br)cc32)c1 ZINC000486801523 1113652933 /nfs/dbraw/zinc/65/29/33/1113652933.db2.gz UUTSENKEZISXGX-AWEZNQCLSA-N 1 1 365.252 4.294 20 5 FIBDMO Cc1ccc([C@@H]2C[C@@H](C)[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000490077280 1114214103 /nfs/dbraw/zinc/21/41/03/1114214103.db2.gz DIOOLVVACPLTBJ-GDBMZVCRSA-N 1 1 351.406 4.422 20 5 FIBDMO Cc1ccc([C@H]2C[C@@H](C)[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C2)cc1 ZINC000490083930 1114216588 /nfs/dbraw/zinc/21/65/88/1114216588.db2.gz VECSPTUTRZSQDP-WBVHZDCISA-N 1 1 368.433 4.148 20 5 FIBDMO CC[C@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CCCC1 ZINC000490171812 1114230041 /nfs/dbraw/zinc/23/00/41/1114230041.db2.gz ILTLODXSYOQTJD-TZIWHRDSSA-N 1 1 353.466 4.148 20 5 FIBDMO CC(C)[N@H+]1CCC[C@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000491035725 1114364448 /nfs/dbraw/zinc/36/44/48/1114364448.db2.gz JZWOKVIHYALPEA-GCJKJVERSA-N 1 1 367.493 4.394 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OCC(F)F ZINC000491095630 1114373127 /nfs/dbraw/zinc/37/31/27/1114373127.db2.gz ZUODJRRRWWCVLY-OCCSQVGLSA-N 1 1 370.396 4.012 20 5 FIBDMO COC[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000588986502 1114685270 /nfs/dbraw/zinc/68/52/70/1114685270.db2.gz ABADABWZFMYNNP-OAHLLOKOSA-N 1 1 355.221 4.379 20 5 FIBDMO CCOC(=O)C1CCC([N@@H+](CC)Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000572850784 1114806894 /nfs/dbraw/zinc/80/68/94/1114806894.db2.gz GHMHWURMLUFVII-UHFFFAOYSA-N 1 1 368.861 4.192 20 5 FIBDMO Cc1ccc(C[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C(C)C)s1 ZINC000166101736 1114932048 /nfs/dbraw/zinc/93/20/48/1114932048.db2.gz YRYBAKFRECUFRO-UHFFFAOYSA-N 1 1 361.467 4.122 20 5 FIBDMO Cc1ccc(C[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C(C)C)s1 ZINC000166101736 1114932051 /nfs/dbraw/zinc/93/20/51/1114932051.db2.gz YRYBAKFRECUFRO-UHFFFAOYSA-N 1 1 361.467 4.122 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H](c2ccccc2)C2(CO)CC=CC2)c(F)c1 ZINC000592178135 1115216594 /nfs/dbraw/zinc/21/65/94/1115216594.db2.gz XNLDCRVYBUEZCD-IBGZPJMESA-N 1 1 374.387 4.033 20 5 FIBDMO CCCC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCc2ncsc2C1 ZINC000592187201 1115220247 /nfs/dbraw/zinc/22/02/47/1115220247.db2.gz ICLGUJGVZGOPCY-ZDUSSCGKSA-N 1 1 351.497 4.272 20 5 FIBDMO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1Cl ZINC000058764835 1115326394 /nfs/dbraw/zinc/32/63/94/1115326394.db2.gz QYQRBYUWMWCSGO-SNVBAGLBSA-N 1 1 368.220 4.191 20 5 FIBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000593870865 1115352459 /nfs/dbraw/zinc/35/24/59/1115352459.db2.gz FEYMMGXXCYAKDK-CALCHBBNSA-N 1 1 361.489 4.381 20 5 FIBDMO CCn1c2ccccc2nc1[C@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594499619 1115450790 /nfs/dbraw/zinc/45/07/90/1115450790.db2.gz OJQFAIYMTRFTLO-BBRMVZONSA-N 1 1 350.422 4.303 20 5 FIBDMO CCn1c2ccccc2nc1[C@@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594499623 1115450914 /nfs/dbraw/zinc/45/09/14/1115450914.db2.gz OJQFAIYMTRFTLO-CJNGLKHVSA-N 1 1 350.422 4.303 20 5 FIBDMO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595003560 1115506889 /nfs/dbraw/zinc/50/68/89/1115506889.db2.gz IMYQVEQRWPVJMA-CHWSQXEVSA-N 1 1 360.410 4.032 20 5 FIBDMO COC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1cccc(Cl)c1 ZINC000595046559 1115511662 /nfs/dbraw/zinc/51/16/62/1115511662.db2.gz AMCQALMTENTDBJ-YVEFUNNKSA-N 1 1 364.829 4.295 20 5 FIBDMO COc1ccccc1-c1cc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])on1 ZINC000595105848 1115516379 /nfs/dbraw/zinc/51/63/79/1115516379.db2.gz ZMJYJLQZILDJCH-QGZVFWFLSA-N 1 1 365.389 4.036 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cc(F)ccc1OC(F)F ZINC000595093732 1115517433 /nfs/dbraw/zinc/51/74/33/1115517433.db2.gz OOOFOTGKDAEDIW-NSHDSACASA-N 1 1 354.328 4.495 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H]1CC[C@H]2C[C@H]2C1)[C@H]1CC[C@H](O)CC1 ZINC000595561264 1115540435 /nfs/dbraw/zinc/54/04/35/1115540435.db2.gz DNFRTCFSRSEPFW-QQXMDYFESA-N 1 1 358.482 4.137 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@H](C4CCCCC4)C3)o2)cc1 ZINC000595734500 1115560188 /nfs/dbraw/zinc/56/01/88/1115560188.db2.gz MVAOBTSONTXFNK-INIZCTEOSA-N 1 1 356.426 4.047 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H]([C@@H]4CCCCO4)C3)co2)cc1 ZINC000595786908 1115563320 /nfs/dbraw/zinc/56/33/20/1115563320.db2.gz IXLWUKGFTZCFHL-LPHOPBHVSA-N 1 1 371.437 4.031 20 5 FIBDMO CCC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1CCCCC1 ZINC000060495338 1115648657 /nfs/dbraw/zinc/64/86/57/1115648657.db2.gz HJWCWABUDSWABR-UHFFFAOYSA-N 1 1 358.442 4.437 20 5 FIBDMO Cc1cc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])ncc1Br ZINC000598981132 1115775277 /nfs/dbraw/zinc/77/52/77/1115775277.db2.gz RSZJJXYPYAVZPL-UHFFFAOYSA-N 1 1 364.243 4.086 20 5 FIBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599070567 1115786590 /nfs/dbraw/zinc/78/65/90/1115786590.db2.gz ZHZRDGOYPDZKEY-AWEZNQCLSA-N 1 1 368.462 4.088 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3CCC4(CC4(F)F)CC3)cs2)c1 ZINC000593674259 1115788051 /nfs/dbraw/zinc/78/80/51/1115788051.db2.gz XMHUQSWOZMDIKQ-UHFFFAOYSA-N 1 1 365.405 4.340 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccnc2C(F)(F)F)C2CC2)cc1 ZINC000599338671 1115810565 /nfs/dbraw/zinc/81/05/65/1115810565.db2.gz DYTKRZXTSBUCLI-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccnc2C(F)(F)F)C2CC2)cc1 ZINC000599338671 1115810567 /nfs/dbraw/zinc/81/05/67/1115810567.db2.gz DYTKRZXTSBUCLI-UHFFFAOYSA-N 1 1 351.328 4.173 20 5 FIBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNc3cccnc3[N+](=O)[O-])cc2)C1 ZINC000603862277 1115822910 /nfs/dbraw/zinc/82/29/10/1115822910.db2.gz KYLQYYBIJGWAPK-IYBDPMFKSA-N 1 1 354.454 4.080 20 5 FIBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNc2cccnc2[N+](=O)[O-])C1 ZINC000603862334 1115823007 /nfs/dbraw/zinc/82/30/07/1115823007.db2.gz PJRXPSCRBWGQPF-IYBDPMFKSA-N 1 1 354.454 4.080 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000604520782 1115867258 /nfs/dbraw/zinc/86/72/58/1115867258.db2.gz PTIRUKPDJCIWLV-LAUBAEHRSA-N 1 1 370.449 4.203 20 5 FIBDMO CC[C@H](c1ccccc1)[N@@H+](CC)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000604493274 1115867549 /nfs/dbraw/zinc/86/75/49/1115867549.db2.gz BKGRHGXZROFUFL-QGZVFWFLSA-N 1 1 355.438 4.315 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000604492864 1115867653 /nfs/dbraw/zinc/86/76/53/1115867653.db2.gz KXEQCAQAFIVMBD-SFHVURJKSA-N 1 1 367.449 4.241 20 5 FIBDMO O=C(Nc1ccccc1)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172174030 1115921913 /nfs/dbraw/zinc/92/19/13/1115921913.db2.gz ZSHNCRJTZOJECL-UHFFFAOYSA-N 1 1 373.840 4.099 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2cccc(OC(F)(F)F)c2)CC1 ZINC000594038207 1115973698 /nfs/dbraw/zinc/97/36/98/1115973698.db2.gz MCSOCZVITGBJER-UHFFFAOYSA-N 1 1 352.312 4.272 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)no1)Cc1ccc([N+](=O)[O-])cc1 ZINC000608780187 1116128326 /nfs/dbraw/zinc/12/83/26/1116128326.db2.gz IZCUDRNHGAZPOT-UHFFFAOYSA-N 1 1 369.396 4.454 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC[C@@H]1C ZINC000608836317 1116131291 /nfs/dbraw/zinc/13/12/91/1116131291.db2.gz HWCNGVQCFKCFAD-HOTGVXAUSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCC[C@@H]1C ZINC000608836317 1116131293 /nfs/dbraw/zinc/13/12/93/1116131293.db2.gz HWCNGVQCFKCFAD-HOTGVXAUSA-N 1 1 357.454 4.207 20 5 FIBDMO CC1CCC(OC2CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 ZINC000491218695 1116141958 /nfs/dbraw/zinc/14/19/58/1116141958.db2.gz ZJUPILQHOJKFOY-UHFFFAOYSA-N 1 1 350.434 4.294 20 5 FIBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000609064336 1116197303 /nfs/dbraw/zinc/19/73/03/1116197303.db2.gz ZFZVVVDMMAXNEH-UHFFFAOYSA-N 1 1 353.422 4.209 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000089910019 1116351832 /nfs/dbraw/zinc/35/18/32/1116351832.db2.gz XQWQRQJUHROQRF-IBGZPJMESA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)n1 ZINC000089910019 1116351833 /nfs/dbraw/zinc/35/18/33/1116351833.db2.gz XQWQRQJUHROQRF-IBGZPJMESA-N 1 1 364.405 4.290 20 5 FIBDMO CCC[C@@H](Nc1ccc(N2CCOCC2)[nH+]c1C)c1cccc([N+](=O)[O-])c1 ZINC000539740816 1116374145 /nfs/dbraw/zinc/37/41/45/1116374145.db2.gz OVPAJOZGDNPNMD-LJQANCHMSA-N 1 1 370.453 4.088 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1 ZINC000539765063 1116377414 /nfs/dbraw/zinc/37/74/14/1116377414.db2.gz JFHRJULGRJGSSB-KRWDZBQOSA-N 1 1 369.469 4.140 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3nc(C4CCCCC4)n[nH]3)C2)cc1 ZINC000539765063 1116377416 /nfs/dbraw/zinc/37/74/16/1116377416.db2.gz JFHRJULGRJGSSB-KRWDZBQOSA-N 1 1 369.469 4.140 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3nc(C4CCCCC4)n[nH]3)C2)cc1 ZINC000539765063 1116377418 /nfs/dbraw/zinc/37/74/18/1116377418.db2.gz JFHRJULGRJGSSB-KRWDZBQOSA-N 1 1 369.469 4.140 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H](CCO)c1ccccc1 ZINC000539826339 1116386979 /nfs/dbraw/zinc/38/69/79/1116386979.db2.gz OCUJAICQSUXDPC-LJQANCHMSA-N 1 1 366.417 4.410 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(CN[C@H]3CC[N@@H+](CC4CCCC4)C3)o2)c1 ZINC000462740095 1117743602 /nfs/dbraw/zinc/74/36/02/1117743602.db2.gz RINRXMUPGGGFBU-SFHVURJKSA-N 1 1 369.465 4.209 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H]3CCN(CC4CCCC4)C3)o2)c1 ZINC000462740095 1117743604 /nfs/dbraw/zinc/74/36/04/1117743604.db2.gz RINRXMUPGGGFBU-SFHVURJKSA-N 1 1 369.465 4.209 20 5 FIBDMO Cc1[nH+]cn(-c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)c1C ZINC000462774702 1117760544 /nfs/dbraw/zinc/76/05/44/1117760544.db2.gz DBXKYFLYWQVFQY-UHFFFAOYSA-N 1 1 370.796 4.303 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000539992826 1117790814 /nfs/dbraw/zinc/79/08/14/1117790814.db2.gz HGXXDADKQXZLID-GUTXKFCHSA-N 1 1 369.412 4.038 20 5 FIBDMO C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](c2ccco2)C1 ZINC000076184680 1118192752 /nfs/dbraw/zinc/19/27/52/1118192752.db2.gz WMQMTBMUYOPGPN-GUYCJALGSA-N 1 1 358.394 4.028 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](c2ccco2)C1 ZINC000076184680 1118192755 /nfs/dbraw/zinc/19/27/55/1118192755.db2.gz WMQMTBMUYOPGPN-GUYCJALGSA-N 1 1 358.394 4.028 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000540866508 1118285522 /nfs/dbraw/zinc/28/55/22/1118285522.db2.gz VSLSOSTXJNULTG-QGZVFWFLSA-N 1 1 369.469 4.140 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541701959 1118616933 /nfs/dbraw/zinc/61/69/33/1118616933.db2.gz ZTWZRZBPLQGYGD-PXNSSMCTSA-N 1 1 374.412 4.095 20 5 FIBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(C)s2)c([N+](=O)[O-])cc1F ZINC000464687412 1118655882 /nfs/dbraw/zinc/65/58/82/1118655882.db2.gz OJRRYMYVOFVYLE-CQSZACIVSA-N 1 1 350.415 4.450 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(C)s2)c([N+](=O)[O-])cc1F ZINC000464687412 1118655886 /nfs/dbraw/zinc/65/58/86/1118655886.db2.gz OJRRYMYVOFVYLE-CQSZACIVSA-N 1 1 350.415 4.450 20 5 FIBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C[N@H+](CC)C2CC2)cc1 ZINC000464722324 1118671743 /nfs/dbraw/zinc/67/17/43/1118671743.db2.gz DSRPVNUFGYMKLV-UHFFFAOYSA-N 1 1 367.449 4.394 20 5 FIBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000464780447 1118692362 /nfs/dbraw/zinc/69/23/62/1118692362.db2.gz SUFHBRFYLZMNSO-WBVHZDCISA-N 1 1 352.500 4.488 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464834107 1118708038 /nfs/dbraw/zinc/70/80/38/1118708038.db2.gz FYTDOVPGXNFSQV-PKOBYXMFSA-N 1 1 353.466 4.110 20 5 FIBDMO CCCCOC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000464850683 1118722159 /nfs/dbraw/zinc/72/21/59/1118722159.db2.gz NNHRMZHQXIXMHS-UHFFFAOYSA-N 1 1 350.459 4.163 20 5 FIBDMO C[C@@H]([NH2+]Cc1cccc(SC(=O)N(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271796584 1118903047 /nfs/dbraw/zinc/90/30/47/1118903047.db2.gz VUWAAEYIUZPNEN-CYBMUJFWSA-N 1 1 359.451 4.219 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@]3(CCCOC3)C2)c1 ZINC000549865183 1118953083 /nfs/dbraw/zinc/95/30/83/1118953083.db2.gz DDTFDXISMCJRBG-MRXNPFEDSA-N 1 1 358.360 4.006 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+](Cc1ccccc1)[C@H](CO)C1CC1 ZINC000492177193 1119039736 /nfs/dbraw/zinc/03/97/36/1119039736.db2.gz XKPJMUABFBMFKJ-LJQANCHMSA-N 1 1 360.841 4.021 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+](Cc1ccccc1)[C@H](CO)C1CC1 ZINC000492177193 1119039739 /nfs/dbraw/zinc/03/97/39/1119039739.db2.gz XKPJMUABFBMFKJ-LJQANCHMSA-N 1 1 360.841 4.021 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000493179056 1119331988 /nfs/dbraw/zinc/33/19/88/1119331988.db2.gz GINWDOJXVZUHQJ-GOSISDBHSA-N 1 1 360.841 4.120 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000493179056 1119331991 /nfs/dbraw/zinc/33/19/91/1119331991.db2.gz GINWDOJXVZUHQJ-GOSISDBHSA-N 1 1 360.841 4.120 20 5 FIBDMO C[N@@H+](Cc1ccc(OC(F)F)cc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761510510 1119404929 /nfs/dbraw/zinc/40/49/29/1119404929.db2.gz GRHXMGVMUPDCCQ-UHFFFAOYSA-N 1 1 356.756 4.482 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000494269289 1119816762 /nfs/dbraw/zinc/81/67/62/1119816762.db2.gz WTSMQPWOGVXYBO-DTQAZKPQSA-N 1 1 367.449 4.267 20 5 FIBDMO COC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000089511995 1120898341 /nfs/dbraw/zinc/89/83/41/1120898341.db2.gz YSSLGYBPWUQDDA-HNNXBMFYSA-N 1 1 354.328 4.091 20 5 FIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000076776759 1121098718 /nfs/dbraw/zinc/09/87/18/1121098718.db2.gz KGZHZSYTVSPLBI-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c(Cl)c1 ZINC000326406445 1121160367 /nfs/dbraw/zinc/16/03/67/1121160367.db2.gz IXTSMUQFNVYLAJ-NXHRZFHOSA-N 1 1 352.862 4.154 20 5 FIBDMO CC(=O)c1c(NC[C@@H](c2ccco2)[NH+]2CCCCC2)cccc1[N+](=O)[O-] ZINC000763206883 1121275724 /nfs/dbraw/zinc/27/57/24/1121275724.db2.gz NAVSPXHVVPWUAM-KRWDZBQOSA-N 1 1 357.410 4.030 20 5 FIBDMO CC(=O)c1cc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000552996719 1121516779 /nfs/dbraw/zinc/51/67/79/1121516779.db2.gz DORXEUKLZFXDOO-OAHLLOKOSA-N 1 1 373.478 4.183 20 5 FIBDMO CCOc1ccc([C@H](C)NCc2cccc(C[N@H+](C)CC)c2)cc1[N+](=O)[O-] ZINC000153596428 1122201105 /nfs/dbraw/zinc/20/11/05/1122201105.db2.gz CAAVKMIYAMTMKF-INIZCTEOSA-N 1 1 371.481 4.296 20 5 FIBDMO CCOc1ccc([C@H](C)NCc2cccc(C[N@@H+](C)CC)c2)cc1[N+](=O)[O-] ZINC000153596428 1122201108 /nfs/dbraw/zinc/20/11/08/1122201108.db2.gz CAAVKMIYAMTMKF-INIZCTEOSA-N 1 1 371.481 4.296 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@H+](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000542692456 1122288336 /nfs/dbraw/zinc/28/83/36/1122288336.db2.gz QOMJADQMKWDRSG-UHFFFAOYSA-N 1 1 362.433 4.390 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000542692456 1122288341 /nfs/dbraw/zinc/28/83/41/1122288341.db2.gz QOMJADQMKWDRSG-UHFFFAOYSA-N 1 1 362.433 4.390 20 5 FIBDMO CCC[C@@H]([NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000129294736 1122565940 /nfs/dbraw/zinc/56/59/40/1122565940.db2.gz DIAHPWNGIVAGEF-IAGOWNOFSA-N 1 1 353.426 4.220 20 5 FIBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609280915 1122680061 /nfs/dbraw/zinc/68/00/61/1122680061.db2.gz WNAHQNVHOIIXFU-KRWDZBQOSA-N 1 1 356.422 4.209 20 5 FIBDMO CCC[C@]1(COC)CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000194923917 1123011849 /nfs/dbraw/zinc/01/18/49/1123011849.db2.gz UVMAJMMISOCUQX-HXUWFJFHSA-N 1 1 373.453 4.073 20 5 FIBDMO CCC[N@H+]1CC[C@@H](CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000919722946 1123109878 /nfs/dbraw/zinc/10/98/78/1123109878.db2.gz UWWQMJGDNRFMNW-JTQLQIEISA-N 1 1 365.783 4.411 20 5 FIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](c3nnc(C4CC4)[nH]3)C2)cc1[N+](=O)[O-] ZINC000557027669 1123322143 /nfs/dbraw/zinc/32/21/43/1123322143.db2.gz SPWUHAMQOWDMGD-MRXNPFEDSA-N 1 1 369.469 4.093 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)C1 ZINC000609441895 1123714233 /nfs/dbraw/zinc/71/42/33/1123714233.db2.gz VFAJAIVNQIBDTL-CQSZACIVSA-N 1 1 371.412 4.218 20 5 FIBDMO CC[C@H]1c2ccccc2CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000609625682 1123773778 /nfs/dbraw/zinc/77/37/78/1123773778.db2.gz OAUMFVVNNIIFTR-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000609625682 1123773780 /nfs/dbraw/zinc/77/37/80/1123773780.db2.gz OAUMFVVNNIIFTR-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO CC[N@H+]1CCCC[C@H]1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609762403 1123835111 /nfs/dbraw/zinc/83/51/11/1123835111.db2.gz IBMZKMYFADFDSP-IBGZPJMESA-N 1 1 369.421 4.200 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCS[C@H](c3ccccc3)C2)cc1 ZINC000609800965 1123839962 /nfs/dbraw/zinc/83/99/62/1123839962.db2.gz YCNJHRSWIWOITO-IBGZPJMESA-N 1 1 358.463 4.154 20 5 FIBDMO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+](C)Cc1ccccc1 ZINC000301246342 1123966898 /nfs/dbraw/zinc/96/68/98/1123966898.db2.gz LFVYSDUIBJMTAW-OAHLLOKOSA-N 1 1 350.422 4.075 20 5 FIBDMO CCc1ccc(C(C)(C)[NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000180102580 1124221895 /nfs/dbraw/zinc/22/18/95/1124221895.db2.gz LYWQTYQZMYEWBL-UHFFFAOYSA-N 1 1 366.421 4.232 20 5 FIBDMO CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000616994122 1124424596 /nfs/dbraw/zinc/42/45/96/1124424596.db2.gz UYUQLDAGRIVYAP-INIZCTEOSA-N 1 1 361.489 4.238 20 5 FIBDMO COc1cc(NCc2ccccc2C[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000462786496 1124517009 /nfs/dbraw/zinc/51/70/09/1124517009.db2.gz YMEOAPGASKONOI-INIZCTEOSA-N 1 1 369.465 4.447 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)c(Cl)c1 ZINC000542974430 1125085125 /nfs/dbraw/zinc/08/51/25/1125085125.db2.gz CMDAUIMLUXWFOF-IBGZPJMESA-N 1 1 360.841 4.021 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)[C@@H](CO)C2CC2)c(Cl)c1 ZINC000542974430 1125085135 /nfs/dbraw/zinc/08/51/35/1125085135.db2.gz CMDAUIMLUXWFOF-IBGZPJMESA-N 1 1 360.841 4.021 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCCC[C@@H]3c3ccco3)o2)cc1 ZINC000077177054 1125138862 /nfs/dbraw/zinc/13/88/62/1125138862.db2.gz NUJPHULFDAKWPS-MRXNPFEDSA-N 1 1 368.393 4.355 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCCC[C@@H]3c3ccco3)o2)cc1 ZINC000077177054 1125138871 /nfs/dbraw/zinc/13/88/71/1125138871.db2.gz NUJPHULFDAKWPS-MRXNPFEDSA-N 1 1 368.393 4.355 20 5 FIBDMO C[C@H]1C[C@H](N(C)c2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301748821 1125188000 /nfs/dbraw/zinc/18/80/00/1125188000.db2.gz SOWMJELOEDTRRJ-WMLDXEAASA-N 1 1 374.872 4.133 20 5 FIBDMO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c2ncccc12 ZINC000059386703 221126265 /nfs/dbraw/zinc/12/62/65/221126265.db2.gz XRMSENDGLZZVJE-QGZVFWFLSA-N 1 1 362.433 4.220 20 5 FIBDMO Cc1cc(NC[C@H](C)[N@H+]2CCCC[C@@H]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000060859100 567855538 /nfs/dbraw/zinc/85/55/38/567855538.db2.gz VLWPERZQBLOOES-HOTGVXAUSA-N 1 1 369.469 4.035 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCCC[C@H]12 ZINC000603846950 568162809 /nfs/dbraw/zinc/16/28/09/568162809.db2.gz IEGGASJHZOSEGZ-XYPHTWIQSA-N 1 1 356.426 4.045 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CC1CCC(C(F)(F)F)CC1)CCO2 ZINC000568804373 568226974 /nfs/dbraw/zinc/22/69/74/568226974.db2.gz VCDDYANBRFCNPZ-UHFFFAOYSA-N 1 1 358.360 4.158 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCCC[C@H]3c3cc[nH]n3)o2)cc1 ZINC000569392322 568400283 /nfs/dbraw/zinc/40/02/83/568400283.db2.gz DVAPUNOCBADFHQ-SFHVURJKSA-N 1 1 352.394 4.305 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCC[C@H]3c3cc[nH]n3)o2)cc1 ZINC000569392322 568400284 /nfs/dbraw/zinc/40/02/84/568400284.db2.gz DVAPUNOCBADFHQ-SFHVURJKSA-N 1 1 352.394 4.305 20 5 FIBDMO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)cc1Cl ZINC000132279933 1125550358 /nfs/dbraw/zinc/55/03/58/1125550358.db2.gz QWGQEHZITCKQID-UHFFFAOYSA-N 1 1 372.755 4.148 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000619722721 1125668091 /nfs/dbraw/zinc/66/80/91/1125668091.db2.gz VDNJIQDJAWWSSA-IAGOWNOFSA-N 1 1 368.481 4.377 20 5 FIBDMO CN(C)C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCCCC1 ZINC000608835447 1079849787 /nfs/dbraw/zinc/84/97/87/1079849787.db2.gz FZPBVKXWCCZTQC-UHFFFAOYSA-N 1 1 357.454 4.209 20 5 FIBDMO CC[C@@H]1CC[N@H+]1Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000430207325 1079944601 /nfs/dbraw/zinc/94/46/01/1079944601.db2.gz QOBFPZNPQVGPRI-QGZVFWFLSA-N 1 1 356.422 4.167 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1OCC ZINC000430213211 1079979058 /nfs/dbraw/zinc/97/90/58/1079979058.db2.gz SBIKKNFTUUQCHM-CQSZACIVSA-N 1 1 374.437 4.252 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCC(C)(C2CC2)CC1 ZINC000580742853 1082115253 /nfs/dbraw/zinc/11/52/53/1082115253.db2.gz FSWQCPYONBHTEG-LBPRGKRZSA-N 1 1 365.861 4.087 20 5 FIBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000022340191 1082255034 /nfs/dbraw/zinc/25/50/34/1082255034.db2.gz MGWXAYOYZYYRKN-UHFFFAOYSA-N 1 1 364.327 4.053 20 5 FIBDMO C[N@H+](Cc1ccc(C(F)(F)F)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000022340191 1082255040 /nfs/dbraw/zinc/25/50/40/1082255040.db2.gz MGWXAYOYZYYRKN-UHFFFAOYSA-N 1 1 364.327 4.053 20 5 FIBDMO Cc1ccc2c(c1)nc(C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)n2C ZINC000187586436 1083038343 /nfs/dbraw/zinc/03/83/43/1083038343.db2.gz CESDRKFQNLBQLY-UHFFFAOYSA-N 1 1 352.438 4.203 20 5 FIBDMO COc1cc(C[N@@H+](C)CC(C)(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000510618930 1083205659 /nfs/dbraw/zinc/20/56/59/1083205659.db2.gz LRYNUMIFBKWQBK-UHFFFAOYSA-N 1 1 364.364 4.022 20 5 FIBDMO COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(C)cc1C ZINC000610581541 1083206947 /nfs/dbraw/zinc/20/69/47/1083206947.db2.gz QZIHDLNWBWERIF-UHFFFAOYSA-N 1 1 369.421 4.001 20 5 FIBDMO COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(C)cc1C ZINC000610581541 1083206949 /nfs/dbraw/zinc/20/69/49/1083206949.db2.gz QZIHDLNWBWERIF-UHFFFAOYSA-N 1 1 369.421 4.001 20 5 FIBDMO Cc1ccccc1C[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581841 1083214239 /nfs/dbraw/zinc/21/42/39/1083214239.db2.gz RUNRXQKNFJYRLI-INIZCTEOSA-N 1 1 351.406 4.252 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCc2ccccc2[C@@H]1C(C)C ZINC000610788739 1083510059 /nfs/dbraw/zinc/51/00/59/1083510059.db2.gz JVFLQCGIBOQOAP-NRFANRHFSA-N 1 1 367.449 4.097 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCc2ccccc2[C@@H]1C(C)C ZINC000610788739 1083510065 /nfs/dbraw/zinc/51/00/65/1083510065.db2.gz JVFLQCGIBOQOAP-NRFANRHFSA-N 1 1 367.449 4.097 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000411945054 1083929915 /nfs/dbraw/zinc/92/99/15/1083929915.db2.gz KCQZLRKOSADGDH-ZWKOTPCHSA-N 1 1 365.433 4.063 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000411945054 1083929916 /nfs/dbraw/zinc/92/99/16/1083929916.db2.gz KCQZLRKOSADGDH-ZWKOTPCHSA-N 1 1 365.433 4.063 20 5 FIBDMO CC(C)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(Cl)c(Cl)c1 ZINC000472455325 1083969539 /nfs/dbraw/zinc/96/95/39/1083969539.db2.gz UEMDFTQKWPTCEH-UHFFFAOYSA-N 1 1 357.241 4.009 20 5 FIBDMO Cc1cnc(CC[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 ZINC000180058261 1084208071 /nfs/dbraw/zinc/20/80/71/1084208071.db2.gz CJBOLRJBVMRFOQ-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO CCOc1cc(C[N@@H+](Cc2ccccc2)[C@@H](CO)C(C)C)ccc1[N+](=O)[O-] ZINC001167529945 1084464212 /nfs/dbraw/zinc/46/42/12/1084464212.db2.gz WXAVADAKFLVSTB-FQEVSTJZSA-N 1 1 372.465 4.013 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccn(C)n1 ZINC000414169182 1084732229 /nfs/dbraw/zinc/73/22/29/1084732229.db2.gz ASDFNIONWDYHOQ-STQMWFEESA-N 1 1 356.451 4.469 20 5 FIBDMO CCc1ccc(C(=O)Nc2ccc(C[NH+](C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000478051614 1084750221 /nfs/dbraw/zinc/75/02/21/1084750221.db2.gz CCDNQSRPSRLERM-UHFFFAOYSA-N 1 1 361.829 4.125 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCCc2ccccc2C1 ZINC000106888026 1085238070 /nfs/dbraw/zinc/23/80/70/1085238070.db2.gz APWOBTTXECHSBE-AWEZNQCLSA-N 1 1 364.405 4.154 20 5 FIBDMO CC[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[C@H]1c1ccccc1 ZINC001167601537 1085422391 /nfs/dbraw/zinc/42/23/91/1085422391.db2.gz DHHDGDUOQIJPIH-CRAIPNDOSA-N 1 1 364.449 4.487 20 5 FIBDMO O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)c1 ZINC000472252736 1085616992 /nfs/dbraw/zinc/61/69/92/1085616992.db2.gz WHYPTTKRFOHNKG-INIZCTEOSA-N 1 1 368.359 4.037 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000178730748 1085967653 /nfs/dbraw/zinc/96/76/53/1085967653.db2.gz XWKMKYCLRHSDBT-NSHDSACASA-N 1 1 370.327 4.353 20 5 FIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052212654 1086450548 /nfs/dbraw/zinc/45/05/48/1086450548.db2.gz CNDAKQILZNSJCK-IBGZPJMESA-N 1 1 354.406 4.107 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000511978603 1086520327 /nfs/dbraw/zinc/52/03/27/1086520327.db2.gz NVUWDKQFCHEXGO-HNNXBMFYSA-N 1 1 356.422 4.024 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000472319500 1087295981 /nfs/dbraw/zinc/29/59/81/1087295981.db2.gz UWZFVVBRPQVOJE-RNODOKPDSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]1c1cccc(F)c1 ZINC000472319500 1087295988 /nfs/dbraw/zinc/29/59/88/1087295988.db2.gz UWZFVVBRPQVOJE-RNODOKPDSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000472319503 1087296151 /nfs/dbraw/zinc/29/61/51/1087296151.db2.gz UWZFVVBRPQVOJE-XCLFUZPHSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H]1c1cccc(F)c1 ZINC000472319503 1087296157 /nfs/dbraw/zinc/29/61/57/1087296157.db2.gz UWZFVVBRPQVOJE-XCLFUZPHSA-N 1 1 371.412 4.064 20 5 FIBDMO COc1ccc(F)cc1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189209369 1088453099 /nfs/dbraw/zinc/45/30/99/1088453099.db2.gz HCTVPKHVZHFDAR-UHFFFAOYSA-N 1 1 356.353 4.292 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(F)(c4ccccc4)CC3)nc2c1 ZINC000434496493 1088703376 /nfs/dbraw/zinc/70/33/76/1088703376.db2.gz IRMIURCAIBVKOG-UHFFFAOYSA-N 1 1 355.369 4.197 20 5 FIBDMO C[C@H](C[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000514085435 1088728344 /nfs/dbraw/zinc/72/83/44/1088728344.db2.gz VZDXNLSUUBKWMZ-MRXNPFEDSA-N 1 1 364.449 4.231 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC2(CCOCC2)[C@H]1c1ccccc1 ZINC000414566740 1088834524 /nfs/dbraw/zinc/83/45/24/1088834524.db2.gz XHVQIDRUEOOYBR-VMLCMGRWSA-N 1 1 364.445 4.462 20 5 FIBDMO C[C@H]([NH2+]C[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853297 1088883658 /nfs/dbraw/zinc/88/36/58/1088883658.db2.gz WHHCHDLKXLQKPI-LAUBAEHRSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H](NC[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853297 1088883681 /nfs/dbraw/zinc/88/36/81/1088883681.db2.gz WHHCHDLKXLQKPI-LAUBAEHRSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H](NC[C@@]1(C)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853297 1088883707 /nfs/dbraw/zinc/88/37/07/1088883707.db2.gz WHHCHDLKXLQKPI-LAUBAEHRSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H]([NH2+]C[C@@]1(C)CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000311853297 1088883729 /nfs/dbraw/zinc/88/37/29/1088883729.db2.gz WHHCHDLKXLQKPI-LAUBAEHRSA-N 1 1 353.466 4.158 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@H](C)C2CC2)cc1 ZINC000505526659 1089052826 /nfs/dbraw/zinc/05/28/26/1089052826.db2.gz ONSPCZULSRJRSJ-OAHLLOKOSA-N 1 1 370.449 4.413 20 5 FIBDMO Cc1ccccc1-c1cnc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000549170967 1089105068 /nfs/dbraw/zinc/10/50/68/1089105068.db2.gz LSEJAFJXQHALTF-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO Cc1ccccc1-c1cnc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000549170967 1089105079 /nfs/dbraw/zinc/10/50/79/1089105079.db2.gz LSEJAFJXQHALTF-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000549171146 1089110386 /nfs/dbraw/zinc/11/03/86/1089110386.db2.gz IKBWKZJFPYLZLK-HNNXBMFYSA-N 1 1 358.360 4.158 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000549171146 1089110394 /nfs/dbraw/zinc/11/03/94/1089110394.db2.gz IKBWKZJFPYLZLK-HNNXBMFYSA-N 1 1 358.360 4.158 20 5 FIBDMO CCc1ccc(C[N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000505590899 1089217107 /nfs/dbraw/zinc/21/71/07/1089217107.db2.gz PQDIHAFNPOTCIZ-UHFFFAOYSA-N 1 1 364.449 4.190 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](Cc4ccccc4)C3)nc2c1 ZINC000435048631 1089236644 /nfs/dbraw/zinc/23/66/44/1089236644.db2.gz JHHFCSUDCPRAOQ-MRXNPFEDSA-N 1 1 351.406 4.191 20 5 FIBDMO C[N@@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H]1CCCOC1 ZINC000514972104 1089677632 /nfs/dbraw/zinc/67/76/32/1089677632.db2.gz GKIPKWOSDALJHB-INIZCTEOSA-N 1 1 360.385 4.137 20 5 FIBDMO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])c1ccccc1-n1cccn1 ZINC000119730269 1089687441 /nfs/dbraw/zinc/68/74/41/1089687441.db2.gz JHKADJOKRYYISH-ZDUSSCGKSA-N 1 1 356.813 4.285 20 5 FIBDMO Cc1c([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000101595790 1089806641 /nfs/dbraw/zinc/80/66/41/1089806641.db2.gz JFZSCVNQFPTDLS-ZDUSSCGKSA-N 1 1 354.385 4.079 20 5 FIBDMO C[N@@H+](CC1CC1)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000053183763 1090357744 /nfs/dbraw/zinc/35/77/44/1090357744.db2.gz ORNNZXMWLOBQPP-GOSISDBHSA-N 1 1 373.840 4.270 20 5 FIBDMO CCN(CCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000110267008 1090383252 /nfs/dbraw/zinc/38/32/52/1090383252.db2.gz YBBUMHJIRJZELJ-AVRDEDQJSA-N 1 1 367.493 4.295 20 5 FIBDMO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000110267008 1090383256 /nfs/dbraw/zinc/38/32/56/1090383256.db2.gz YBBUMHJIRJZELJ-AVRDEDQJSA-N 1 1 367.493 4.295 20 5 FIBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000110267008 1090383263 /nfs/dbraw/zinc/38/32/63/1090383263.db2.gz YBBUMHJIRJZELJ-AVRDEDQJSA-N 1 1 367.493 4.295 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511628926 1090894870 /nfs/dbraw/zinc/89/48/70/1090894870.db2.gz ZJEPIBOJURBXQU-SFHVURJKSA-N 1 1 373.840 4.332 20 5 FIBDMO Cc1ccc([C@@H]2CCCCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])o1 ZINC000500074789 1091023815 /nfs/dbraw/zinc/02/38/15/1091023815.db2.gz NCNQOOIWYDXSPI-SFHVURJKSA-N 1 1 371.437 4.442 20 5 FIBDMO C[C@@H](c1ccccc1)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000500092210 1091033681 /nfs/dbraw/zinc/03/36/81/1091033681.db2.gz VMBAOLGOJJIGAY-HNNXBMFYSA-N 1 1 353.422 4.149 20 5 FIBDMO O=C(CC[N@@H+](Cc1ccoc1)C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000500129626 1091056120 /nfs/dbraw/zinc/05/61/20/1091056120.db2.gz OLBBNVMHVHSMAN-UHFFFAOYSA-N 1 1 371.437 4.351 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 ZINC000511759282 1091626477 /nfs/dbraw/zinc/62/64/77/1091626477.db2.gz TUVXCFMSSPSRMK-HHXXYDBFSA-N 1 1 372.852 4.253 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccc(F)cc2)n[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC000110903363 1091709885 /nfs/dbraw/zinc/70/98/85/1091709885.db2.gz GFIBTPGKLZMDRO-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1N1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000432165297 1091774538 /nfs/dbraw/zinc/77/45/38/1091774538.db2.gz SHFOQBMYJCJNCR-ZDUSSCGKSA-N 1 1 360.845 4.165 20 5 FIBDMO C[C@@H](c1ccccc1)[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000512291216 1092012399 /nfs/dbraw/zinc/01/23/99/1092012399.db2.gz GGZXASIUXSRPLA-AWEZNQCLSA-N 1 1 364.405 4.370 20 5 FIBDMO C[C@@H](c1ccccc1)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000512291216 1092012405 /nfs/dbraw/zinc/01/24/05/1092012405.db2.gz GGZXASIUXSRPLA-AWEZNQCLSA-N 1 1 364.405 4.370 20 5 FIBDMO C[NH+](C)C1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCC1 ZINC000520954145 1092379348 /nfs/dbraw/zinc/37/93/48/1092379348.db2.gz BWVBOCOENOSCLV-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Oc2ccc(C)c(C)c2)CC1 ZINC000521425524 1092691322 /nfs/dbraw/zinc/69/13/22/1092691322.db2.gz CCMFEOPMSKNCMX-UHFFFAOYSA-N 1 1 370.449 4.264 20 5 FIBDMO C[N@@H+]1CCC[C@H](CN[C@H]2CCc3c2cccc3[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000522013409 1093029437 /nfs/dbraw/zinc/02/94/37/1093029437.db2.gz GPWFEEFNVUBUOT-CFLQYTFWSA-N 1 1 371.506 4.316 20 5 FIBDMO C[N@H+]1CCC[C@H](CN[C@H]2CCc3c2cccc3[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000522013409 1093029483 /nfs/dbraw/zinc/02/94/83/1093029483.db2.gz GPWFEEFNVUBUOT-CFLQYTFWSA-N 1 1 371.506 4.316 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ncc(C)s2)CC1 ZINC000433034762 1093145158 /nfs/dbraw/zinc/14/51/58/1093145158.db2.gz UHHVXNDFPUCPFG-UHFFFAOYSA-N 1 1 361.467 4.138 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000433063615 1093173773 /nfs/dbraw/zinc/17/37/73/1093173773.db2.gz YJIMIRVRUPQJPS-GOSISDBHSA-N 1 1 367.449 4.111 20 5 FIBDMO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)on1 ZINC000509780193 1093281742 /nfs/dbraw/zinc/28/17/42/1093281742.db2.gz CJODGXVSAADYET-QGZVFWFLSA-N 1 1 353.378 4.488 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000439316098 1093328987 /nfs/dbraw/zinc/32/89/87/1093328987.db2.gz JDLMFIYTPAWNAH-ZBFHGGJFSA-N 1 1 350.422 4.239 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000439316098 1093328994 /nfs/dbraw/zinc/32/89/94/1093328994.db2.gz JDLMFIYTPAWNAH-ZBFHGGJFSA-N 1 1 350.422 4.239 20 5 FIBDMO CC1(C)C[C@@H]([NH2+]Cc2cn3cc(Cl)ccc3n2)c2cc([N+](=O)[O-])ccc21 ZINC000433150540 1093332198 /nfs/dbraw/zinc/33/21/98/1093332198.db2.gz LUCUINMXAHDBKA-QGZVFWFLSA-N 1 1 370.840 4.408 20 5 FIBDMO Cc1ccnc(NCc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1[N+](=O)[O-] ZINC000522417560 1093548435 /nfs/dbraw/zinc/54/84/35/1093548435.db2.gz BFPZGCLRZPOPKH-HNNXBMFYSA-N 1 1 354.454 4.142 20 5 FIBDMO COc1ccc2nc(C[NH2+]C(C)(C)c3ccc([N+](=O)[O-])cc3)sc2c1 ZINC000474356583 1093707426 /nfs/dbraw/zinc/70/74/26/1093707426.db2.gz ROYQAGKXVGFDLU-UHFFFAOYSA-N 1 1 357.435 4.238 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000397991350 1093799202 /nfs/dbraw/zinc/79/92/02/1093799202.db2.gz ASGUQIKSZWTBSC-BBTUJRGHSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000397991350 1093799209 /nfs/dbraw/zinc/79/92/09/1093799209.db2.gz ASGUQIKSZWTBSC-BBTUJRGHSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000397991352 1093800047 /nfs/dbraw/zinc/80/00/47/1093800047.db2.gz ASGUQIKSZWTBSC-LVCYWYKZSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000397991352 1093800055 /nfs/dbraw/zinc/80/00/55/1093800055.db2.gz ASGUQIKSZWTBSC-LVCYWYKZSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]([C@@H](C)c1ccco1)C1CC1 ZINC000086234964 1093894394 /nfs/dbraw/zinc/89/43/94/1093894394.db2.gz PNYGBLRTTGCPRR-AWEZNQCLSA-N 1 1 357.410 4.050 20 5 FIBDMO Cc1cccc(C2=CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000500976220 1093900799 /nfs/dbraw/zinc/90/07/99/1093900799.db2.gz IVYCDUFDKQETLM-UHFFFAOYSA-N 1 1 365.433 4.021 20 5 FIBDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000151133722 1093916054 /nfs/dbraw/zinc/91/60/54/1093916054.db2.gz JLJILTPNABKQCR-HNNXBMFYSA-N 1 1 366.421 4.016 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513247153 1094033920 /nfs/dbraw/zinc/03/39/20/1094033920.db2.gz KLJNWGKVBREEKH-MGPUTAFESA-N 1 1 367.449 4.315 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000513256910 1094040175 /nfs/dbraw/zinc/04/01/75/1094040175.db2.gz OKOGUIDEMRCSBI-KSSFIOAISA-N 1 1 364.405 4.228 20 5 FIBDMO CCC[C@H]([NH2+]Cc1ccn(-c2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000163193391 1094718510 /nfs/dbraw/zinc/71/85/10/1094718510.db2.gz HLVUDOJVSVLRIK-FQEVSTJZSA-N 1 1 350.422 4.412 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H](O)CC34CCC4)s2)cc1 ZINC000421380271 1095579331 /nfs/dbraw/zinc/57/93/31/1095579331.db2.gz YBTKKNCLYMBJAC-MRXNPFEDSA-N 1 1 358.463 4.203 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCCC[C@@H]3c3ccco3)n2)c1 ZINC000121231675 1095718624 /nfs/dbraw/zinc/71/86/24/1095718624.db2.gz KPBCBCWCUSRLAT-MRXNPFEDSA-N 1 1 368.393 4.355 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCCC[C@@H]3c3ccco3)n2)c1 ZINC000121231675 1095718634 /nfs/dbraw/zinc/71/86/34/1095718634.db2.gz KPBCBCWCUSRLAT-MRXNPFEDSA-N 1 1 368.393 4.355 20 5 FIBDMO COCC[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccco1 ZINC000503944691 1096604934 /nfs/dbraw/zinc/60/49/34/1096604934.db2.gz KZKPPAWLKHXINN-KRWDZBQOSA-N 1 1 356.378 4.315 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000533400047 1099008956 /nfs/dbraw/zinc/00/89/56/1099008956.db2.gz CRYUEYVEJZMEJS-SFHVURJKSA-N 1 1 367.449 4.111 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1 ZINC000533438753 1099042903 /nfs/dbraw/zinc/04/29/03/1099042903.db2.gz OYDKAOHLGOBCOR-DLBZAZTESA-N 1 1 367.449 4.028 20 5 FIBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000506100656 1100080790 /nfs/dbraw/zinc/08/07/90/1100080790.db2.gz FSPZKWKSNDJGMO-QGZVFWFLSA-N 1 1 354.406 4.012 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 ZINC000459653836 1100396142 /nfs/dbraw/zinc/39/61/42/1100396142.db2.gz DMSAQAWKKGDCQQ-CJNGLKHVSA-N 1 1 372.387 4.337 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@@H+]1CCCC[C@@H]1C ZINC000517535987 1100473530 /nfs/dbraw/zinc/47/35/30/1100473530.db2.gz SDRQPFVVYTVTAP-HOTGVXAUSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@H+]1CCCC[C@@H]1C ZINC000517535987 1100473538 /nfs/dbraw/zinc/47/35/38/1100473538.db2.gz SDRQPFVVYTVTAP-HOTGVXAUSA-N 1 1 357.454 4.207 20 5 FIBDMO C[N@@H+](CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CCCC1 ZINC000518275267 1101057809 /nfs/dbraw/zinc/05/78/09/1101057809.db2.gz BWUQWEJNHSOYQT-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO CN(CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CCCC1 ZINC000518275267 1101057819 /nfs/dbraw/zinc/05/78/19/1101057819.db2.gz BWUQWEJNHSOYQT-UHFFFAOYSA-N 1 1 359.495 4.287 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000459673166 1101313064 /nfs/dbraw/zinc/31/30/64/1101313064.db2.gz IYPHICAPMVVODH-MSOLQXFVSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000439329449 1101351795 /nfs/dbraw/zinc/35/17/95/1101351795.db2.gz VHWPAHPFQGTXGK-SJLPKXTDSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000439329449 1101351811 /nfs/dbraw/zinc/35/18/11/1101351811.db2.gz VHWPAHPFQGTXGK-SJLPKXTDSA-N 1 1 367.449 4.110 20 5 FIBDMO COC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1ccc(F)c(F)c1 ZINC000536995163 1101376830 /nfs/dbraw/zinc/37/68/30/1101376830.db2.gz RVPMTXUZJNOUBW-SGTLLEGYSA-N 1 1 350.365 4.220 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000537078613 1101444095 /nfs/dbraw/zinc/44/40/95/1101444095.db2.gz MFDAECNINURFKC-HNNXBMFYSA-N 1 1 354.328 4.387 20 5 FIBDMO CCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC(=O)Nc1ccccc1C ZINC000506773456 1102063963 /nfs/dbraw/zinc/06/39/63/1102063963.db2.gz DTCBSHGKJWNETH-DHZHZOJOSA-N 1 1 367.449 4.267 20 5 FIBDMO CCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC(=O)Nc1ccccc1C ZINC000506773456 1102063974 /nfs/dbraw/zinc/06/39/74/1102063974.db2.gz DTCBSHGKJWNETH-DHZHZOJOSA-N 1 1 367.449 4.267 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])cc2)C1 ZINC000121842518 1102254916 /nfs/dbraw/zinc/25/49/16/1102254916.db2.gz BCZVQQPPDCQMMP-CQSZACIVSA-N 1 1 371.412 4.218 20 5 FIBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000052907871 1102346562 /nfs/dbraw/zinc/34/65/62/1102346562.db2.gz IYNFMQIVRVFAQS-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 ZINC000052907871 1102346568 /nfs/dbraw/zinc/34/65/68/1102346568.db2.gz IYNFMQIVRVFAQS-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCCC[C@@H]12 ZINC000532470959 1102389279 /nfs/dbraw/zinc/38/92/79/1102389279.db2.gz DAJAMLNMTFTHSG-COXVUDFISA-N 1 1 356.426 4.045 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCCC[C@H]12 ZINC000532470967 1102389862 /nfs/dbraw/zinc/38/98/62/1102389862.db2.gz DAJAMLNMTFTHSG-KBRIMQKVSA-N 1 1 356.426 4.045 20 5 FIBDMO Cc1ccc([C@H]2CCCCC[N@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000532570706 1102493412 /nfs/dbraw/zinc/49/34/12/1102493412.db2.gz CCKALSRZPAMOSJ-GOSISDBHSA-N 1 1 371.437 4.076 20 5 FIBDMO Cc1ccc([C@H]2CCCCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000532570706 1102493424 /nfs/dbraw/zinc/49/34/24/1102493424.db2.gz CCKALSRZPAMOSJ-GOSISDBHSA-N 1 1 371.437 4.076 20 5 FIBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000532586891 1102506266 /nfs/dbraw/zinc/50/62/66/1102506266.db2.gz YENBFVMFWNIRRQ-QGZVFWFLSA-N 1 1 366.421 4.098 20 5 FIBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000507008466 1103031101 /nfs/dbraw/zinc/03/11/01/1103031101.db2.gz UCPXSOKTUMSEHW-DOTOQJQBSA-N 1 1 362.433 4.390 20 5 FIBDMO Cc1ccccc1[C@@H]1CC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000507166508 1103167093 /nfs/dbraw/zinc/16/70/93/1103167093.db2.gz WYROIMAINLSXIE-QGZVFWFLSA-N 1 1 367.449 4.030 20 5 FIBDMO C[C@H]1CC[N@@H+]([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)C1 ZINC000507185393 1103185396 /nfs/dbraw/zinc/18/53/96/1103185396.db2.gz XICZRFJIDJZYGS-UGSOOPFHSA-N 1 1 373.840 4.270 20 5 FIBDMO C[C@H]1CC[N@H+]([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)C1 ZINC000507185393 1103185403 /nfs/dbraw/zinc/18/54/03/1103185403.db2.gz XICZRFJIDJZYGS-UGSOOPFHSA-N 1 1 373.840 4.270 20 5 FIBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000507189673 1103205578 /nfs/dbraw/zinc/20/55/78/1103205578.db2.gz WENWERGIHJRIGV-MRXNPFEDSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000507189673 1103205591 /nfs/dbraw/zinc/20/55/91/1103205591.db2.gz WENWERGIHJRIGV-MRXNPFEDSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1cccc([C@@H](C)[NH+]2CCN([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000507750422 1104731408 /nfs/dbraw/zinc/73/14/08/1104731408.db2.gz WSEGSVVZVZVMBL-IAGOWNOFSA-N 1 1 369.465 4.043 20 5 FIBDMO COc1cccc([C@@H](C)[NH+]2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000507750419 1104731605 /nfs/dbraw/zinc/73/16/05/1104731605.db2.gz WSEGSVVZVZVMBL-DLBZAZTESA-N 1 1 369.465 4.043 20 5 FIBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(OC(F)(F)F)cc1 ZINC000182516966 1105214227 /nfs/dbraw/zinc/21/42/27/1105214227.db2.gz OGBPORWZLDDKQE-JTQLQIEISA-N 1 1 358.291 4.483 20 5 FIBDMO C[C@]1(O)CCCC[C@H]1[C@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000450958330 1106844372 /nfs/dbraw/zinc/84/43/72/1106844372.db2.gz MVSKJDFDIGYJGA-QGTPRVQTSA-N 1 1 352.862 4.154 20 5 FIBDMO CCOC(=O)c1oc2ccccc2c1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451109708 1106927260 /nfs/dbraw/zinc/92/72/60/1106927260.db2.gz YLNJVOKLUXXBNX-ZDUSSCGKSA-N 1 1 368.389 4.369 20 5 FIBDMO C[C@@H]1Cc2[nH+]cn(CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)c2C[C@H]1C ZINC000451341544 1107042703 /nfs/dbraw/zinc/04/27/03/1107042703.db2.gz MFMMEYRRPQBKLG-ZIAGYGMSSA-N 1 1 366.421 4.060 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530522898 1107102618 /nfs/dbraw/zinc/10/26/18/1107102618.db2.gz UNEKZONFAOGVHV-PKOBYXMFSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000530522898 1107102620 /nfs/dbraw/zinc/10/26/20/1107102620.db2.gz UNEKZONFAOGVHV-PKOBYXMFSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCN(Cc2ccccc2)C1 ZINC000530522898 1107102622 /nfs/dbraw/zinc/10/26/22/1107102622.db2.gz UNEKZONFAOGVHV-PKOBYXMFSA-N 1 1 353.466 4.076 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3nc(-c4cccs4)no3)C2)cc1 ZINC000451555494 1107173788 /nfs/dbraw/zinc/17/37/88/1107173788.db2.gz BTICLNKXRNGUHE-AWEZNQCLSA-N 1 1 370.434 4.086 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc(-c4cccs4)no3)C2)cc1 ZINC000451555494 1107173804 /nfs/dbraw/zinc/17/38/04/1107173804.db2.gz BTICLNKXRNGUHE-AWEZNQCLSA-N 1 1 370.434 4.086 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000451856728 1107345788 /nfs/dbraw/zinc/34/57/88/1107345788.db2.gz PVRAGHJMBZJKIY-IBGZPJMESA-N 1 1 369.421 4.052 20 5 FIBDMO Cc1ccc(C)c([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 ZINC001168133630 1107395916 /nfs/dbraw/zinc/39/59/16/1107395916.db2.gz DBUSBYYIARFVRI-GOSISDBHSA-N 1 1 355.394 4.457 20 5 FIBDMO Cc1nc2ccccc2n1C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000475516087 1107665063 /nfs/dbraw/zinc/66/50/63/1107665063.db2.gz INNYOMTXMXYEEC-UHFFFAOYSA-N 1 1 356.451 4.152 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[C@H]1c1ccccc1 ZINC000444651929 1108048545 /nfs/dbraw/zinc/04/85/45/1108048545.db2.gz QKKTYNAHAGSCQD-WMLDXEAASA-N 1 1 350.422 4.097 20 5 FIBDMO Cc1ccc(C[N@@H+](CCO)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)o1 ZINC000475624270 1108575444 /nfs/dbraw/zinc/57/54/44/1108575444.db2.gz JAEPTVRCQXRGLT-UHFFFAOYSA-N 1 1 372.446 4.219 20 5 FIBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000038039039 1108601424 /nfs/dbraw/zinc/60/14/24/1108601424.db2.gz VYGICAAMIJGNKU-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000532166420 1108691616 /nfs/dbraw/zinc/69/16/16/1108691616.db2.gz ZZZWKIUFVAXFGC-OAHLLOKOSA-N 1 1 351.516 4.133 20 5 FIBDMO COc1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2C)C[C@@H]2CCCO2)c1 ZINC000520392055 1108693718 /nfs/dbraw/zinc/69/37/18/1108693718.db2.gz IFXDAHOUVSDSKO-FQEVSTJZSA-N 1 1 370.449 4.093 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000524036590 1108766217 /nfs/dbraw/zinc/76/62/17/1108766217.db2.gz DYVUKQFVJBRSEN-IFXJQAMLSA-N 1 1 358.463 4.282 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCS[C@@H](C)[C@@H]1c1ccccc1 ZINC000524036590 1108766224 /nfs/dbraw/zinc/76/62/24/1108766224.db2.gz DYVUKQFVJBRSEN-IFXJQAMLSA-N 1 1 358.463 4.282 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(CNc3ncc([N+](=O)[O-])cc3Cl)cc2)C1 ZINC000524581016 1109085034 /nfs/dbraw/zinc/08/50/34/1109085034.db2.gz BMANDMXKADKYBP-AWEZNQCLSA-N 1 1 374.872 4.487 20 5 FIBDMO C[C@@H](O)C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000441234958 1109504498 /nfs/dbraw/zinc/50/44/98/1109504498.db2.gz RMEHUYASLXRPKS-QWHCGFSZSA-N 1 1 368.886 4.124 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H]1CCCC[C@H]1O ZINC000428489416 1109579956 /nfs/dbraw/zinc/57/99/56/1109579956.db2.gz VMJFHVFRIHKKQW-IAGOWNOFSA-N 1 1 364.829 4.244 20 5 FIBDMO COc1cc(C[NH+]2[C@@H](C)C[C@@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000526989469 1109660997 /nfs/dbraw/zinc/66/09/97/1109660997.db2.gz HOORTPGIUCSPJB-GJZGRUSLSA-N 1 1 356.422 4.165 20 5 FIBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000449227628 1110002851 /nfs/dbraw/zinc/00/28/51/1110002851.db2.gz PUSNKFVVKWAZFU-OPYAIIAOSA-N 1 1 367.493 4.026 20 5 FIBDMO COc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(Br)c1 ZINC000449348639 1110036874 /nfs/dbraw/zinc/03/68/74/1110036874.db2.gz MNXGISSTXPYOTK-NSHDSACASA-N 1 1 365.227 4.217 20 5 FIBDMO CC(C)c1ccc(C[NH2+]Cc2cccc(C(F)(F)F)n2)cc1[N+](=O)[O-] ZINC000449404120 1110059340 /nfs/dbraw/zinc/05/93/40/1110059340.db2.gz YRXNWURZSOAGGA-UHFFFAOYSA-N 1 1 353.344 4.422 20 5 FIBDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2nccn21 ZINC000449572349 1110114042 /nfs/dbraw/zinc/11/40/42/1110114042.db2.gz NAJHEMJSHAVGSM-WBMJQRKESA-N 1 1 354.435 4.315 20 5 FIBDMO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2nccn21 ZINC000449572346 1110114599 /nfs/dbraw/zinc/11/45/99/1110114599.db2.gz NAJHEMJSHAVGSM-BLLLJJGKSA-N 1 1 354.435 4.315 20 5 FIBDMO CCc1ncc(C[NH2+]Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)o1 ZINC000449608034 1110121853 /nfs/dbraw/zinc/12/18/53/1110121853.db2.gz DLKJBFMCKWGUOB-UHFFFAOYSA-N 1 1 366.421 4.203 20 5 FIBDMO CC[C@H]([NH2+]Cc1cccc(C(=O)OC)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000450680793 1110329050 /nfs/dbraw/zinc/32/90/50/1110329050.db2.gz LLQYSMLVIFVSRM-INIZCTEOSA-N 1 1 362.813 4.276 20 5 FIBDMO CO[C@H]1CC[N@H+](Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)C1 ZINC000538727641 1111264961 /nfs/dbraw/zinc/26/49/61/1111264961.db2.gz JXQZDGVVZBREOO-AWEZNQCLSA-N 1 1 362.813 4.261 20 5 FIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)C1 ZINC000538727641 1111264964 /nfs/dbraw/zinc/26/49/64/1111264964.db2.gz JXQZDGVVZBREOO-AWEZNQCLSA-N 1 1 362.813 4.261 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000538730442 1111267245 /nfs/dbraw/zinc/26/72/45/1111267245.db2.gz LGHIFMZEQSASAG-HNNXBMFYSA-N 1 1 356.422 4.167 20 5 FIBDMO C[C@@H]1CC[N@@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538739505 1111272768 /nfs/dbraw/zinc/27/27/68/1111272768.db2.gz QQJIBJCHWANVTE-CYBMUJFWSA-N 1 1 363.845 4.034 20 5 FIBDMO C[C@@H]1CCN(C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538739505 1111272770 /nfs/dbraw/zinc/27/27/70/1111272770.db2.gz QQJIBJCHWANVTE-CYBMUJFWSA-N 1 1 363.845 4.034 20 5 FIBDMO C[C@@H]1CCN(C)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538739505 1111272772 /nfs/dbraw/zinc/27/27/72/1111272772.db2.gz QQJIBJCHWANVTE-CYBMUJFWSA-N 1 1 363.845 4.034 20 5 FIBDMO CCOC[C@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000538761535 1111289270 /nfs/dbraw/zinc/28/92/70/1111289270.db2.gz JWAWCIFNMPXZCP-SFHVURJKSA-N 1 1 369.465 4.221 20 5 FIBDMO CS[C@@H]1CCCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000538799859 1111297148 /nfs/dbraw/zinc/29/71/48/1111297148.db2.gz ZLHULVVTEUPUCT-MRXNPFEDSA-N 1 1 363.508 4.436 20 5 FIBDMO CC(C)=CC[NH2+][C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000479484176 1112040511 /nfs/dbraw/zinc/04/05/11/1112040511.db2.gz ZPJXUVZIUFANFS-SFHVURJKSA-N 1 1 373.840 4.484 20 5 FIBDMO COc1cc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(F)cn1 ZINC000554094678 1112191457 /nfs/dbraw/zinc/19/14/57/1112191457.db2.gz JMBKUUITQKOXPY-VIFPVBQESA-N 1 1 373.306 4.007 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+][C@H](CN2CCCC2)c2ccccc2)cc1[N+](=O)[O-] ZINC000480282585 1112372869 /nfs/dbraw/zinc/37/28/69/1112372869.db2.gz XLMXYIKAELHJDX-FXAWDEMLSA-N 1 1 353.466 4.391 20 5 FIBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000480410275 1112416767 /nfs/dbraw/zinc/41/67/67/1112416767.db2.gz ZPRAFICGMAHQLM-WBVHZDCISA-N 1 1 362.433 4.390 20 5 FIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C[C@@H]1CCCO1 ZINC000482302982 1113220757 /nfs/dbraw/zinc/22/07/57/1113220757.db2.gz ZVWNXQAYQIPUKC-ZDUSSCGKSA-N 1 1 350.802 4.119 20 5 FIBDMO CC[C@H](NC[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482435450 1113253845 /nfs/dbraw/zinc/25/38/45/1113253845.db2.gz HQUPOFQNFDMJRS-KNQAVFIVSA-N 1 1 367.493 4.200 20 5 FIBDMO CC[C@H](NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000482435450 1113253853 /nfs/dbraw/zinc/25/38/53/1113253853.db2.gz HQUPOFQNFDMJRS-KNQAVFIVSA-N 1 1 367.493 4.200 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CSc3ccc(Br)cc32)cc1 ZINC000486805523 1113654434 /nfs/dbraw/zinc/65/44/34/1113654434.db2.gz XGJMROHYQUHKCJ-AWEZNQCLSA-N 1 1 365.252 4.294 20 5 FIBDMO CCC[C@H]([NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000129293989 1113822788 /nfs/dbraw/zinc/82/27/88/1113822788.db2.gz DIAHPWNGIVAGEF-IRXDYDNUSA-N 1 1 353.426 4.220 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000488044515 1113846193 /nfs/dbraw/zinc/84/61/93/1113846193.db2.gz PWQVIAGKIKJFPO-HZPDHXFCSA-N 1 1 353.422 4.007 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2CC2CCCCC2)c2c(c1)COCO2 ZINC000488406037 1113920565 /nfs/dbraw/zinc/92/05/65/1113920565.db2.gz WKJRESVPVXXGKR-SFHVURJKSA-N 1 1 360.454 4.396 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c(F)c1 ZINC000586766784 1114389246 /nfs/dbraw/zinc/38/92/46/1114389246.db2.gz CVWJHQMHPCUWIA-LBPRGKRZSA-N 1 1 373.359 4.394 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)c(F)c1 ZINC000586766784 1114389250 /nfs/dbraw/zinc/38/92/50/1114389250.db2.gz CVWJHQMHPCUWIA-LBPRGKRZSA-N 1 1 373.359 4.394 20 5 FIBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000164797905 1114585358 /nfs/dbraw/zinc/58/53/58/1114585358.db2.gz ZLRZNQKDKJPUFP-QGZVFWFLSA-N 1 1 373.478 4.303 20 5 FIBDMO CCN(Cc1csc([N+](=O)[O-])c1)[C@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000249702767 1114590137 /nfs/dbraw/zinc/59/01/37/1114590137.db2.gz DUOCUOHNQXIJPK-QAPCUYQASA-N 1 1 359.495 4.314 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c1 ZINC000590170154 1114907282 /nfs/dbraw/zinc/90/72/82/1114907282.db2.gz AZPZYVKIFGTACT-UONOGXRCSA-N 1 1 372.387 4.252 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c1 ZINC000590170151 1114907375 /nfs/dbraw/zinc/90/73/75/1114907375.db2.gz AZPZYVKIFGTACT-KBPBESRZSA-N 1 1 372.387 4.252 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3cccc(Cl)c3)CCC2)c2c(c1)COCO2 ZINC000592183412 1115220983 /nfs/dbraw/zinc/22/09/83/1115220983.db2.gz IJQOQCKGMGMDPX-UHFFFAOYSA-N 1 1 374.824 4.284 20 5 FIBDMO CC(=O)Nc1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3C)cc2)cc1[N+](=O)[O-] ZINC000592985988 1115278399 /nfs/dbraw/zinc/27/83/99/1115278399.db2.gz JWTSHAQROZJHMF-AWEZNQCLSA-N 1 1 353.422 4.205 20 5 FIBDMO Cc1ccc(-c2nn(C)cc2C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000592497730 1115329652 /nfs/dbraw/zinc/32/96/52/1115329652.db2.gz AGGVXXQDHDILGQ-UHFFFAOYSA-N 1 1 366.421 4.061 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000226514732 1115391791 /nfs/dbraw/zinc/39/17/91/1115391791.db2.gz URCZDPZBQYBLHH-AAEUAGOBSA-N 1 1 363.767 4.306 20 5 FIBDMO COc1cncc(/C=C/CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000574515297 1115416840 /nfs/dbraw/zinc/41/68/40/1115416840.db2.gz VRWUFGWOAKYONI-GQCTYLIASA-N 1 1 353.422 4.066 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](c1ccccc1)[C@H]1CCCO1 ZINC000595011240 1115503334 /nfs/dbraw/zinc/50/33/34/1115503334.db2.gz CPUOKVPAXLBDSD-BOUXLOLZSA-N 1 1 356.422 4.174 20 5 FIBDMO CCCOc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1OC ZINC000595007840 1115507768 /nfs/dbraw/zinc/50/77/68/1115507768.db2.gz PTGUEGFCHNDDRX-CQSZACIVSA-N 1 1 374.437 4.252 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccccc1OCC1CC1 ZINC000595008666 1115508011 /nfs/dbraw/zinc/50/80/11/1115508011.db2.gz PRALPDGMAZOESS-AWEZNQCLSA-N 1 1 356.422 4.243 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000595007511 1115508028 /nfs/dbraw/zinc/50/80/28/1115508028.db2.gz LHYSPTXROJGEMH-INIZCTEOSA-N 1 1 371.481 4.294 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000595007511 1115508031 /nfs/dbraw/zinc/50/80/31/1115508031.db2.gz LHYSPTXROJGEMH-INIZCTEOSA-N 1 1 371.481 4.294 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCOc2c(Cl)cccc21 ZINC000595008677 1115508048 /nfs/dbraw/zinc/50/80/48/1115508048.db2.gz QNINEJLPUMONRZ-ZBEGNZNMSA-N 1 1 362.813 4.431 20 5 FIBDMO Cc1noc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)c1[N+](=O)[O-] ZINC000595416358 1115534898 /nfs/dbraw/zinc/53/48/98/1115534898.db2.gz VVEUFHVPJUNUTA-AWEZNQCLSA-N 1 1 357.332 4.397 20 5 FIBDMO Cc1noc(C[N@H+]2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)c1[N+](=O)[O-] ZINC000595484956 1115536851 /nfs/dbraw/zinc/53/68/51/1115536851.db2.gz PUCPHTSGMIBJNP-ZDUSSCGKSA-N 1 1 369.343 4.290 20 5 FIBDMO COc1ccc(CN(C)[C@H](C)c2nc3ccc(Cl)cc3[nH]2)cc1[N+](=O)[O-] ZINC000595514159 1115539415 /nfs/dbraw/zinc/53/94/15/1115539415.db2.gz AYEMYQPSTUEOAO-LLVKDONJSA-N 1 1 374.828 4.326 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC000595838768 1115563904 /nfs/dbraw/zinc/56/39/04/1115563904.db2.gz WATDTMOTTAKMJM-CZUORRHYSA-N 1 1 356.426 4.218 20 5 FIBDMO Cc1c([C@H](C)[NH2+][C@H]2CCc3ccccc3-n3ccnc32)cccc1[N+](=O)[O-] ZINC000596095276 1115574201 /nfs/dbraw/zinc/57/42/01/1115574201.db2.gz OOSDZSDTZMQNSG-YJBOKZPZSA-N 1 1 362.433 4.427 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+](CCCO)[C@H]2CCc3ccccc32)ccc1Cl ZINC000761249156 1115701961 /nfs/dbraw/zinc/70/19/61/1115701961.db2.gz HLPSZYVWWXVMGT-SFHVURJKSA-N 1 1 360.841 4.120 20 5 FIBDMO CC(C)n1cc([C@H](C)[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)cn1 ZINC000602560064 1115710835 /nfs/dbraw/zinc/71/08/35/1115710835.db2.gz BAEWYBVABAIBCU-VIFPVBQESA-N 1 1 373.276 4.047 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H](CO)CC3)o2)c(Cl)c1 ZINC000560627323 1115715336 /nfs/dbraw/zinc/71/53/36/1115715336.db2.gz FVYQIXFASVRDEJ-ZDUSSCGKSA-N 1 1 364.829 4.103 20 5 FIBDMO COc1ccc([C@H]2CCC[N@@H+]2Cn2nc(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000761276413 1115723767 /nfs/dbraw/zinc/72/37/67/1115723767.db2.gz WZEVYKGOMPAXLC-LJQANCHMSA-N 1 1 366.421 4.056 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2Cn2nc(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000761276413 1115723771 /nfs/dbraw/zinc/72/37/71/1115723771.db2.gz WZEVYKGOMPAXLC-LJQANCHMSA-N 1 1 366.421 4.056 20 5 FIBDMO C[N@H+]1CCCC[C@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000599070731 1115787074 /nfs/dbraw/zinc/78/70/74/1115787074.db2.gz OGHJDWFKUBQJPS-DYESRHJHSA-N 1 1 353.466 4.006 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] ZINC000603838839 1115818276 /nfs/dbraw/zinc/81/82/76/1115818276.db2.gz OLMHLGDMGCFWMR-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2ccccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000603840930 1115822562 /nfs/dbraw/zinc/82/25/62/1115822562.db2.gz OHPWLLGGLABOJK-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO COc1ccc(C[N@@H+](C)CCCOc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000603867281 1115823691 /nfs/dbraw/zinc/82/36/91/1115823691.db2.gz OEEZHJAXAWMQBD-UHFFFAOYSA-N 1 1 364.829 4.158 20 5 FIBDMO COc1ccc(C[N@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cc1[N+](=O)[O-] ZINC000603889938 1115826647 /nfs/dbraw/zinc/82/66/47/1115826647.db2.gz GNDSAHZKXMOTNO-QGZVFWFLSA-N 1 1 365.433 4.464 20 5 FIBDMO C/C=C/C[C@@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599689600 1115836319 /nfs/dbraw/zinc/83/63/19/1115836319.db2.gz JZYKUYLKBPCGIW-NMONBKHDSA-N 1 1 356.426 4.384 20 5 FIBDMO COc1ccccc1C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000604013538 1115840746 /nfs/dbraw/zinc/84/07/46/1115840746.db2.gz OLPMQNCMXHWRHS-UHFFFAOYSA-N 1 1 356.422 4.037 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccccc1C ZINC000063524687 1116077945 /nfs/dbraw/zinc/07/79/45/1116077945.db2.gz CFEHUGCNKXSSKK-HXUWFJFHSA-N 1 1 367.449 4.377 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000063522305 1116078028 /nfs/dbraw/zinc/07/80/28/1116078028.db2.gz QEFWZOGZRSVUCZ-UHFFFAOYSA-N 1 1 371.437 4.270 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C)CC1 ZINC000608836959 1116131480 /nfs/dbraw/zinc/13/14/80/1116131480.db2.gz DEHAIMKAGULQKB-INIZCTEOSA-N 1 1 357.454 4.065 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CCC[N@H+](C3CCCC3)CC2)nc1-c1ccccc1 ZINC000534144134 1116162198 /nfs/dbraw/zinc/16/21/98/1116162198.db2.gz MIVBWAIVZVNYIU-UHFFFAOYSA-N 1 1 366.465 4.112 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000029825535 1116309007 /nfs/dbraw/zinc/30/90/07/1116309007.db2.gz GMZCHTMWTQYOSX-CQSZACIVSA-N 1 1 367.405 4.124 20 5 FIBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089907091 1116347042 /nfs/dbraw/zinc/34/70/42/1116347042.db2.gz LJQPJTWXTPTORL-SJORKVTESA-N 1 1 361.467 4.356 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]1Cn1cnc2ccccc21 ZINC000539884934 1116396847 /nfs/dbraw/zinc/39/68/47/1116396847.db2.gz BWICYNGBBQITLB-INIZCTEOSA-N 1 1 370.840 4.263 20 5 FIBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@H]1CCC[C@@H]1O ZINC000539912641 1117749726 /nfs/dbraw/zinc/74/97/26/1117749726.db2.gz FFFUGWPMAHLDCP-BEFAXECRSA-N 1 1 374.412 4.119 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1Cc2ccc(O)cc2C2(CC2)C1 ZINC000462826989 1117798462 /nfs/dbraw/zinc/79/84/62/1117798462.db2.gz RWCWCBLQUURQSN-DHDCSXOGSA-N 1 1 350.418 4.251 20 5 FIBDMO COc1ccc(C[NH2+][C@H](C)c2sccc2Br)cc1[N+](=O)[O-] ZINC000540174296 1117915458 /nfs/dbraw/zinc/91/54/58/1117915458.db2.gz YZPQFQQLNLRZRA-SECBINFHSA-N 1 1 371.256 4.278 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccc(F)cc1F)C(C)C ZINC000540427156 1118051609 /nfs/dbraw/zinc/05/16/09/1118051609.db2.gz SDWZGARFZLOEHQ-GOSISDBHSA-N 1 1 350.365 4.369 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000540476038 1118077212 /nfs/dbraw/zinc/07/72/12/1118077212.db2.gz PURLHJDMDVRAQJ-CVEARBPZSA-N 1 1 355.438 4.198 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Oc3ccccc3)nn2)cc1[N+](=O)[O-] ZINC000540476741 1118078994 /nfs/dbraw/zinc/07/89/94/1118078994.db2.gz DJEMPEHXRAOAQT-OAHLLOKOSA-N 1 1 364.405 4.336 20 5 FIBDMO Cc1ccc([C@@H](CC(=O)OC(C)C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000541203820 1118423073 /nfs/dbraw/zinc/42/30/73/1118423073.db2.gz GWZRHJDNJNERQN-LJQANCHMSA-N 1 1 374.412 4.215 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCO)[C@H]2CCc3ccccc32)c(Cl)c1 ZINC000541534555 1118553171 /nfs/dbraw/zinc/55/31/71/1118553171.db2.gz TUWRGWCNAWOPHJ-IBGZPJMESA-N 1 1 360.841 4.120 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](CCCO)[C@H]2CCc3ccccc32)c(Cl)c1 ZINC000541534555 1118553173 /nfs/dbraw/zinc/55/31/73/1118553173.db2.gz TUWRGWCNAWOPHJ-IBGZPJMESA-N 1 1 360.841 4.120 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N(C)C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000464834106 1118708391 /nfs/dbraw/zinc/70/83/91/1118708391.db2.gz FYTDOVPGXNFSQV-IEBWSBKVSA-N 1 1 353.466 4.110 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C)C[C@@H]2c2ccc(C)o2)c([N+](=O)[O-])c1 ZINC000464841787 1118717913 /nfs/dbraw/zinc/71/79/13/1118717913.db2.gz XZHYATMQYGIAAY-RHSMWYFYSA-N 1 1 374.437 4.357 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C)C[C@H]1c1ccco1 ZINC000464858895 1118726900 /nfs/dbraw/zinc/72/69/00/1118726900.db2.gz XEMYLJGEDXUHOU-KSSFIOAISA-N 1 1 371.437 4.298 20 5 FIBDMO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000076342711 1118734447 /nfs/dbraw/zinc/73/44/47/1118734447.db2.gz OQBLDWQCWSRZLV-LLVKDONJSA-N 1 1 367.858 4.077 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000076342711 1118734451 /nfs/dbraw/zinc/73/44/51/1118734451.db2.gz OQBLDWQCWSRZLV-LLVKDONJSA-N 1 1 367.858 4.077 20 5 FIBDMO COc1cccc([C@@H]2C[C@@H](C)C[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000542247183 1118866608 /nfs/dbraw/zinc/86/66/08/1118866608.db2.gz PMODCCAOWGTOHB-KDOFPFPSSA-N 1 1 356.422 4.195 20 5 FIBDMO CC(C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1cc(C(F)(F)F)on1 ZINC000492110199 1119026416 /nfs/dbraw/zinc/02/64/16/1119026416.db2.gz SXTMGZBZMDBCSM-ALCCZGGFSA-N 1 1 355.316 4.140 20 5 FIBDMO CCOc1cc(C[N@@H+](C)Cc2ccccc2N2CCCC2)ccc1[N+](=O)[O-] ZINC000492377167 1119079058 /nfs/dbraw/zinc/07/90/58/1119079058.db2.gz PHLMOKHBFAMHTM-UHFFFAOYSA-N 1 1 369.465 4.226 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2cccc(OC)c2)ccc1[N+](=O)[O-] ZINC000492462308 1119097335 /nfs/dbraw/zinc/09/73/35/1119097335.db2.gz MTGIDDKZRYZTNQ-SFHVURJKSA-N 1 1 356.422 4.339 20 5 FIBDMO CCC[C@H]([NH2+][C@@H](C)c1cn(-c2ccccc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000090449816 1119161618 /nfs/dbraw/zinc/16/16/18/1119161618.db2.gz OUGAISAXUXDYHG-KXBFYZLASA-N 1 1 365.437 4.368 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1)CCC2 ZINC000492702223 1119168412 /nfs/dbraw/zinc/16/84/12/1119168412.db2.gz KHSDLWJCXSXXNR-OAHLLOKOSA-N 1 1 361.467 4.132 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000492771371 1119190080 /nfs/dbraw/zinc/19/00/80/1119190080.db2.gz MCGFLPLYVNMHMC-KFKAGJAMSA-N 1 1 362.470 4.019 20 5 FIBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1N1CCCC1 ZINC000761507771 1119403043 /nfs/dbraw/zinc/40/30/43/1119403043.db2.gz WTNKFNZEEGBMKQ-UHFFFAOYSA-N 1 1 359.857 4.480 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526563 1119409826 /nfs/dbraw/zinc/40/98/26/1119409826.db2.gz OWFKQDGSUPXMCJ-BEFAXECRSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526563 1119409829 /nfs/dbraw/zinc/40/98/29/1119409829.db2.gz OWFKQDGSUPXMCJ-BEFAXECRSA-N 1 1 373.884 4.248 20 5 FIBDMO CCC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000493240670 1119431441 /nfs/dbraw/zinc/43/14/41/1119431441.db2.gz WLXFCBWRYBZCJN-VUCTXSBTSA-N 1 1 352.862 4.274 20 5 FIBDMO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccc(F)cn1 ZINC000494516614 1119885347 /nfs/dbraw/zinc/88/53/47/1119885347.db2.gz VJCZPIBSJXQWHT-CQSZACIVSA-N 1 1 357.307 4.389 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc3c2C[N@@H+](CC(C)C)C3)c1 ZINC000494521159 1119888459 /nfs/dbraw/zinc/88/84/59/1119888459.db2.gz SVKYOEMZLOQMGL-UHFFFAOYSA-N 1 1 353.422 4.127 20 5 FIBDMO Cn1c(=O)c2cc3ccccc3cc2nc1SCC[C@H]1CCCC[N@H+]1C ZINC000495389351 1120774525 /nfs/dbraw/zinc/77/45/25/1120774525.db2.gz JFNAZXWYXFQQSK-QGZVFWFLSA-N 1 1 367.518 4.053 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1NCCc1[nH+]ccn1Cc1ccccc1 ZINC000301095684 1121030392 /nfs/dbraw/zinc/03/03/92/1121030392.db2.gz VULNVLCAFVYUKK-UHFFFAOYSA-N 1 1 356.813 4.148 20 5 FIBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCCc2ccccc21 ZINC000916571930 1121548223 /nfs/dbraw/zinc/54/82/23/1121548223.db2.gz UEPQIIXMBQPZHW-KRWDZBQOSA-N 1 1 373.840 4.196 20 5 FIBDMO C[C@H]1C[C@@H](N(C)c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000301452185 1121963287 /nfs/dbraw/zinc/96/32/87/1121963287.db2.gz XQNMYBPHNVFKEA-UWVGGRQHSA-N 1 1 365.783 4.186 20 5 FIBDMO C[N@@H+](Cc1cccc(C(F)(F)F)c1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917473566 1122321489 /nfs/dbraw/zinc/32/14/89/1122321489.db2.gz FFSKWQQJXBXTMY-UHFFFAOYSA-N 1 1 364.327 4.053 20 5 FIBDMO C[N@H+](Cc1cccc(C(F)(F)F)c1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917473566 1122321492 /nfs/dbraw/zinc/32/14/92/1122321492.db2.gz FFSKWQQJXBXTMY-UHFFFAOYSA-N 1 1 364.327 4.053 20 5 FIBDMO C[N@@H+](CCc1cccs1)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072800874 1123152370 /nfs/dbraw/zinc/15/23/70/1123152370.db2.gz SAMXUAHSTZDWLT-UHFFFAOYSA-N 1 1 357.435 4.028 20 5 FIBDMO C[C@@H]1CCCC[C@@H]1CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556873235 1123157099 /nfs/dbraw/zinc/15/70/99/1123157099.db2.gz VNIHPWKDGLFHJG-MDZRGWNJSA-N 1 1 356.470 4.224 20 5 FIBDMO CC(C)[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000072863560 1123167893 /nfs/dbraw/zinc/16/78/93/1123167893.db2.gz NTBDCFHJTAPYSE-UHFFFAOYSA-N 1 1 352.394 4.055 20 5 FIBDMO CC(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000072863560 1123167894 /nfs/dbraw/zinc/16/78/94/1123167894.db2.gz NTBDCFHJTAPYSE-UHFFFAOYSA-N 1 1 352.394 4.055 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCCC3(CCOCC3)C2)o1 ZINC000556887998 1123175120 /nfs/dbraw/zinc/17/51/20/1123175120.db2.gz SLMHQAPHWNGPLQ-UHFFFAOYSA-N 1 1 356.422 4.247 20 5 FIBDMO C[N@@H+](Cn1cc(Br)c([N+](=O)[O-])n1)C1CCC(C(C)(C)C)CC1 ZINC000921046415 1123557233 /nfs/dbraw/zinc/55/72/33/1123557233.db2.gz OOQWHMWFWPZCCZ-UHFFFAOYSA-N 1 1 373.295 4.048 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000615724036 1124108672 /nfs/dbraw/zinc/10/86/72/1124108672.db2.gz KPZAICIZNUKOBW-YHYXMXQVSA-N 1 1 354.303 4.344 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000615834333 1124127604 /nfs/dbraw/zinc/12/76/04/1124127604.db2.gz AOAOUWYRCXSSAW-ZDJZVTAXSA-N 1 1 352.434 4.462 20 5 FIBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273515514 1124191175 /nfs/dbraw/zinc/19/11/75/1124191175.db2.gz PEBMNOMFBMILEL-JKSUJKDBSA-N 1 1 350.415 4.148 20 5 FIBDMO COc1ccc(-c2nc(C[NH2+]Cc3cccc([N+](=O)[O-])c3C)cs2)cc1 ZINC000616483570 1124320697 /nfs/dbraw/zinc/32/06/97/1124320697.db2.gz LCKQSAUPIKTCIV-UHFFFAOYSA-N 1 1 369.446 4.325 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C(C)C)[C@@H](C)c1ccccc1 ZINC000428838455 1124499303 /nfs/dbraw/zinc/49/93/03/1124499303.db2.gz HDPWKNONEBJPRD-INIZCTEOSA-N 1 1 355.438 4.313 20 5 FIBDMO C[N@H+]1CCC[C@@H](CNc2ncc(Cl)cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000153832381 1124575458 /nfs/dbraw/zinc/57/54/58/1124575458.db2.gz VYIZDQRIITWQKY-XHDPSFHLSA-N 1 1 366.874 4.200 20 5 FIBDMO COc1cccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Br)c1 ZINC001168675287 1124745406 /nfs/dbraw/zinc/74/54/06/1124745406.db2.gz DFYWGKYSFXIWAR-LLVKDONJSA-N 1 1 365.227 4.217 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCc2ccccc21 ZINC000170908234 1124860508 /nfs/dbraw/zinc/86/05/08/1124860508.db2.gz NXSHGZKZUVRAKO-IBGZPJMESA-N 1 1 363.417 4.412 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCCc3ccccc3)CC2)c(Cl)c1 ZINC000542927450 1124869795 /nfs/dbraw/zinc/86/97/95/1124869795.db2.gz KERNURYBJFVCTM-UHFFFAOYSA-N 1 1 374.868 4.472 20 5 FIBDMO COc1ccc(C[N@H+](C)Cc2csc(Br)c2)cc1[N+](=O)[O-] ZINC000064994440 1125119291 /nfs/dbraw/zinc/11/92/91/1125119291.db2.gz DIBXLMALUVVHLV-UHFFFAOYSA-N 1 1 371.256 4.059 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2csc(Br)c2)cc1[N+](=O)[O-] ZINC000064994440 1125119296 /nfs/dbraw/zinc/11/92/96/1125119296.db2.gz DIBXLMALUVVHLV-UHFFFAOYSA-N 1 1 371.256 4.059 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC(c4ccc(F)c(F)c4)CC3)nc2c1 ZINC000618280078 1125136788 /nfs/dbraw/zinc/13/67/88/1125136788.db2.gz SXXKNLNCRACIEF-UHFFFAOYSA-N 1 1 372.375 4.129 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113314854 1125149305 /nfs/dbraw/zinc/14/93/05/1125149305.db2.gz SHQFQHXPRLFYSU-HNNXBMFYSA-N 1 1 374.510 4.072 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C(C)C)s1 ZINC000065162144 1125168154 /nfs/dbraw/zinc/16/81/54/1125168154.db2.gz LFMCSKARBZMIIE-UHFFFAOYSA-N 1 1 362.451 4.242 20 5 FIBDMO O=[N+]([O-])c1c(NCCc2[nH+]ccn2Cc2ccccc2)ccc2ncccc21 ZINC000051654791 568138492 /nfs/dbraw/zinc/13/84/92/568138492.db2.gz NUARFYNZGVMRQP-UHFFFAOYSA-N 1 1 373.416 4.042 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000031006300 568324873 /nfs/dbraw/zinc/32/48/73/568324873.db2.gz DFACAWHGHDQCPV-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])N1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000569629784 568411147 /nfs/dbraw/zinc/41/11/47/568411147.db2.gz IQQPPOSSOZMKEZ-MISYRCLQSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1 ZINC000569629784 568411152 /nfs/dbraw/zinc/41/11/52/568411152.db2.gz IQQPPOSSOZMKEZ-MISYRCLQSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1 ZINC000569629784 568411153 /nfs/dbraw/zinc/41/11/53/568411153.db2.gz IQQPPOSSOZMKEZ-MISYRCLQSA-N 1 1 365.477 4.110 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCn2ccnc2)Cc2cccc(Cl)c2)cc1 ZINC000619532286 1125609241 /nfs/dbraw/zinc/60/92/41/1125609241.db2.gz UMZXGICNAMAKNH-UHFFFAOYSA-N 1 1 370.840 4.147 20 5 FIBDMO COc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1F ZINC000619715447 1125667259 /nfs/dbraw/zinc/66/72/59/1125667259.db2.gz HRNVYSXZWZKXRC-UHFFFAOYSA-N 1 1 358.291 4.051 20 5 FIBDMO COc1cc(C[N@@H+](C2CC2)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000064809174 1079976367 /nfs/dbraw/zinc/97/63/67/1079976367.db2.gz GCZUDYSCENBEJY-UHFFFAOYSA-N 1 1 356.369 4.112 20 5 FIBDMO CS[C@H]1CCCC[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000134548697 1080271712 /nfs/dbraw/zinc/27/17/12/1080271712.db2.gz GGMWYKFXKDCCJS-INIZCTEOSA-N 1 1 361.467 4.010 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H]3c3cccs3)o2)cc1 ZINC000032811681 1080861577 /nfs/dbraw/zinc/86/15/77/1080861577.db2.gz HVKJSYCFYNLMHM-AWEZNQCLSA-N 1 1 356.407 4.043 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H]3c3cccs3)o2)cc1 ZINC000032811681 1080861580 /nfs/dbraw/zinc/86/15/80/1080861580.db2.gz HVKJSYCFYNLMHM-AWEZNQCLSA-N 1 1 356.407 4.043 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(COc4ccccc4)CC3)nc2c1 ZINC000083172206 1081257435 /nfs/dbraw/zinc/25/74/35/1081257435.db2.gz VFMZQLLUBAYAFR-UHFFFAOYSA-N 1 1 367.405 4.027 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1nc2cc(Cl)ccc2n1C ZINC000547979390 1081308765 /nfs/dbraw/zinc/30/87/65/1081308765.db2.gz LSTURLGJXIUEAB-GFCCVEGCSA-N 1 1 358.829 4.294 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000175827211 1081369369 /nfs/dbraw/zinc/36/93/69/1081369369.db2.gz VKBYHJYIYZLYSV-ZBFHGGJFSA-N 1 1 366.870 4.398 20 5 FIBDMO CCc1ccc(C[NH+]2CCN([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000610003301 1081370446 /nfs/dbraw/zinc/37/04/46/1081370446.db2.gz JFFLUVRPIGEJLX-OAHLLOKOSA-N 1 1 359.495 4.098 20 5 FIBDMO O=[N+]([O-])c1sccc1N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000610469427 1082232141 /nfs/dbraw/zinc/23/21/41/1082232141.db2.gz ODPYIZKIKSEFAP-IBGZPJMESA-N 1 1 357.479 4.149 20 5 FIBDMO CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000580962931 1082255130 /nfs/dbraw/zinc/25/51/30/1082255130.db2.gz LNTBXJAOCIQMQK-FQEVSTJZSA-N 1 1 353.466 4.212 20 5 FIBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000157798729 1082330777 /nfs/dbraw/zinc/33/07/77/1082330777.db2.gz WDKOYGDQVPIMJF-CYBMUJFWSA-N 1 1 356.451 4.250 20 5 FIBDMO Cc1c([C@@H](C)NC2CC[NH+](CCc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000177969306 1082443530 /nfs/dbraw/zinc/44/35/30/1082443530.db2.gz PMDWTBURZMEONY-GOSISDBHSA-N 1 1 367.493 4.261 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCC[C@@H]2c2ccc(C)cc2)c1 ZINC001167483668 1082913628 /nfs/dbraw/zinc/91/36/28/1082913628.db2.gz YDYRJQHEFLVXMT-LJQANCHMSA-N 1 1 368.433 4.417 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@@H]2c2ccc(C)cc2)c1 ZINC001167483668 1082913631 /nfs/dbraw/zinc/91/36/31/1082913631.db2.gz YDYRJQHEFLVXMT-LJQANCHMSA-N 1 1 368.433 4.417 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1 ZINC000055910981 1082926286 /nfs/dbraw/zinc/92/62/86/1082926286.db2.gz DEQDJMMAOPOAAV-LJQANCHMSA-N 1 1 354.406 4.107 20 5 FIBDMO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1Cl ZINC000178205840 1082977807 /nfs/dbraw/zinc/97/78/07/1082977807.db2.gz GJVGQUNOPFQTKZ-JTQLQIEISA-N 1 1 368.220 4.191 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@H+]2CCCOCC2)cc1 ZINC000510509587 1083132383 /nfs/dbraw/zinc/13/23/83/1083132383.db2.gz WDFPJSUNODLTPB-UHFFFAOYSA-N 1 1 362.813 4.263 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000510870424 1083349354 /nfs/dbraw/zinc/34/93/54/1083349354.db2.gz VDLMXTPPKOPKGH-HNNXBMFYSA-N 1 1 367.449 4.387 20 5 FIBDMO CC[N@H+](Cc1cccc(F)c1)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000102696124 1083495238 /nfs/dbraw/zinc/49/52/38/1083495238.db2.gz QPOMWLBCKAICKC-CYBMUJFWSA-N 1 1 370.384 4.367 20 5 FIBDMO CC[N@@H+](Cc1cccc(F)c1)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000102696124 1083495249 /nfs/dbraw/zinc/49/52/49/1083495249.db2.gz QPOMWLBCKAICKC-CYBMUJFWSA-N 1 1 370.384 4.367 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Cn2cnc3ccccc32)C1 ZINC000614235771 1083580174 /nfs/dbraw/zinc/58/01/74/1083580174.db2.gz GIHKHDWMDKNBQZ-DLBZAZTESA-N 1 1 364.449 4.418 20 5 FIBDMO Cc1c([C@@H](C)[NH2+]C[C@@H]2CCCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805892 1083718280 /nfs/dbraw/zinc/71/82/80/1083718280.db2.gz OCXGRIAPPBFCJH-QUCCMNQESA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c([C@@H](C)NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805892 1083718282 /nfs/dbraw/zinc/71/82/82/1083718282.db2.gz OCXGRIAPPBFCJH-QUCCMNQESA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c([C@@H](C)NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805892 1083718289 /nfs/dbraw/zinc/71/82/89/1083718289.db2.gz OCXGRIAPPBFCJH-QUCCMNQESA-N 1 1 367.493 4.466 20 5 FIBDMO CC(C)CCC1CC[NH+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC001167688574 1083727988 /nfs/dbraw/zinc/72/79/88/1083727988.db2.gz FMPHGCOCSWPJTN-UHFFFAOYSA-N 1 1 367.877 4.335 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2cccc(F)c2)n1 ZINC000548934780 1083854020 /nfs/dbraw/zinc/85/40/20/1083854020.db2.gz SDGDIZQXLRFNMM-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2cccc(F)c2)n1 ZINC000548934780 1083854025 /nfs/dbraw/zinc/85/40/25/1083854025.db2.gz SDGDIZQXLRFNMM-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@@H]2c2ccccc2C(F)(F)F)n1 ZINC000478008510 1083943001 /nfs/dbraw/zinc/94/30/01/1083943001.db2.gz FQIHEICQLWMWGV-OAHLLOKOSA-N 1 1 368.359 4.037 20 5 FIBDMO Cc1c(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000411996001 1083943691 /nfs/dbraw/zinc/94/36/91/1083943691.db2.gz FRIIBPUNPOVKDP-FQEVSTJZSA-N 1 1 352.434 4.257 20 5 FIBDMO Cc1oc(-c2ccsc2)nc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511068117 1084580492 /nfs/dbraw/zinc/58/04/92/1084580492.db2.gz YPBVUIAJYMXIKB-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO Cc1oc(-c2ccsc2)nc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511068117 1084580502 /nfs/dbraw/zinc/58/05/02/1084580502.db2.gz YPBVUIAJYMXIKB-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO COc1cc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379431 1084667386 /nfs/dbraw/zinc/66/73/86/1084667386.db2.gz SLAWWHZEOWXDAG-SFHVURJKSA-N 1 1 362.426 4.033 20 5 FIBDMO COc1cc(C[N@H+]2CCS[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000613379431 1084667390 /nfs/dbraw/zinc/66/73/90/1084667390.db2.gz SLAWWHZEOWXDAG-SFHVURJKSA-N 1 1 362.426 4.033 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC)CCC2 ZINC000478051525 1084830211 /nfs/dbraw/zinc/83/02/11/1084830211.db2.gz CZNMUYOHTNNKQD-OAHLLOKOSA-N 1 1 361.467 4.132 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC)CCC2 ZINC000478051525 1084830215 /nfs/dbraw/zinc/83/02/15/1084830215.db2.gz CZNMUYOHTNNKQD-OAHLLOKOSA-N 1 1 361.467 4.132 20 5 FIBDMO Cn1ncc2c1CCC[C@@H]2[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000180210192 1084899056 /nfs/dbraw/zinc/89/90/56/1084899056.db2.gz RRYDRSMQTIVVBV-SFHVURJKSA-N 1 1 366.421 4.098 20 5 FIBDMO C[C@@H](c1ccc2ccccc2c1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000478432588 1084951048 /nfs/dbraw/zinc/95/10/48/1084951048.db2.gz UVDDHSGUGDMSLU-HNNXBMFYSA-N 1 1 350.422 4.170 20 5 FIBDMO C[N@@H+](CCCc1ccccc1)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000170912847 1084981888 /nfs/dbraw/zinc/98/18/88/1084981888.db2.gz FJODLFSISAMBIM-UHFFFAOYSA-N 1 1 365.433 4.357 20 5 FIBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC001167582220 1085103262 /nfs/dbraw/zinc/10/32/62/1085103262.db2.gz MKGYPJMCARBFRH-NSHDSACASA-N 1 1 369.284 4.482 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@H](c4ccccc4)[C@H]4CCC[C@H]43)nc2c1 ZINC000511878138 1085275088 /nfs/dbraw/zinc/27/50/88/1085275088.db2.gz WTBNMVWHEBAPLZ-MBOZVWFJSA-N 1 1 362.433 4.239 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCCC[C@@H]2C[C@H](O)c2ccco2)c(F)c1 ZINC000121874367 1085586847 /nfs/dbraw/zinc/58/68/47/1085586847.db2.gz BWNKJSPLXOHZJM-QAPCUYQASA-N 1 1 362.401 4.195 20 5 FIBDMO Cc1ccccc1C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104662020 1085746753 /nfs/dbraw/zinc/74/67/53/1085746753.db2.gz WUMLPCMWLDHSLF-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC([C@H](O)c3ccccc3)CC2)ccc1Cl ZINC000122067340 1086224404 /nfs/dbraw/zinc/22/44/04/1086224404.db2.gz UOJGIYJKJLUGGD-LJQANCHMSA-N 1 1 360.841 4.194 20 5 FIBDMO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000535967171 1086432385 /nfs/dbraw/zinc/43/23/85/1086432385.db2.gz KZYSMHDPRLNEOM-UHFFFAOYSA-N 1 1 358.825 4.052 20 5 FIBDMO CC(=O)c1ccc2c(c1)CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC2 ZINC000535967171 1086432388 /nfs/dbraw/zinc/43/23/88/1086432388.db2.gz KZYSMHDPRLNEOM-UHFFFAOYSA-N 1 1 358.825 4.052 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2ccccc2)CC2CCC2)c2c(c1)COCO2 ZINC000512041139 1086695506 /nfs/dbraw/zinc/69/55/06/1086695506.db2.gz SIPHMKYZWJBKMU-UHFFFAOYSA-N 1 1 368.433 4.264 20 5 FIBDMO COCCC[N@H+]1Cc2cccc(N[C@H](C)c3ccccc3[N+](=O)[O-])c2C1 ZINC000080467634 1086776061 /nfs/dbraw/zinc/77/60/61/1086776061.db2.gz VRNHDWOZVFEMFN-OAHLLOKOSA-N 1 1 355.438 4.120 20 5 FIBDMO CC(C)[N@@H+](Cc1cccc(F)c1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899445 1086905912 /nfs/dbraw/zinc/90/59/12/1086905912.db2.gz VDNYXALITUZGEK-UHFFFAOYSA-N 1 1 368.412 4.466 20 5 FIBDMO CC(C)[N@H+](Cc1cccc(F)c1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899445 1086905915 /nfs/dbraw/zinc/90/59/15/1086905915.db2.gz VDNYXALITUZGEK-UHFFFAOYSA-N 1 1 368.412 4.466 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000081574163 1087321788 /nfs/dbraw/zinc/32/17/88/1087321788.db2.gz HXYIENOKUNSAOW-GLJUWKHASA-N 1 1 364.405 4.399 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000081574163 1087321794 /nfs/dbraw/zinc/32/17/94/1087321794.db2.gz HXYIENOKUNSAOW-GLJUWKHASA-N 1 1 364.405 4.399 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCc2c1c(Br)ccc2F ZINC000180414330 1087904478 /nfs/dbraw/zinc/90/44/78/1087904478.db2.gz WQSUWLLIFCJGAH-CQSZACIVSA-N 1 1 365.202 4.274 20 5 FIBDMO Cc1cccc2nc(C3CC[NH+](Cc4csc([N+](=O)[O-])c4)CC3)oc21 ZINC000189814376 1088643765 /nfs/dbraw/zinc/64/37/65/1088643765.db2.gz RQEXQFJAMLSCCM-UHFFFAOYSA-N 1 1 357.435 4.486 20 5 FIBDMO CC(C)(C)c1ccncc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000414502854 1088813437 /nfs/dbraw/zinc/81/34/37/1088813437.db2.gz VGYSAEOWJRZCHH-UHFFFAOYSA-N 1 1 365.380 4.179 20 5 FIBDMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1csc2ccccc12 ZINC000514617404 1089271289 /nfs/dbraw/zinc/27/12/89/1089271289.db2.gz ITBJZKZOZOEETL-UHFFFAOYSA-N 1 1 369.446 4.270 20 5 FIBDMO CCCO[C@@H]1CCC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425401221 1089852247 /nfs/dbraw/zinc/85/22/47/1089852247.db2.gz GRDXAKZQINFZRU-OAHLLOKOSA-N 1 1 371.275 4.138 20 5 FIBDMO CCCO[C@@H]1CCC[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000425401221 1089852264 /nfs/dbraw/zinc/85/22/64/1089852264.db2.gz GRDXAKZQINFZRU-OAHLLOKOSA-N 1 1 371.275 4.138 20 5 FIBDMO CC[C@H](C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000072588512 1090256664 /nfs/dbraw/zinc/25/66/64/1090256664.db2.gz YZYSHLZKDKPFBV-HNNXBMFYSA-N 1 1 366.421 4.446 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cn3cc(Cl)ccc3n1)CCCC2 ZINC000417322012 1090815007 /nfs/dbraw/zinc/81/50/07/1090815007.db2.gz MGHQZDZOKQZAIX-SFHVURJKSA-N 1 1 370.840 4.453 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000511628223 1090890238 /nfs/dbraw/zinc/89/02/38/1090890238.db2.gz XZGFHJUSPVYLNN-GOSISDBHSA-N 1 1 373.840 4.332 20 5 FIBDMO C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1cccc(F)c1 ZINC000500120483 1091052128 /nfs/dbraw/zinc/05/21/28/1091052128.db2.gz XSNWPMSPAQRCGL-VBKZILBWSA-N 1 1 371.412 4.146 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)c2ccc(Cl)c(F)c2)C2CC2)c1 ZINC000759850412 1091325667 /nfs/dbraw/zinc/32/56/67/1091325667.db2.gz HSTLBJXNMVNTIY-GOSISDBHSA-N 1 1 364.804 4.085 20 5 FIBDMO C[C@H](C[N@@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 ZINC000066854218 1091362337 /nfs/dbraw/zinc/36/23/37/1091362337.db2.gz QZGNBCXYGIUYSK-CABCVRRESA-N 1 1 366.421 4.441 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1C[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C1 ZINC000566706660 1091374239 /nfs/dbraw/zinc/37/42/39/1091374239.db2.gz FBWUISQMJWNPQI-QMMLZNLJSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000566706660 1091374284 /nfs/dbraw/zinc/37/42/84/1091374284.db2.gz FBWUISQMJWNPQI-QMMLZNLJSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1 ZINC000566706660 1091374288 /nfs/dbraw/zinc/37/42/88/1091374288.db2.gz FBWUISQMJWNPQI-QMMLZNLJSA-N 1 1 365.477 4.110 20 5 FIBDMO CCC1(CC)[C@H](OC)C[C@H]1[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001167766317 1091600941 /nfs/dbraw/zinc/60/09/41/1091600941.db2.gz KHLSKZFDWZAHKU-RTBURBONSA-N 1 1 364.486 4.408 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc(F)cc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899833 1091819556 /nfs/dbraw/zinc/81/95/56/1091819556.db2.gz SMFNSPMGXFYVIS-UHFFFAOYSA-N 1 1 368.412 4.466 20 5 FIBDMO CC(C)[N@H+](Cc1ccc(F)cc1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899833 1091819560 /nfs/dbraw/zinc/81/95/60/1091819560.db2.gz SMFNSPMGXFYVIS-UHFFFAOYSA-N 1 1 368.412 4.466 20 5 FIBDMO CC(C)(C)C[N@H+](Cc1ccccc1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000728903420 1091850302 /nfs/dbraw/zinc/85/03/02/1091850302.db2.gz YLJFJNMAPGXZGP-UHFFFAOYSA-N 1 1 369.421 4.009 20 5 FIBDMO C[NH+](C)Cc1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1Cl ZINC000500750910 1092506495 /nfs/dbraw/zinc/50/64/95/1092506495.db2.gz UUWGLMMKHKGDBZ-UHFFFAOYSA-N 1 1 368.220 4.216 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC4(CCC4)[C@H]3[C@H]3CCCO3)o2)cc1 ZINC000572807658 1092907773 /nfs/dbraw/zinc/90/77/73/1092907773.db2.gz CIOACHDBUFQVCA-WOJBJXKFSA-N 1 1 368.433 4.388 20 5 FIBDMO CC(C)CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 ZINC000521818191 1092936855 /nfs/dbraw/zinc/93/68/55/1092936855.db2.gz RZIGLPVQSSWUEL-UHFFFAOYSA-N 1 1 358.442 4.436 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccn(-c3ccc(F)cc3F)n2)cc1[N+](=O)[O-] ZINC000190326655 1093005870 /nfs/dbraw/zinc/00/58/70/1093005870.db2.gz DGSYGDMSCXGTJM-CYBMUJFWSA-N 1 1 372.375 4.218 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000433063616 1093173665 /nfs/dbraw/zinc/17/36/65/1093173665.db2.gz YJIMIRVRUPQJPS-SFHVURJKSA-N 1 1 367.449 4.111 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000439316095 1093328926 /nfs/dbraw/zinc/32/89/26/1093328926.db2.gz JDLMFIYTPAWNAH-GDBMZVCRSA-N 1 1 350.422 4.239 20 5 FIBDMO C[C@@H]1C[C@H](c2ccccc2)CC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000439316095 1093328935 /nfs/dbraw/zinc/32/89/35/1093328935.db2.gz JDLMFIYTPAWNAH-GDBMZVCRSA-N 1 1 350.422 4.239 20 5 FIBDMO CCc1ccc([C@H]([NH2+]CCc2nc(C)oc2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544361129 1093513816 /nfs/dbraw/zinc/51/38/16/1093513816.db2.gz XLHXNSYIPFIUIS-HXUWFJFHSA-N 1 1 369.421 4.277 20 5 FIBDMO CC(C)c1ccc(C(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000474173360 1093552228 /nfs/dbraw/zinc/55/22/28/1093552228.db2.gz UCGYAXDLNRGLDT-WBVHZDCISA-N 1 1 373.497 4.101 20 5 FIBDMO CC(C)c1ccc(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000474173359 1093552515 /nfs/dbraw/zinc/55/25/15/1093552515.db2.gz UCGYAXDLNRGLDT-RDJZCZTQSA-N 1 1 373.497 4.101 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCCC[C@@H]2c2nc3ccccc3o2)cc1 ZINC000474233488 1093602534 /nfs/dbraw/zinc/60/25/34/1093602534.db2.gz QQLXSQUMVBSUEQ-GOSISDBHSA-N 1 1 367.405 4.342 20 5 FIBDMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCCC[C@@H]2c2nc3ccccc3o2)cc1 ZINC000474233488 1093602538 /nfs/dbraw/zinc/60/25/38/1093602538.db2.gz QQLXSQUMVBSUEQ-GOSISDBHSA-N 1 1 367.405 4.342 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cc(F)c(F)cc1Br ZINC000512988305 1093629015 /nfs/dbraw/zinc/62/90/15/1093629015.db2.gz HVKQPPFPALEVRS-UHFFFAOYSA-N 1 1 371.181 4.234 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000397994579 1093799120 /nfs/dbraw/zinc/79/91/20/1093799120.db2.gz RTWHSRYXVYHRIN-HNAYVOBHSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000397994579 1093799127 /nfs/dbraw/zinc/79/91/27/1093799127.db2.gz RTWHSRYXVYHRIN-HNAYVOBHSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1c(Cl)cccc1[N+](=O)[O-] ZINC000397988083 1093805153 /nfs/dbraw/zinc/80/51/53/1093805153.db2.gz PEEVHPFSIHJGLR-HNAYVOBHSA-N 1 1 373.884 4.248 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCSC[C@@H]3C3CCC3)o2)c1 ZINC000419375782 1093813833 /nfs/dbraw/zinc/81/38/33/1093813833.db2.gz RAFDJKKCUKWBBP-QGZVFWFLSA-N 1 1 373.478 4.010 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000513247247 1094028757 /nfs/dbraw/zinc/02/87/57/1094028757.db2.gz LWMQJUNXRNVZTQ-UGSOOPFHSA-N 1 1 373.840 4.270 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000513247247 1094028762 /nfs/dbraw/zinc/02/87/62/1094028762.db2.gz LWMQJUNXRNVZTQ-UGSOOPFHSA-N 1 1 373.840 4.270 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)C[C@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000513472416 1094151685 /nfs/dbraw/zinc/15/16/85/1094151685.db2.gz DYFUIJPSZKYNIN-GOSISDBHSA-N 1 1 369.465 4.221 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(Nc2ccc(F)cc2)CC1 ZINC000237095535 1094918154 /nfs/dbraw/zinc/91/81/54/1094918154.db2.gz NKCIHCGOVCTIMN-UHFFFAOYSA-N 1 1 373.428 4.209 20 5 FIBDMO CC[N@H+](Cc1ccc(OC)c(OC)c1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522536327 1095119741 /nfs/dbraw/zinc/11/97/41/1095119741.db2.gz IYXDGVMMZIKXKD-UHFFFAOYSA-N 1 1 364.829 4.288 20 5 FIBDMO CC[N@@H+](Cc1ccc(OC)c(OC)c1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522536327 1095119746 /nfs/dbraw/zinc/11/97/46/1095119746.db2.gz IYXDGVMMZIKXKD-UHFFFAOYSA-N 1 1 364.829 4.288 20 5 FIBDMO C[C@@H](CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[N@H+](C)C1CC1 ZINC000237407130 1095172132 /nfs/dbraw/zinc/17/21/32/1095172132.db2.gz ZJIITTYNNQCXPU-AWEZNQCLSA-N 1 1 373.428 4.099 20 5 FIBDMO C[C@@H](CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000237407130 1095172142 /nfs/dbraw/zinc/17/21/42/1095172142.db2.gz ZJIITTYNNQCXPU-AWEZNQCLSA-N 1 1 373.428 4.099 20 5 FIBDMO CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccsc1 ZINC000421009245 1095223311 /nfs/dbraw/zinc/22/33/11/1095223311.db2.gz MXRYKBNAVGGPBM-AWEZNQCLSA-N 1 1 361.467 4.457 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421007090 1095240670 /nfs/dbraw/zinc/24/06/70/1095240670.db2.gz KUGCDHGRMSCQOL-CQSZACIVSA-N 1 1 361.467 4.375 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421007090 1095240684 /nfs/dbraw/zinc/24/06/84/1095240684.db2.gz KUGCDHGRMSCQOL-CQSZACIVSA-N 1 1 361.467 4.375 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(-c2c(F)cccc2F)o1 ZINC000237201078 1095552509 /nfs/dbraw/zinc/55/25/09/1095552509.db2.gz NOVVNNAEZJWQDQ-UHFFFAOYSA-N 1 1 374.343 4.431 20 5 FIBDMO CC[C@@H]1C[C@@]1([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1cccc(C)c1 ZINC000502555373 1095586899 /nfs/dbraw/zinc/58/68/99/1095586899.db2.gz YGMHYQFQCIPBPT-QRWLVFNGSA-N 1 1 358.413 4.466 20 5 FIBDMO Cc1ccc(C(C)(C)C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000444168871 1095798645 /nfs/dbraw/zinc/79/86/45/1095798645.db2.gz PNDDBDQMJJAGQP-UHFFFAOYSA-N 1 1 369.465 4.141 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])CC2CC2)c(OC)c1 ZINC000503218998 1096309067 /nfs/dbraw/zinc/30/90/67/1096309067.db2.gz UBOFCTOZQLTGEW-UHFFFAOYSA-N 1 1 356.422 4.024 20 5 FIBDMO COc1ccc(C[N@H+](Cc2ccccc2[N+](=O)[O-])CC2CC2)c(OC)c1 ZINC000503218998 1096309077 /nfs/dbraw/zinc/30/90/77/1096309077.db2.gz UBOFCTOZQLTGEW-UHFFFAOYSA-N 1 1 356.422 4.024 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000503253186 1096331142 /nfs/dbraw/zinc/33/11/42/1096331142.db2.gz ATUCNWUGZZNZON-IRXDYDNUSA-N 1 1 369.465 4.116 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CC(=O)N(C)[C@@H](C)c1ccccc1 ZINC000503253186 1096331149 /nfs/dbraw/zinc/33/11/49/1096331149.db2.gz ATUCNWUGZZNZON-IRXDYDNUSA-N 1 1 369.465 4.116 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CC(=O)N(C)[C@H](C)c1ccccc1 ZINC000503253188 1096331420 /nfs/dbraw/zinc/33/14/20/1096331420.db2.gz ATUCNWUGZZNZON-SJORKVTESA-N 1 1 369.465 4.116 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CC(=O)N(C)[C@H](C)c1ccccc1 ZINC000503253188 1096331426 /nfs/dbraw/zinc/33/14/26/1096331426.db2.gz ATUCNWUGZZNZON-SJORKVTESA-N 1 1 369.465 4.116 20 5 FIBDMO Cc1c([C@H](C)NC[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000423470678 1096693139 /nfs/dbraw/zinc/69/31/39/1096693139.db2.gz LSHKXQJYTJNDPY-RIFZZMRRSA-N 1 1 371.456 4.086 20 5 FIBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000515410491 1098561648 /nfs/dbraw/zinc/56/16/48/1098561648.db2.gz ITJKPCKMCNYEMN-HNNXBMFYSA-N 1 1 353.422 4.222 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)c1 ZINC000532904104 1098580794 /nfs/dbraw/zinc/58/07/94/1098580794.db2.gz QCSWVFXNXSMCFX-QGZVFWFLSA-N 1 1 369.446 4.420 20 5 FIBDMO CC(C)[N@H+](CC(=O)c1c[nH]c2ccccc12)Cc1ccc([N+](=O)[O-])cc1 ZINC000532929184 1098601326 /nfs/dbraw/zinc/60/13/26/1098601326.db2.gz COURDJYBCKIPRW-UHFFFAOYSA-N 1 1 351.406 4.169 20 5 FIBDMO CC(C)[N@@H+](CC(=O)c1c[nH]c2ccccc12)Cc1ccc([N+](=O)[O-])cc1 ZINC000532929184 1098601328 /nfs/dbraw/zinc/60/13/28/1098601328.db2.gz COURDJYBCKIPRW-UHFFFAOYSA-N 1 1 351.406 4.169 20 5 FIBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[NH+]2C3CCC2CC3)c([N+](=O)[O-])c1 ZINC000532915996 1098606656 /nfs/dbraw/zinc/60/66/56/1098606656.db2.gz YCDYIZUUEASRSQ-UHYCVJNDSA-N 1 1 365.433 4.210 20 5 FIBDMO COc1ccccc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@@H]1CCCO1 ZINC000515546364 1098686489 /nfs/dbraw/zinc/68/64/89/1098686489.db2.gz PZQFGKNEQYDFGN-IBGZPJMESA-N 1 1 370.449 4.093 20 5 FIBDMO COc1ccccc1C[N@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@@H]1CCCO1 ZINC000515546364 1098686499 /nfs/dbraw/zinc/68/64/99/1098686499.db2.gz PZQFGKNEQYDFGN-IBGZPJMESA-N 1 1 370.449 4.093 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]Cc3ccc4c(c3)COC4)cs2)c1 ZINC000533201543 1098862934 /nfs/dbraw/zinc/86/29/34/1098862934.db2.gz JOQMTSAGUAVXEZ-UHFFFAOYSA-N 1 1 367.430 4.038 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](Cc1ccccc1)CC1CCC1 ZINC000533247542 1098909344 /nfs/dbraw/zinc/90/93/44/1098909344.db2.gz XIYUEEFAPQOUJC-UHFFFAOYSA-N 1 1 367.449 4.144 20 5 FIBDMO CC[C@H](Cc1ccccc1)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000533301040 1098952851 /nfs/dbraw/zinc/95/28/51/1098952851.db2.gz CMUOVWPALZWMFX-GOSISDBHSA-N 1 1 369.465 4.185 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000533435533 1099056313 /nfs/dbraw/zinc/05/63/13/1099056313.db2.gz IAOYKGHLJPDULI-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO CC(C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000505859607 1099202723 /nfs/dbraw/zinc/20/27/23/1099202723.db2.gz ZGIZVQBWSPYGMF-UHFFFAOYSA-N 1 1 353.216 4.458 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](Cc1ccccc1)[C@H](CO)C1CC1 ZINC000533645137 1099267885 /nfs/dbraw/zinc/26/78/85/1099267885.db2.gz UDIHGDORTYFAAO-LJQANCHMSA-N 1 1 360.841 4.021 20 5 FIBDMO Cc1ccc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)c1 ZINC000064350510 1099344705 /nfs/dbraw/zinc/34/47/05/1099344705.db2.gz JNBHTRQCWTXXIH-UHFFFAOYSA-N 1 1 355.438 4.061 20 5 FIBDMO Cc1ccc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)c1 ZINC000064350510 1099344719 /nfs/dbraw/zinc/34/47/19/1099344719.db2.gz JNBHTRQCWTXXIH-UHFFFAOYSA-N 1 1 355.438 4.061 20 5 FIBDMO COc1nc2ccccc2cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000517006846 1099980299 /nfs/dbraw/zinc/98/02/99/1099980299.db2.gz JLDRREJNNBCSCP-UHFFFAOYSA-N 1 1 351.406 4.177 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)CC1(O)CCCC1 ZINC000536668700 1100151631 /nfs/dbraw/zinc/15/16/31/1100151631.db2.gz OBAXERORXYTVAX-UHFFFAOYSA-N 1 1 364.829 4.245 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)s1 ZINC000536692325 1100189537 /nfs/dbraw/zinc/18/95/37/1100189537.db2.gz DMESMSODKKHNIO-HUUCEWRRSA-N 1 1 358.463 4.182 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC=C(c2ccc3c(c2)OCCO3)CC1 ZINC000536713464 1100214034 /nfs/dbraw/zinc/21/40/34/1100214034.db2.gz OETGDKXESNAHLI-HNNXBMFYSA-N 1 1 366.417 4.216 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CC[C@@H]3Cc3ccccc3)o2)c1 ZINC000437830491 1100221228 /nfs/dbraw/zinc/22/12/28/1100221228.db2.gz VZFOFWYZBHGNFH-GOSISDBHSA-N 1 1 363.417 4.109 20 5 FIBDMO Cc1c(C[N@H+]2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000459652489 1100394477 /nfs/dbraw/zinc/39/44/77/1100394477.db2.gz BXVUMPKFLVVZRQ-INIZCTEOSA-N 1 1 372.387 4.084 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@H]1CCSC1 ZINC000506217615 1100629304 /nfs/dbraw/zinc/62/93/04/1100629304.db2.gz JYYIASCKMISXLA-LBPRGKRZSA-N 1 1 352.843 4.446 20 5 FIBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518263606 1101048470 /nfs/dbraw/zinc/04/84/70/1101048470.db2.gz YWQMYBDFNYSNFW-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CN1CCC[C@@H](C)C1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518263606 1101048476 /nfs/dbraw/zinc/04/84/76/1101048476.db2.gz YWQMYBDFNYSNFW-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000439329450 1101351608 /nfs/dbraw/zinc/35/16/08/1101351608.db2.gz VHWPAHPFQGTXGK-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000439329450 1101351631 /nfs/dbraw/zinc/35/16/31/1101351631.db2.gz VHWPAHPFQGTXGK-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO CCc1ccc(C(=O)Nc2cccc(CC[N@@H+](C)C3CC3)c2)cc1[N+](=O)[O-] ZINC000537147908 1101508418 /nfs/dbraw/zinc/50/84/18/1101508418.db2.gz OZMNQNUZEISQNA-UHFFFAOYSA-N 1 1 367.449 4.046 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+](Cc2cccs2)C2CC2)c1 ZINC000506617640 1101578973 /nfs/dbraw/zinc/57/89/73/1101578973.db2.gz QQTOOYTZNJOQCE-UHFFFAOYSA-N 1 1 354.378 4.422 20 5 FIBDMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+](Cc2cccs2)C2CC2)c1 ZINC000506617640 1101578980 /nfs/dbraw/zinc/57/89/80/1101578980.db2.gz QQTOOYTZNJOQCE-UHFFFAOYSA-N 1 1 354.378 4.422 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]Cc1nn(-c2ccccc2)c2c1CCC2 ZINC000537353395 1101689514 /nfs/dbraw/zinc/68/95/14/1101689514.db2.gz SXWYMEDHGSAQFS-VQHVLOKHSA-N 1 1 374.444 4.072 20 5 FIBDMO Cc1csc([C@@H]2CCC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)n1 ZINC000163517837 1102183199 /nfs/dbraw/zinc/18/31/99/1102183199.db2.gz ZTACITVZQSPPIQ-GFCCVEGCSA-N 1 1 351.859 4.393 20 5 FIBDMO COc1cc(C[N@@H+]2CCC23CCC3)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000537634261 1102317316 /nfs/dbraw/zinc/31/73/16/1102317316.db2.gz VFCWTEMKOVSQMS-UHFFFAOYSA-N 1 1 368.433 4.311 20 5 FIBDMO COc1cc(C[N@H+]2CCC23CCC3)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000537634261 1102317328 /nfs/dbraw/zinc/31/73/28/1102317328.db2.gz VFCWTEMKOVSQMS-UHFFFAOYSA-N 1 1 368.433 4.311 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](CN1CCCC1)c1ccccc1 ZINC000532451993 1102344931 /nfs/dbraw/zinc/34/49/31/1102344931.db2.gz CLBIYIMFMTUSSP-LAUBAEHRSA-N 1 1 353.466 4.391 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000052803846 1102379524 /nfs/dbraw/zinc/37/95/24/1102379524.db2.gz YEFFFAABFMWQJX-QGZVFWFLSA-N 1 1 359.451 4.130 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccsc1 ZINC000052803847 1102380169 /nfs/dbraw/zinc/38/01/69/1102380169.db2.gz YEFFFAABFMWQJX-KRWDZBQOSA-N 1 1 359.451 4.130 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCCC[C@@H]12 ZINC000532470973 1102389994 /nfs/dbraw/zinc/38/99/94/1102389994.db2.gz DAJAMLNMTFTHSG-XOKHGSTOSA-N 1 1 356.426 4.045 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000537660104 1102783116 /nfs/dbraw/zinc/78/31/16/1102783116.db2.gz ZDQHOGMJNKSCNM-BTYIYWSLSA-N 1 1 362.433 4.188 20 5 FIBDMO CC(C)[N@@H+](Cc1cnc2ccc(Cl)cn12)Cc1ccc([N+](=O)[O-])cc1 ZINC000507123557 1103130523 /nfs/dbraw/zinc/13/05/23/1103130523.db2.gz ZVCKXQAPPDGYOJ-UHFFFAOYSA-N 1 1 358.829 4.307 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)cc1 ZINC000385542611 1103136611 /nfs/dbraw/zinc/13/66/11/1103136611.db2.gz JMTJOSBFXGSPCC-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](c2ccccc2C)C1 ZINC000507165382 1103165580 /nfs/dbraw/zinc/16/55/80/1103165580.db2.gz POQZWEVEVKJOKK-KRWDZBQOSA-N 1 1 367.449 4.030 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1CCCc2ccccc21 ZINC000532754213 1103184078 /nfs/dbraw/zinc/18/40/78/1103184078.db2.gz SRYGKHYTNHKYRC-FQEVSTJZSA-N 1 1 367.449 4.241 20 5 FIBDMO COc1cc(C)c(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1OC ZINC000507169383 1103189530 /nfs/dbraw/zinc/18/95/30/1103189530.db2.gz JGIGTXDEDNHGBY-UHFFFAOYSA-N 1 1 356.422 4.085 20 5 FIBDMO Cc1c(CN[C@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000519650531 1103765686 /nfs/dbraw/zinc/76/56/86/1103765686.db2.gz JQGDBROQSPVPLL-FQEVSTJZSA-N 1 1 365.477 4.190 20 5 FIBDMO Cc1c(CN[C@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000519650531 1103765702 /nfs/dbraw/zinc/76/57/02/1103765702.db2.gz JQGDBROQSPVPLL-FQEVSTJZSA-N 1 1 365.477 4.190 20 5 FIBDMO CC[C@H]([NH2+][C@H](CO)c1cccc(Cl)c1F)c1cccc([N+](=O)[O-])c1 ZINC000467416132 1104128402 /nfs/dbraw/zinc/12/84/02/1104128402.db2.gz HEVBDWGNQWEQFF-JKSUJKDBSA-N 1 1 352.793 4.162 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000441380543 1104320169 /nfs/dbraw/zinc/32/01/69/1104320169.db2.gz HKEAEDUXCQUQDP-SECBINFHSA-N 1 1 356.266 4.473 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000441380543 1104320180 /nfs/dbraw/zinc/32/01/80/1104320180.db2.gz HKEAEDUXCQUQDP-SECBINFHSA-N 1 1 356.266 4.473 20 5 FIBDMO C[NH+](C)[C@H](CNCc1csc([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 ZINC000184530477 1104700567 /nfs/dbraw/zinc/70/05/67/1104700567.db2.gz NZUNHUZIJSAAHI-CQSZACIVSA-N 1 1 373.400 4.068 20 5 FIBDMO C[N@@H+](CCCc1ccccc1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536340916 1104764604 /nfs/dbraw/zinc/76/46/04/1104764604.db2.gz IHWURVZDSIHYEC-UHFFFAOYSA-N 1 1 351.406 4.314 20 5 FIBDMO COc1cc(C[N@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000441463403 1104795482 /nfs/dbraw/zinc/79/54/82/1104795482.db2.gz FIULONBKFRERPN-YRGRVCCFSA-N 1 1 370.396 4.358 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000026483406 1107013061 /nfs/dbraw/zinc/01/30/61/1107013061.db2.gz IMZDYVLUCKVQGL-XJKSGUPXSA-N 1 1 359.451 4.129 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000026483406 1107013075 /nfs/dbraw/zinc/01/30/75/1107013075.db2.gz IMZDYVLUCKVQGL-XJKSGUPXSA-N 1 1 359.451 4.129 20 5 FIBDMO C[C@H]1Cc2[nH+]cn(CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)c2C[C@@H]1C ZINC000451341541 1107042950 /nfs/dbraw/zinc/04/29/50/1107042950.db2.gz MFMMEYRRPQBKLG-KBPBESRZSA-N 1 1 366.421 4.060 20 5 FIBDMO CCCCc1noc([C@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548487 1107169031 /nfs/dbraw/zinc/16/90/31/1107169031.db2.gz NSMFHUQYSMTGOB-GOEBONIOSA-N 1 1 358.442 4.261 20 5 FIBDMO CCCCc1noc([C@H](C)[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000451548487 1107169046 /nfs/dbraw/zinc/16/90/46/1107169046.db2.gz NSMFHUQYSMTGOB-GOEBONIOSA-N 1 1 358.442 4.261 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cc(-c4ccco4)on3)C2)cc1 ZINC000451579113 1107190678 /nfs/dbraw/zinc/19/06/78/1107190678.db2.gz YENJDBAXFWIRNO-HNNXBMFYSA-N 1 1 353.378 4.222 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cc(-c4ccco4)on3)C2)cc1 ZINC000451579113 1107190688 /nfs/dbraw/zinc/19/06/88/1107190688.db2.gz YENJDBAXFWIRNO-HNNXBMFYSA-N 1 1 353.378 4.222 20 5 FIBDMO O=[N+]([O-])c1cc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)cs1 ZINC000532243783 1108733929 /nfs/dbraw/zinc/73/39/29/1108733929.db2.gz GOVVADQDHADGBF-RBUKOAKNSA-N 1 1 371.506 4.143 20 5 FIBDMO O=[N+]([O-])c1cc(CN2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)cs1 ZINC000532243782 1108734487 /nfs/dbraw/zinc/73/44/87/1108734487.db2.gz GOVVADQDHADGBF-OALUTQOASA-N 1 1 371.506 4.143 20 5 FIBDMO C[C@@H]1SCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000524035668 1108765696 /nfs/dbraw/zinc/76/56/96/1108765696.db2.gz AEPBTNDZKJWZHG-KXBFYZLASA-N 1 1 358.463 4.152 20 5 FIBDMO COc1ccc(C[N@@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000524037091 1108768259 /nfs/dbraw/zinc/76/82/59/1108768259.db2.gz UHLYSHINKSFVQG-AUUYWEPGSA-N 1 1 358.463 4.282 20 5 FIBDMO COc1ccc(C[N@H+]2CCS[C@H](C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000524037091 1108768269 /nfs/dbraw/zinc/76/82/69/1108768269.db2.gz UHLYSHINKSFVQG-AUUYWEPGSA-N 1 1 358.463 4.282 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(CNc3ncc([N+](=O)[O-])cc3Cl)cc2)C1 ZINC000524581024 1109085004 /nfs/dbraw/zinc/08/50/04/1109085004.db2.gz BMANDMXKADKYBP-CQSZACIVSA-N 1 1 374.872 4.487 20 5 FIBDMO COc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1C ZINC000524666748 1109119775 /nfs/dbraw/zinc/11/97/75/1109119775.db2.gz JBRTZUGRRVMKFQ-UHFFFAOYSA-N 1 1 358.438 4.331 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)cc1C ZINC000524666748 1109119777 /nfs/dbraw/zinc/11/97/77/1109119777.db2.gz JBRTZUGRRVMKFQ-UHFFFAOYSA-N 1 1 358.438 4.331 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1C ZINC000525121584 1109269805 /nfs/dbraw/zinc/26/98/05/1109269805.db2.gz UNOXFXZZUYFOLA-FQEVSTJZSA-N 1 1 368.433 4.415 20 5 FIBDMO COc1cc(C[N@H+]2CCCC(C)(C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000525638556 1109464279 /nfs/dbraw/zinc/46/42/79/1109464279.db2.gz QSNMWBBSZDHTDC-UHFFFAOYSA-N 1 1 358.385 4.217 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2ccccc2C)c([N+](=O)[O-])c1 ZINC000441231186 1109483013 /nfs/dbraw/zinc/48/30/13/1109483013.db2.gz KHLQAPYEFOXXRM-GOSISDBHSA-N 1 1 356.422 4.128 20 5 FIBDMO C[C@H](NC1CC[NH+](CCc2ccc(F)cc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000449347911 1110036954 /nfs/dbraw/zinc/03/69/54/1110036954.db2.gz JUPPXEYBMRPENA-INIZCTEOSA-N 1 1 371.456 4.092 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3C[C@H](C4CC4)[C@H]3C3CC3)cs2)c1 ZINC000449536463 1110103530 /nfs/dbraw/zinc/10/35/30/1110103530.db2.gz IOFDSMRBSCGGIP-QZTJIDSGSA-N 1 1 355.463 4.339 20 5 FIBDMO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449563279 1110111697 /nfs/dbraw/zinc/11/16/97/1110111697.db2.gz UAQOWWXBFHYBRM-CYBMUJFWSA-N 1 1 356.451 4.391 20 5 FIBDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)c2nccn21 ZINC000449569269 1110113662 /nfs/dbraw/zinc/11/36/62/1110113662.db2.gz GNNXHZRTGHUVSK-DOMZBBRYSA-N 1 1 354.435 4.315 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2cccs2)C2(CO)CCC2)c(Cl)c1 ZINC000449770526 1110166076 /nfs/dbraw/zinc/16/60/76/1110166076.db2.gz WRHGMPCECQUKHR-MRXNPFEDSA-N 1 1 366.870 4.303 20 5 FIBDMO Cc1cc(N2CCC(c3[nH]cc[nH+]3)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461784356 1111355497 /nfs/dbraw/zinc/35/54/97/1111355497.db2.gz JIMPETDAFULXDA-UHFFFAOYSA-N 1 1 354.332 4.029 20 5 FIBDMO Cc1cc(NC[C@H]2CCCn3cc[nH+]c32)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461936098 1111431889 /nfs/dbraw/zinc/43/18/89/1111431889.db2.gz QLQMCVRMHXAEHW-LLVKDONJSA-N 1 1 354.332 4.108 20 5 FIBDMO CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000478046333 1111663387 /nfs/dbraw/zinc/66/33/87/1111663387.db2.gz MSJTWEBPEYGVMW-HXUWFJFHSA-N 1 1 368.412 4.042 20 5 FIBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)n1 ZINC000478046787 1111664124 /nfs/dbraw/zinc/66/41/24/1111664124.db2.gz OKWBGFVZSGAFLU-HNNXBMFYSA-N 1 1 368.359 4.037 20 5 FIBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])NC1CC([NH+]2CCCCC2)C1 ZINC000479509698 1112054189 /nfs/dbraw/zinc/05/41/89/1112054189.db2.gz CKHUXTIWQSIKQO-KLAILNCOSA-N 1 1 363.527 4.072 20 5 FIBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC(N2CCCCC2)C1 ZINC000479509698 1112054192 /nfs/dbraw/zinc/05/41/92/1112054192.db2.gz CKHUXTIWQSIKQO-KLAILNCOSA-N 1 1 363.527 4.072 20 5 FIBDMO C[C@@H](c1cc2ccccc2o1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482684374 1113330547 /nfs/dbraw/zinc/33/05/47/1113330547.db2.gz OIWVQHZIAFJXIT-LBPRGKRZSA-N 1 1 350.378 4.410 20 5 FIBDMO C[C@@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482684374 1113330551 /nfs/dbraw/zinc/33/05/51/1113330551.db2.gz OIWVQHZIAFJXIT-LBPRGKRZSA-N 1 1 350.378 4.410 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@@H]3CCc3ccccc3)nc2c1 ZINC000482684495 1113330834 /nfs/dbraw/zinc/33/08/34/1113330834.db2.gz RXFVFSPKUSKJFI-MRXNPFEDSA-N 1 1 350.422 4.068 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c2c(c1)COCO2 ZINC000111306883 1113349578 /nfs/dbraw/zinc/34/95/78/1113349578.db2.gz KNSHXKUFNQWIHP-CQSZACIVSA-N 1 1 374.824 4.104 20 5 FIBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490049811 1114210176 /nfs/dbraw/zinc/21/01/76/1114210176.db2.gz WWWISHZFCRCCEJ-INIZCTEOSA-N 1 1 355.438 4.142 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000490049811 1114210177 /nfs/dbraw/zinc/21/01/77/1114210177.db2.gz WWWISHZFCRCCEJ-INIZCTEOSA-N 1 1 355.438 4.142 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@H](c2c(F)cccc2Cl)[NH+]2CCCC2)nc1 ZINC000029622155 1114340237 /nfs/dbraw/zinc/34/02/37/1114340237.db2.gz QZBIMQLKBJRSKF-OAHLLOKOSA-N 1 1 364.808 4.031 20 5 FIBDMO Cn1cc(C[N@@H+](C)C2CCC(F)(F)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000571688897 1114491519 /nfs/dbraw/zinc/49/15/19/1114491519.db2.gz OXGSWPQASJAVIL-UHFFFAOYSA-N 1 1 364.396 4.005 20 5 FIBDMO CC[C@@H]1c2ccsc2CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000164798166 1114585329 /nfs/dbraw/zinc/58/53/29/1114585329.db2.gz TXPAUDPBZPGGBS-QGZVFWFLSA-N 1 1 373.478 4.303 20 5 FIBDMO C[N@H+](Cc1cccc(OCC(F)(F)F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000056283603 1114682166 /nfs/dbraw/zinc/68/21/66/1114682166.db2.gz UHVBWBXLPXXAAF-UHFFFAOYSA-N 1 1 354.328 4.168 20 5 FIBDMO C[N@@H+](Cc1cccc(OCC(F)(F)F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000056283603 1114682168 /nfs/dbraw/zinc/68/21/68/1114682168.db2.gz UHVBWBXLPXXAAF-UHFFFAOYSA-N 1 1 354.328 4.168 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c1 ZINC000590173499 1114907853 /nfs/dbraw/zinc/90/78/53/1114907853.db2.gz WZKBMWAKGRWGGD-CQSZACIVSA-N 1 1 365.355 4.073 20 5 FIBDMO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H](c1ccc(Cl)cc1)[NH+](C)C ZINC000572972444 1114940434 /nfs/dbraw/zinc/94/04/34/1114940434.db2.gz YFFYRVRNKWIGOY-KRWDZBQOSA-N 1 1 361.829 4.106 20 5 FIBDMO C[N@@H+](CCc1cccc(N[C@H]2CCc3c2cccc3[N+](=O)[O-])c1)C1CC1 ZINC000573741117 1115179748 /nfs/dbraw/zinc/17/97/48/1115179748.db2.gz DWZCJOOKXYNWCF-FQEVSTJZSA-N 1 1 351.450 4.331 20 5 FIBDMO C[C@]1(c2cccc(F)c2)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000593044774 1115281903 /nfs/dbraw/zinc/28/19/03/1115281903.db2.gz BPOVRWPPVIWOGZ-IBGZPJMESA-N 1 1 355.369 4.039 20 5 FIBDMO C[C@]1(c2cccc(F)c2)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000593044774 1115281906 /nfs/dbraw/zinc/28/19/06/1115281906.db2.gz BPOVRWPPVIWOGZ-IBGZPJMESA-N 1 1 355.369 4.039 20 5 FIBDMO CC[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@H]1[NH3+] ZINC000592427719 1115307273 /nfs/dbraw/zinc/30/72/73/1115307273.db2.gz TUCIYQAQAIGIKG-YVEFUNNKSA-N 1 1 363.845 4.067 20 5 FIBDMO C[N@H+](Cc1ccc(F)cc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157796094 1115320087 /nfs/dbraw/zinc/32/00/87/1115320087.db2.gz DRFGSRUPKUOYAS-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO C[N@@H+](Cc1ccc(F)cc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000157796094 1115320089 /nfs/dbraw/zinc/32/00/89/1115320089.db2.gz DRFGSRUPKUOYAS-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC001168404381 1115434777 /nfs/dbraw/zinc/43/47/77/1115434777.db2.gz SUOHCYMFPYJIHW-BYCMXARLSA-N 1 1 353.260 4.368 20 5 FIBDMO Cc1nn(-c2ccc(C)cc2)cc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000594516835 1115458880 /nfs/dbraw/zinc/45/88/80/1115458880.db2.gz GCZSRDVFUARKKV-UHFFFAOYSA-N 1 1 364.449 4.422 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](c1ccccc1)[C@@H]1CCCO1 ZINC000595011239 1115503483 /nfs/dbraw/zinc/50/34/83/1115503483.db2.gz CPUOKVPAXLBDSD-ADLFWFRXSA-N 1 1 356.422 4.174 20 5 FIBDMO CCCC(=O)Nc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595009249 1115508187 /nfs/dbraw/zinc/50/81/87/1115508187.db2.gz GLDAZBFSBWMPRI-AWEZNQCLSA-N 1 1 371.437 4.193 20 5 FIBDMO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ncnc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000595064149 1115508917 /nfs/dbraw/zinc/50/89/17/1115508917.db2.gz DPKDFWXYZDDGIN-MBNYWOFBSA-N 1 1 369.450 4.271 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1cn(C(C)(C)C)nc1C ZINC000595033940 1115510455 /nfs/dbraw/zinc/51/04/55/1115510455.db2.gz UBMVQABMZGXZNC-QWHCGFSZSA-N 1 1 360.458 4.275 20 5 FIBDMO COc1cccc(OC)c1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000595074467 1115516628 /nfs/dbraw/zinc/51/66/28/1115516628.db2.gz SIBIETIRFYMSLF-SFHVURJKSA-N 1 1 356.422 4.169 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccc(OC(C)C)cc2)c1 ZINC000593021364 1115539605 /nfs/dbraw/zinc/53/96/05/1115539605.db2.gz WGCJOLQTUNOEJM-CQSZACIVSA-N 1 1 372.421 4.019 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H](C4CCCCC4)C3)o2)cc1 ZINC000595734501 1115560403 /nfs/dbraw/zinc/56/04/03/1115560403.db2.gz MVAOBTSONTXFNK-MRXNPFEDSA-N 1 1 356.426 4.047 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC000595838769 1115564154 /nfs/dbraw/zinc/56/41/54/1115564154.db2.gz WATDTMOTTAKMJM-XJKSGUPXSA-N 1 1 356.426 4.218 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3ccccc3-n3ccnc32)cc1[N+](=O)[O-] ZINC000596095897 1115571815 /nfs/dbraw/zinc/57/18/15/1115571815.db2.gz QVXJSSCTMDVPNZ-QAPCUYQASA-N 1 1 362.433 4.427 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc(O[C@H]2CCOC2)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000596980194 1115631428 /nfs/dbraw/zinc/63/14/28/1115631428.db2.gz VOARRJMKYOTLBB-NRFANRHFSA-N 1 1 370.449 4.173 20 5 FIBDMO CC(C)(C)OCc1cccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000602528273 1115710448 /nfs/dbraw/zinc/71/04/48/1115710448.db2.gz QZGQVLBGVFXCEP-UHFFFAOYSA-N 1 1 369.421 4.341 20 5 FIBDMO Cc1cc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)ncc1Br ZINC000598966613 1115771651 /nfs/dbraw/zinc/77/16/51/1115771651.db2.gz YVMAPZPESPETDC-UHFFFAOYSA-N 1 1 364.243 4.086 20 5 FIBDMO CCOc1cc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c(F)cc1OC ZINC000598963765 1115771733 /nfs/dbraw/zinc/77/17/33/1115771733.db2.gz CRVBUONODYJCHJ-UHFFFAOYSA-N 1 1 362.401 4.166 20 5 FIBDMO CN(C)C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)c(Cl)c1 ZINC000598998119 1115776186 /nfs/dbraw/zinc/77/61/86/1115776186.db2.gz NQUAIMSVSNLRGY-KRWDZBQOSA-N 1 1 368.264 4.294 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599023292 1115778164 /nfs/dbraw/zinc/77/81/64/1115778164.db2.gz GSWZGAQEIUCWGO-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO COc1ccc(C[N@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000603837397 1115819900 /nfs/dbraw/zinc/81/99/00/1115819900.db2.gz FRNJIAIGFBQKTB-GUYCJALGSA-N 1 1 356.422 4.484 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000603837397 1115819902 /nfs/dbraw/zinc/81/99/02/1115819902.db2.gz FRNJIAIGFBQKTB-GUYCJALGSA-N 1 1 356.422 4.484 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576811 1115827915 /nfs/dbraw/zinc/82/79/15/1115827915.db2.gz USDZGCCHMGCOOF-YCRPNKLZSA-N 1 1 366.417 4.156 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576811 1115827918 /nfs/dbraw/zinc/82/79/18/1115827918.db2.gz USDZGCCHMGCOOF-YCRPNKLZSA-N 1 1 366.417 4.156 20 5 FIBDMO Cc1cccc([C@@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C(C)C)c1 ZINC000599628466 1115831969 /nfs/dbraw/zinc/83/19/69/1115831969.db2.gz UFNIJHIXEVCGGY-IBGZPJMESA-N 1 1 366.421 4.440 20 5 FIBDMO COc1ccc([C@@H]2CCC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604012515 1115840861 /nfs/dbraw/zinc/84/08/61/1115840861.db2.gz KZXIZKRWSUCSQK-FQEVSTJZSA-N 1 1 356.422 4.209 20 5 FIBDMO O=[N+]([O-])c1ccc(NCC[NH+]2Cc3ccccc3C2)c(C(F)(F)F)c1 ZINC000604482907 1115866561 /nfs/dbraw/zinc/86/65/61/1115866561.db2.gz KNBNXGGDNLZZTK-UHFFFAOYSA-N 1 1 351.328 4.041 20 5 FIBDMO COc1ccc(C[N@@H+](C)C[C@@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000604521701 1115867332 /nfs/dbraw/zinc/86/73/32/1115867332.db2.gz UJHYDMFCVYLCPC-RXVVDRJESA-N 1 1 370.449 4.203 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc(CNc2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000063254717 1116031743 /nfs/dbraw/zinc/03/17/43/1116031743.db2.gz ODOYMDJSTUVWEF-UHFFFAOYSA-N 1 1 360.776 4.494 20 5 FIBDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1C ZINC000063619327 1116088258 /nfs/dbraw/zinc/08/82/58/1116088258.db2.gz UOIOQOCHPLMADW-FQEVSTJZSA-N 1 1 368.433 4.415 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000608836068 1116131133 /nfs/dbraw/zinc/13/11/33/1116131133.db2.gz JLZZNZJTCXJDMV-NVXWUHKLSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[N@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000608836068 1116131134 /nfs/dbraw/zinc/13/11/34/1116131134.db2.gz JLZZNZJTCXJDMV-NVXWUHKLSA-N 1 1 357.479 4.040 20 5 FIBDMO Cc1cc(N2CCC(C[N@H+](C)Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000608973167 1116138955 /nfs/dbraw/zinc/13/89/55/1116138955.db2.gz FINVRGMHTWTDSR-UHFFFAOYSA-N 1 1 353.466 4.252 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H](CCO)c1ccccc1 ZINC000539826338 1116386849 /nfs/dbraw/zinc/38/68/49/1116386849.db2.gz OCUJAICQSUXDPC-IBGZPJMESA-N 1 1 366.417 4.410 20 5 FIBDMO COc1cc(C[N@@H+]2CC[C@@](C)(F)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000539923858 1117756871 /nfs/dbraw/zinc/75/68/71/1117756871.db2.gz KJNATTYWNOVLMP-HXUWFJFHSA-N 1 1 374.412 4.116 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@@](C)(F)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000539923858 1117756876 /nfs/dbraw/zinc/75/68/76/1117756876.db2.gz KJNATTYWNOVLMP-HXUWFJFHSA-N 1 1 374.412 4.116 20 5 FIBDMO C[C@@H]([NH2+]C1CCN(CCc2ccc(F)cc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000463276236 1118075320 /nfs/dbraw/zinc/07/53/20/1118075320.db2.gz OZPKFBHNKWDDEF-MRXNPFEDSA-N 1 1 371.456 4.092 20 5 FIBDMO Cc1ccccc1[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000540592443 1118137487 /nfs/dbraw/zinc/13/74/87/1118137487.db2.gz SKIGAALDLFPMCS-IBGZPJMESA-N 1 1 364.405 4.194 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000463433790 1118153431 /nfs/dbraw/zinc/15/34/31/1118153431.db2.gz YJESBRCOWWQDAB-AVRDEDQJSA-N 1 1 368.477 4.281 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000541070779 1118368361 /nfs/dbraw/zinc/36/83/61/1118368361.db2.gz MZDLHPXAUZWQKH-UHFFFAOYSA-N 1 1 371.437 4.088 20 5 FIBDMO O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1cc2ccccc2c2cccnc12 ZINC000464332914 1118530141 /nfs/dbraw/zinc/53/01/41/1118530141.db2.gz IXOGJSHIHIYQRT-IBGZPJMESA-N 1 1 373.500 4.382 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc(F)cc1OC(F)F ZINC000122446014 1118567416 /nfs/dbraw/zinc/56/74/16/1118567416.db2.gz WQHTUNMAWASUEM-SNVBAGLBSA-N 1 1 370.327 4.195 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1nc2ccccc2n1C ZINC000541772265 1118644674 /nfs/dbraw/zinc/64/46/74/1118644674.db2.gz YGCFZUYZRUTQSB-IBGZPJMESA-N 1 1 350.422 4.127 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1nc2ccccc2n1C ZINC000541772265 1118644677 /nfs/dbraw/zinc/64/46/77/1118644677.db2.gz YGCFZUYZRUTQSB-IBGZPJMESA-N 1 1 350.422 4.127 20 5 FIBDMO Cc1cccc([C@H]2CCCC[N@H+]2Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1C ZINC000464771303 1118680961 /nfs/dbraw/zinc/68/09/61/1118680961.db2.gz CZGZJRCPXSUQJK-LJQANCHMSA-N 1 1 367.449 4.038 20 5 FIBDMO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cccnc2)cc1OC ZINC000542123691 1118797631 /nfs/dbraw/zinc/79/76/31/1118797631.db2.gz QXIWWSWXCRQNSF-CABCVRRESA-N 1 1 373.453 4.274 20 5 FIBDMO COc1cccc([C@@H]2C[C@H](C)C[N@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000542247184 1118866670 /nfs/dbraw/zinc/86/66/70/1118866670.db2.gz PMODCCAOWGTOHB-KSSFIOAISA-N 1 1 356.422 4.195 20 5 FIBDMO CC[C@H]1CCCC[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491890274 1118990569 /nfs/dbraw/zinc/99/05/69/1118990569.db2.gz NMNXEASCPHSPFO-ZDUSSCGKSA-N 1 1 358.385 4.012 20 5 FIBDMO COc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(Cl)c1OC ZINC000492041748 1119010580 /nfs/dbraw/zinc/01/05/80/1119010580.db2.gz HGXDJFABARKMEE-UHFFFAOYSA-N 1 1 364.829 4.290 20 5 FIBDMO CCCc1nc(C)c(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000492225747 1119047430 /nfs/dbraw/zinc/04/74/30/1119047430.db2.gz NBZDLWCWHKIYNW-UHFFFAOYSA-N 1 1 355.394 4.394 20 5 FIBDMO COc1cc(C[NH2+][C@H](CC(F)(F)F)c2ccccc2)ccc1[N+](=O)[O-] ZINC000492938398 1119223734 /nfs/dbraw/zinc/22/37/34/1119223734.db2.gz ZOBPFZUIKIHLEC-CQSZACIVSA-N 1 1 354.328 4.387 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000761512879 1119405659 /nfs/dbraw/zinc/40/56/59/1119405659.db2.gz YWUWQRXCGVMUAN-KBRIMQKVSA-N 1 1 352.862 4.274 20 5 FIBDMO O=[N+]([O-])c1ccc(CNC[C@@H](c2ccccc2)[NH+]2CCCC2)cc1Cl ZINC000761518109 1119407973 /nfs/dbraw/zinc/40/79/73/1119407973.db2.gz XMOFCVALGHJGRQ-IBGZPJMESA-N 1 1 359.857 4.175 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](CO)c2ccc(C(F)(F)F)cc2)cc1Cl ZINC000761528283 1119409580 /nfs/dbraw/zinc/40/95/80/1119409580.db2.gz YGOGZZCXLUQECQ-CQSZACIVSA-N 1 1 374.746 4.090 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000494292537 1119821564 /nfs/dbraw/zinc/82/15/64/1119821564.db2.gz GXBGGRDSQYLZGK-NTCAYCPXSA-N 1 1 364.405 4.180 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000494292537 1119821571 /nfs/dbraw/zinc/82/15/71/1119821571.db2.gz GXBGGRDSQYLZGK-NTCAYCPXSA-N 1 1 364.405 4.180 20 5 FIBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3cc(Cl)cs3)CC2)cc1 ZINC000494952237 1120399439 /nfs/dbraw/zinc/39/94/39/1120399439.db2.gz CRMYGTRCOQDKQX-UHFFFAOYSA-N 1 1 352.843 4.353 20 5 FIBDMO CCCOc1ncccc1C[NH2+][C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000153212670 1120473515 /nfs/dbraw/zinc/47/35/15/1120473515.db2.gz ZQIAWGKEAIOLEG-AWEZNQCLSA-N 1 1 359.426 4.028 20 5 FIBDMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCCSc1ccccc1Cl)CC2 ZINC000495465407 1120841175 /nfs/dbraw/zinc/84/11/75/1120841175.db2.gz NOIYPTXQDWULRG-UHFFFAOYSA-N 1 1 363.870 4.184 20 5 FIBDMO C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000916571931 1121548793 /nfs/dbraw/zinc/54/87/93/1121548793.db2.gz UEPQIIXMBQPZHW-QGZVFWFLSA-N 1 1 373.840 4.196 20 5 FIBDMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000301560063 1122220090 /nfs/dbraw/zinc/22/00/90/1122220090.db2.gz UJOJRTFYPFPQCS-JOYOIKCWSA-N 1 1 365.783 4.043 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000542709036 1122310900 /nfs/dbraw/zinc/31/09/00/1122310900.db2.gz GECWAOKPVYBTOW-UYAOXDASSA-N 1 1 358.413 4.394 20 5 FIBDMO CCC[C@H]([NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1)c1nnc2ccccn21 ZINC000129294483 1122566156 /nfs/dbraw/zinc/56/61/56/1122566156.db2.gz DIAHPWNGIVAGEF-SJORKVTESA-N 1 1 353.426 4.220 20 5 FIBDMO COc1ccccc1[C@H]1CCCC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000609280659 1122686794 /nfs/dbraw/zinc/68/67/94/1122686794.db2.gz IUCHUKCNNNCTDM-QGZVFWFLSA-N 1 1 356.422 4.339 20 5 FIBDMO COc1ccccc1[C@H]1CCCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000609280659 1122686795 /nfs/dbraw/zinc/68/67/95/1122686795.db2.gz IUCHUKCNNNCTDM-QGZVFWFLSA-N 1 1 356.422 4.339 20 5 FIBDMO CC[C@@H](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133731 1123160557 /nfs/dbraw/zinc/16/05/57/1123160557.db2.gz UTMQWPPVFSNRLV-GHTZIAJQSA-N 1 1 353.466 4.158 20 5 FIBDMO CC[C@@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133731 1123160562 /nfs/dbraw/zinc/16/05/62/1123160562.db2.gz UTMQWPPVFSNRLV-GHTZIAJQSA-N 1 1 353.466 4.158 20 5 FIBDMO CC[C@@H]([NH2+]C[C@@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133731 1123160569 /nfs/dbraw/zinc/16/05/69/1123160569.db2.gz UTMQWPPVFSNRLV-GHTZIAJQSA-N 1 1 353.466 4.158 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133390 1123160931 /nfs/dbraw/zinc/16/09/31/1123160931.db2.gz DVHASIMOUONSLP-MJGOQNOKSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133390 1123160934 /nfs/dbraw/zinc/16/09/34/1123160934.db2.gz DVHASIMOUONSLP-MJGOQNOKSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133390 1123160936 /nfs/dbraw/zinc/16/09/36/1123160936.db2.gz DVHASIMOUONSLP-MJGOQNOKSA-N 1 1 353.466 4.076 20 5 FIBDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000556959506 1123272823 /nfs/dbraw/zinc/27/28/23/1123272823.db2.gz XCRGGPGNAOJBJF-FQEVSTJZSA-N 1 1 358.438 4.085 20 5 FIBDMO CSc1ccc(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000064350102 1123706158 /nfs/dbraw/zinc/70/61/58/1123706158.db2.gz STOFJBYHUMLKEH-UHFFFAOYSA-N 1 1 373.478 4.166 20 5 FIBDMO CSc1ccc(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000064350102 1123706163 /nfs/dbraw/zinc/70/61/63/1123706163.db2.gz STOFJBYHUMLKEH-UHFFFAOYSA-N 1 1 373.478 4.166 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)C1 ZINC000609441894 1123713840 /nfs/dbraw/zinc/71/38/40/1123713840.db2.gz VFAJAIVNQIBDTL-AWEZNQCLSA-N 1 1 371.412 4.218 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000615834329 1124127583 /nfs/dbraw/zinc/12/75/83/1124127583.db2.gz AOAOUWYRCXSSAW-YULVEUEDSA-N 1 1 352.434 4.462 20 5 FIBDMO CO[C@@]1(C(F)(F)F)CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000615842171 1124134669 /nfs/dbraw/zinc/13/46/69/1124134669.db2.gz FEGMVQOEJMOUPX-WQMJKPAKSA-N 1 1 358.360 4.041 20 5 FIBDMO CC[C@@H]([NH2+][C@H](COC)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000091413298 1124384870 /nfs/dbraw/zinc/38/48/70/1124384870.db2.gz RYTLMUAPEIKKCQ-QZTJIDSGSA-N 1 1 350.365 4.301 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 ZINC000542946061 1124946034 /nfs/dbraw/zinc/94/60/34/1124946034.db2.gz CPFASZZGWBOFRK-QWHCGFSZSA-N 1 1 368.359 4.208 20 5 FIBDMO C[N@@H+](CCCn1ccnc1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000521318266 1125084519 /nfs/dbraw/zinc/08/45/19/1125084519.db2.gz STSTYOMGDNMHJF-UHFFFAOYSA-N 1 1 356.451 4.042 20 5 FIBDMO COc1ccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000113311530 1125149149 /nfs/dbraw/zinc/14/91/49/1125149149.db2.gz GJILXCOTTIMVAR-UHFFFAOYSA-N 1 1 355.419 4.017 20 5 FIBDMO Cc1cc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1F ZINC000113316684 1125149486 /nfs/dbraw/zinc/14/94/86/1125149486.db2.gz ACJXKGVXQLWDRZ-UHFFFAOYSA-N 1 1 357.410 4.456 20 5 FIBDMO CCCOc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1OC ZINC001168699137 1125158772 /nfs/dbraw/zinc/15/87/72/1125158772.db2.gz IPMVVGKSDIHFQX-CYBMUJFWSA-N 1 1 362.401 4.382 20 5 FIBDMO Cc1ccc(C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C(C)C)s1 ZINC000065162658 1125168257 /nfs/dbraw/zinc/16/82/57/1125168257.db2.gz POYDIJURRSKIKV-UHFFFAOYSA-N 1 1 372.450 4.425 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C(C)C)s1 ZINC000065162658 1125168259 /nfs/dbraw/zinc/16/82/59/1125168259.db2.gz POYDIJURRSKIKV-UHFFFAOYSA-N 1 1 372.450 4.425 20 5 FIBDMO CC(C)Oc1ncccc1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000618984045 1125411667 /nfs/dbraw/zinc/41/16/67/1125411667.db2.gz UMWMASLJPVIMCK-SFHVURJKSA-N 1 1 355.438 4.289 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+](C)[C@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000604434693 568292322 /nfs/dbraw/zinc/29/23/22/568292322.db2.gz NCYKKUVHVLHZDW-FQEVSTJZSA-N 1 1 367.449 4.241 20 5 FIBDMO Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000183145715 1125757041 /nfs/dbraw/zinc/75/70/41/1125757041.db2.gz MLKWOAAYYZNAAU-ZDUSSCGKSA-N 1 1 354.385 4.079 20 5 FIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCC(F)(F)CC1 ZINC000558183589 1079664866 /nfs/dbraw/zinc/66/48/66/1079664866.db2.gz PRGMJIQPKRLZRU-UHFFFAOYSA-N 1 1 351.353 4.260 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1ccc(F)cc1F)C(C)C ZINC000430211428 1079968205 /nfs/dbraw/zinc/96/82/05/1079968205.db2.gz JFHXHANUZBDBRT-SFHVURJKSA-N 1 1 350.365 4.369 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)c1 ZINC000134464235 1080240319 /nfs/dbraw/zinc/24/03/19/1080240319.db2.gz PRVWHCBVQRLAGJ-LBPRGKRZSA-N 1 1 371.384 4.450 20 5 FIBDMO Cc1c([C@@H](C)NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000165314214 1080473128 /nfs/dbraw/zinc/47/31/28/1080473128.db2.gz CHRYZXVKITVJDU-QUCCMNQESA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1c([C@@H](C)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000165314214 1080473132 /nfs/dbraw/zinc/47/31/32/1080473132.db2.gz CHRYZXVKITVJDU-QUCCMNQESA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1c([C@@H](C)NC[C@H]2CC[N@H+](CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000165314475 1080473268 /nfs/dbraw/zinc/47/32/68/1080473268.db2.gz CHRYZXVKITVJDU-UYAOXDASSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1c([C@@H](C)NC[C@H]2CC[N@@H+](CCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000165314475 1080473274 /nfs/dbraw/zinc/47/32/74/1080473274.db2.gz CHRYZXVKITVJDU-UYAOXDASSA-N 1 1 367.493 4.118 20 5 FIBDMO Cc1cccc(C(=O)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)c1[N+](=O)[O-] ZINC000157753387 1080484363 /nfs/dbraw/zinc/48/43/63/1080484363.db2.gz GYJWHDSAFDXXOK-KRWDZBQOSA-N 1 1 373.497 4.020 20 5 FIBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000177529375 1081227365 /nfs/dbraw/zinc/22/73/65/1081227365.db2.gz LHXMTJKMHJIUJJ-KSSFIOAISA-N 1 1 364.405 4.023 20 5 FIBDMO CC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001167376284 1081812044 /nfs/dbraw/zinc/81/20/44/1081812044.db2.gz IBWRHGDLDZJIHD-CHWSQXEVSA-N 1 1 353.850 4.087 20 5 FIBDMO CC[C@@H]1CCC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001167376284 1081812053 /nfs/dbraw/zinc/81/20/53/1081812053.db2.gz IBWRHGDLDZJIHD-CHWSQXEVSA-N 1 1 353.850 4.087 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c2ncccc12 ZINC000380205114 1082100576 /nfs/dbraw/zinc/10/05/76/1082100576.db2.gz GRVXJIWNJWRBNH-KRWDZBQOSA-N 1 1 362.433 4.077 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC=C(c2cccnc2)C1 ZINC000581038364 1082286988 /nfs/dbraw/zinc/28/69/88/1082286988.db2.gz GASHRTMZTWRHDG-UHFFFAOYSA-N 1 1 353.422 4.066 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC=C(c2cccnc2)C1 ZINC000581038364 1082286994 /nfs/dbraw/zinc/28/69/94/1082286994.db2.gz GASHRTMZTWRHDG-UHFFFAOYSA-N 1 1 353.422 4.066 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+](CCC(F)(F)F)CC3CC3)co2)cc1 ZINC000119406927 1082694591 /nfs/dbraw/zinc/69/45/91/1082694591.db2.gz YHMYXSFWGRQISJ-UHFFFAOYSA-N 1 1 369.343 4.414 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](CCC(F)(F)F)CC3CC3)co2)cc1 ZINC000119406927 1082694597 /nfs/dbraw/zinc/69/45/97/1082694597.db2.gz YHMYXSFWGRQISJ-UHFFFAOYSA-N 1 1 369.343 4.414 20 5 FIBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000051131994 1082734517 /nfs/dbraw/zinc/73/45/17/1082734517.db2.gz COUNAAVZKVLLTD-WIYYLYMNSA-N 1 1 370.449 4.073 20 5 FIBDMO Cc1ccc([C@@H]2CCCC[N@@H+]2CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC001167481966 1082874352 /nfs/dbraw/zinc/87/43/52/1082874352.db2.gz BKIUSRRGCLNCGJ-FQEVSTJZSA-N 1 1 367.449 4.377 20 5 FIBDMO Cc1ccc([C@@H]2CCCC[N@H+]2CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC001167481966 1082874357 /nfs/dbraw/zinc/87/43/57/1082874357.db2.gz BKIUSRRGCLNCGJ-FQEVSTJZSA-N 1 1 367.449 4.377 20 5 FIBDMO C[N@@H+](CCCCO)Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000471810571 1083027610 /nfs/dbraw/zinc/02/76/10/1083027610.db2.gz OXSLASPJKXNQEK-UHFFFAOYSA-N 1 1 364.829 4.245 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCCCC[C@@H]3c3ccncc3)nc2c1 ZINC000610581233 1083210513 /nfs/dbraw/zinc/21/05/13/1083210513.db2.gz TWUNXUVWVFYOPD-QGZVFWFLSA-N 1 1 352.394 4.248 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCCCC[C@@H]3c3ccncc3)nc2c1 ZINC000610581233 1083210516 /nfs/dbraw/zinc/21/05/16/1083210516.db2.gz TWUNXUVWVFYOPD-QGZVFWFLSA-N 1 1 352.394 4.248 20 5 FIBDMO Cc1ccccc1C[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581843 1083214271 /nfs/dbraw/zinc/21/42/71/1083214271.db2.gz RUNRXQKNFJYRLI-MRXNPFEDSA-N 1 1 351.406 4.252 20 5 FIBDMO CCOC(=O)C(C)(C)C1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000510874406 1083351502 /nfs/dbraw/zinc/35/15/02/1083351502.db2.gz KIYQEYSZRZQOCV-UHFFFAOYSA-N 1 1 368.861 4.050 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](Cn2cnc3ccccc32)C1 ZINC000614235772 1083579889 /nfs/dbraw/zinc/57/98/89/1083579889.db2.gz GIHKHDWMDKNBQZ-IAGOWNOFSA-N 1 1 364.449 4.418 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H](CCC[N@H+]3Cc3ccccc3)C2)s1 ZINC000610808019 1083718106 /nfs/dbraw/zinc/71/81/06/1083718106.db2.gz PRJKUWMPGDURGZ-SJORKVTESA-N 1 1 357.479 4.147 20 5 FIBDMO C[C@@H]([NH2+][C@H](CN1CCCCC1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610809705 1083719072 /nfs/dbraw/zinc/71/90/72/1083719072.db2.gz PVVYUSJOUKHGOU-DYESRHJHSA-N 1 1 353.466 4.473 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000548934102 1083856008 /nfs/dbraw/zinc/85/60/08/1083856008.db2.gz RIWFJKQOQGGMCX-KRWDZBQOSA-N 1 1 369.465 4.022 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@H](C)[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000548934102 1083856018 /nfs/dbraw/zinc/85/60/18/1083856018.db2.gz RIWFJKQOQGGMCX-KRWDZBQOSA-N 1 1 369.465 4.022 20 5 FIBDMO CCOc1cc(C[NH2+][C@@H](COC)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000580625840 1084444760 /nfs/dbraw/zinc/44/47/60/1084444760.db2.gz FTXRXVSCNHHZTG-INIZCTEOSA-N 1 1 364.829 4.124 20 5 FIBDMO CCO[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])C12CCCCC2 ZINC001167539406 1084494552 /nfs/dbraw/zinc/49/45/52/1084494552.db2.gz MQIIWLUUIIIFGX-MSOLQXFVSA-N 1 1 350.434 4.294 20 5 FIBDMO Cc1ccc(-c2nc(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])co2)cc1 ZINC000511060975 1084521918 /nfs/dbraw/zinc/52/19/18/1084521918.db2.gz VZYJUVFYAZUVOB-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO Cc1ccc(-c2nc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])co2)cc1 ZINC000511060975 1084521933 /nfs/dbraw/zinc/52/19/33/1084521933.db2.gz VZYJUVFYAZUVOB-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO COc1cc(C[NH+]2CCC(c3ccsc3)CC2)c([N+](=O)[O-])cc1OC ZINC000188693865 1085059482 /nfs/dbraw/zinc/05/94/82/1085059482.db2.gz CDTIREMOJFHHOB-UHFFFAOYSA-N 1 1 362.451 4.053 20 5 FIBDMO Cc1ccc(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-] ZINC000127816030 1085114073 /nfs/dbraw/zinc/11/40/73/1085114073.db2.gz KHEPOCTVIYYOGE-INIZCTEOSA-N 1 1 351.406 4.424 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000479446891 1085164712 /nfs/dbraw/zinc/16/47/12/1085164712.db2.gz OWHJNKBTZRUEGR-AVRDEDQJSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@@H]1CC[N@@H+](Cc3ccccc3)C1)CCC2 ZINC000479446891 1085164720 /nfs/dbraw/zinc/16/47/20/1085164720.db2.gz OWHJNKBTZRUEGR-AVRDEDQJSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCN(Cc3ccccc3)C1)CCC2 ZINC000479446891 1085164727 /nfs/dbraw/zinc/16/47/27/1085164727.db2.gz OWHJNKBTZRUEGR-AVRDEDQJSA-N 1 1 365.477 4.084 20 5 FIBDMO CC[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccc(C)cc1 ZINC000181698555 1085210106 /nfs/dbraw/zinc/21/01/06/1085210106.db2.gz WTODUDKSAIXODV-QGZVFWFLSA-N 1 1 352.394 4.194 20 5 FIBDMO C[C@H]1c2ccccc2CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000106862135 1085234054 /nfs/dbraw/zinc/23/40/54/1085234054.db2.gz MRCPVMBJDNRVHL-HNNXBMFYSA-N 1 1 363.417 4.412 20 5 FIBDMO COc1cc(C[N@H+](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000053781443 1085287539 /nfs/dbraw/zinc/28/75/39/1085287539.db2.gz NFNKALPCNHBDQL-LBPRGKRZSA-N 1 1 366.364 4.398 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000053781443 1085287549 /nfs/dbraw/zinc/28/75/49/1085287549.db2.gz NFNKALPCNHBDQL-LBPRGKRZSA-N 1 1 366.364 4.398 20 5 FIBDMO COC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccc(F)cc1 ZINC000549536662 1085467249 /nfs/dbraw/zinc/46/72/49/1085467249.db2.gz VFGNTGPFVHUDBZ-MRXNPFEDSA-N 1 1 372.318 4.230 20 5 FIBDMO CCCCc1oc2ccccc2c1C[N@@H+](C)CCn1c(C)ncc1[N+](=O)[O-] ZINC000611563998 1085492877 /nfs/dbraw/zinc/49/28/77/1085492877.db2.gz HUMVQBITZYWYNW-UHFFFAOYSA-N 1 1 370.453 4.321 20 5 FIBDMO CC[C@@H]([NH2+]Cc1ccn(-c2c(F)cccc2F)n1)c1cccc([N+](=O)[O-])c1 ZINC000181765715 1085540938 /nfs/dbraw/zinc/54/09/38/1085540938.db2.gz JHQZUOAWXCKQQV-GOSISDBHSA-N 1 1 372.375 4.300 20 5 FIBDMO CCC[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccccc1 ZINC000181780720 1085555513 /nfs/dbraw/zinc/55/55/13/1085555513.db2.gz OBGRGCLHMOZFAC-KRWDZBQOSA-N 1 1 352.394 4.276 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1ccccc1F)C1CC1 ZINC000109092983 1085584615 /nfs/dbraw/zinc/58/46/15/1085584615.db2.gz MUPNSZGDPBRYRA-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](C)c1ccccc1F ZINC000109102147 1085588777 /nfs/dbraw/zinc/58/87/77/1085588777.db2.gz AYCFWRSDLRWNMZ-AWEZNQCLSA-N 1 1 359.401 4.064 20 5 FIBDMO CO[C@@H]1CCC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000611984139 1085722415 /nfs/dbraw/zinc/72/24/15/1085722415.db2.gz KNZJRJLEYJEPSG-LJQANCHMSA-N 1 1 369.465 4.364 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@H](CCO)c2ccc(Cl)c(Cl)c2)cs1 ZINC000512178166 1086893368 /nfs/dbraw/zinc/89/33/68/1086893368.db2.gz IFTMFWGOPVJMJU-CYBMUJFWSA-N 1 1 361.250 4.176 20 5 FIBDMO Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)n1 ZINC000541007206 1088205806 /nfs/dbraw/zinc/20/58/06/1088205806.db2.gz REVAIYSJRSZSMM-YOEHRIQHSA-N 1 1 360.483 4.163 20 5 FIBDMO CC(C)[C@@H]1[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000430088007 1088964013 /nfs/dbraw/zinc/96/40/13/1088964013.db2.gz USXROFSEKPUXJC-IBGZPJMESA-N 1 1 354.454 4.006 20 5 FIBDMO Cc1ccc([C@]2(C)CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)cc1 ZINC000434752025 1089022401 /nfs/dbraw/zinc/02/24/01/1089022401.db2.gz KMKZNRHIFMDGDM-HXUWFJFHSA-N 1 1 351.406 4.208 20 5 FIBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000434751049 1089029610 /nfs/dbraw/zinc/02/96/10/1089029610.db2.gz BGNXUBDOPQKKBX-MRXNPFEDSA-N 1 1 355.438 4.152 20 5 FIBDMO Cc1ccc(C[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C(C)C)s1 ZINC000434828744 1089056715 /nfs/dbraw/zinc/05/67/15/1089056715.db2.gz NZERRBFNIOUWEX-UHFFFAOYSA-N 1 1 361.467 4.122 20 5 FIBDMO Cc1ccc(C[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C(C)C)s1 ZINC000434828744 1089056730 /nfs/dbraw/zinc/05/67/30/1089056730.db2.gz NZERRBFNIOUWEX-UHFFFAOYSA-N 1 1 361.467 4.122 20 5 FIBDMO COCC[N@@H+](C)CC[C@H](Nc1ccc([N+](=O)[O-])c(C)c1)c1ccccc1 ZINC000505559822 1089109155 /nfs/dbraw/zinc/10/91/55/1089109155.db2.gz NKRLOUNMXQJYKS-IBGZPJMESA-N 1 1 357.454 4.025 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2ccc(F)cc2)no1 ZINC000549174335 1089129634 /nfs/dbraw/zinc/12/96/34/1089129634.db2.gz XHMWBJMMGOFVBI-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO CC1CCC(OC2CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC2)CC1 ZINC000435058271 1089244251 /nfs/dbraw/zinc/24/42/51/1089244251.db2.gz LZUPBENZWNXGKU-UHFFFAOYSA-N 1 1 373.453 4.296 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(Cc4ccccc4F)CC3)nc2c1 ZINC000435060039 1089247914 /nfs/dbraw/zinc/24/79/14/1089247914.db2.gz ZWOPWQXMBMXKFE-UHFFFAOYSA-N 1 1 369.396 4.330 20 5 FIBDMO C[N@@H+](CCCCCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000435044330 1089251272 /nfs/dbraw/zinc/25/12/72/1089251272.db2.gz FMEPEEVDHSTUGY-UHFFFAOYSA-N 1 1 362.401 4.121 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425369752 1089611815 /nfs/dbraw/zinc/61/18/15/1089611815.db2.gz HUSIXFFYJMKZGG-VMTBQTDASA-N 1 1 356.466 4.279 20 5 FIBDMO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)c1 ZINC000104663314 1090288931 /nfs/dbraw/zinc/28/89/31/1090288931.db2.gz PHKKUFAGCZKJPG-CQSZACIVSA-N 1 1 374.437 4.250 20 5 FIBDMO CC[N@@H+](C)CCNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000236870458 1090942435 /nfs/dbraw/zinc/94/24/35/1090942435.db2.gz VFQUMLWECCALAQ-UHFFFAOYSA-N 1 1 363.845 4.082 20 5 FIBDMO CCN(C)CC[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000236870458 1090942438 /nfs/dbraw/zinc/94/24/38/1090942438.db2.gz VFQUMLWECCALAQ-UHFFFAOYSA-N 1 1 363.845 4.082 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cccc(C[NH+]2CCCC2)c1 ZINC000123034341 1090995730 /nfs/dbraw/zinc/99/57/30/1090995730.db2.gz CQDPBPJMZBIAJJ-QGZVFWFLSA-N 1 1 353.466 4.350 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]CCC(=O)OC(C)(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541546454 1091193101 /nfs/dbraw/zinc/19/31/01/1091193101.db2.gz WLRUOSFFQAJSDM-IBGZPJMESA-N 1 1 374.437 4.161 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H]3c3cccs3)n2)cc1 ZINC000047406648 1091715380 /nfs/dbraw/zinc/71/53/80/1091715380.db2.gz TYRIEZNAKCSDIX-AWEZNQCLSA-N 1 1 356.407 4.043 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]3c3cccs3)n2)cc1 ZINC000047406648 1091715384 /nfs/dbraw/zinc/71/53/84/1091715384.db2.gz TYRIEZNAKCSDIX-AWEZNQCLSA-N 1 1 356.407 4.043 20 5 FIBDMO C[C@@H]1C[C@@]1([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(Cl)cc1 ZINC000500463125 1092104146 /nfs/dbraw/zinc/10/41/46/1092104146.db2.gz NWTCPZXFBUMPBK-BLVKFPJESA-N 1 1 374.824 4.140 20 5 FIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000443075201 1092935358 /nfs/dbraw/zinc/93/53/58/1092935358.db2.gz ZEEULPWEPKMUPR-LPHOPBHVSA-N 1 1 369.465 4.362 20 5 FIBDMO CC(C)[C@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)N1CCCC1 ZINC000521819679 1092936780 /nfs/dbraw/zinc/93/67/80/1092936780.db2.gz VKUPUAZCYOMFAH-IBGZPJMESA-N 1 1 357.454 4.065 20 5 FIBDMO COc1cc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])ccc1SC ZINC000512706028 1093176094 /nfs/dbraw/zinc/17/60/94/1093176094.db2.gz UGNRKXCMPHVAMX-SOFGYWHQSA-N 1 1 358.463 4.471 20 5 FIBDMO C[C@H](CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1)[N@H+]1CCCC[C@@H]1C ZINC000522196447 1093200522 /nfs/dbraw/zinc/20/05/22/1093200522.db2.gz ZUDNFUTVYPFUEH-LSDHHAIUSA-N 1 1 374.510 4.071 20 5 FIBDMO COc1ccc(C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)cc1[N+](=O)[O-] ZINC000522384798 1093464348 /nfs/dbraw/zinc/46/43/48/1093464348.db2.gz TYQRWEZVHUVJKE-UHFFFAOYSA-N 1 1 374.343 4.431 20 5 FIBDMO CC[C@@H]1COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000509831611 1093470467 /nfs/dbraw/zinc/47/04/67/1093470467.db2.gz FTKQWLFMWPZVSS-GFCCVEGCSA-N 1 1 350.802 4.119 20 5 FIBDMO CC[C@@H]1COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000509831611 1093470477 /nfs/dbraw/zinc/47/04/77/1093470477.db2.gz FTKQWLFMWPZVSS-GFCCVEGCSA-N 1 1 350.802 4.119 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC(OC3CCC3)CC2)c1 ZINC000419310840 1093554372 /nfs/dbraw/zinc/55/43/72/1093554372.db2.gz XOELGBJTAUTZCZ-UHFFFAOYSA-N 1 1 358.360 4.147 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](c4cccc(Cl)c4)C3)nc2c1 ZINC000433318953 1093579796 /nfs/dbraw/zinc/57/97/96/1093579796.db2.gz PNXXPGIKNMHXMF-CYBMUJFWSA-N 1 1 356.813 4.114 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](c4cccc(Cl)c4)C3)nc2c1 ZINC000433318953 1093579804 /nfs/dbraw/zinc/57/98/04/1093579804.db2.gz PNXXPGIKNMHXMF-CYBMUJFWSA-N 1 1 356.813 4.114 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@H](c4nccs4)C3)cs2)c1 ZINC000895580531 1093618444 /nfs/dbraw/zinc/61/84/44/1093618444.db2.gz GVSWDFDFOAEXFQ-ZDUSSCGKSA-N 1 1 372.475 4.164 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@H](c4nccs4)C3)cs2)c1 ZINC000895580531 1093618450 /nfs/dbraw/zinc/61/84/50/1093618450.db2.gz GVSWDFDFOAEXFQ-ZDUSSCGKSA-N 1 1 372.475 4.164 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000397994578 1093799810 /nfs/dbraw/zinc/79/98/10/1093799810.db2.gz RTWHSRYXVYHRIN-DNVCBOLYSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000397994578 1093799814 /nfs/dbraw/zinc/79/98/14/1093799814.db2.gz RTWHSRYXVYHRIN-DNVCBOLYSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000398026244 1093809147 /nfs/dbraw/zinc/80/91/47/1093809147.db2.gz CHTUPVPDYBMGJV-LLGFUMIMSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000513256248 1094039451 /nfs/dbraw/zinc/03/94/51/1094039451.db2.gz KQNPVTOAACKDIR-KSSFIOAISA-N 1 1 364.405 4.228 20 5 FIBDMO CCC[C@H]([NH2+][C@H]1CCCn2nc(C(C)C)nc21)c1cccc([N+](=O)[O-])c1 ZINC000167982637 1094284749 /nfs/dbraw/zinc/28/47/49/1094284749.db2.gz TXASDSIJLJFBFU-IRXDYDNUSA-N 1 1 357.458 4.276 20 5 FIBDMO CC(C)CC1(C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000513696954 1094361152 /nfs/dbraw/zinc/36/11/52/1094361152.db2.gz HJPGJFZZROEVSP-GOSISDBHSA-N 1 1 356.470 4.224 20 5 FIBDMO CCCn1nccc1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000501546074 1094768754 /nfs/dbraw/zinc/76/87/54/1094768754.db2.gz LVUFUWXRWPFHLP-UHFFFAOYSA-N 1 1 362.861 4.234 20 5 FIBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000444239936 1095895842 /nfs/dbraw/zinc/89/58/42/1095895842.db2.gz CUTLIIQQFIWKEG-RKVPGOIHSA-N 1 1 355.438 4.445 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)CC(=O)Nc1ccccc1 ZINC000502890695 1095924529 /nfs/dbraw/zinc/92/45/29/1095924529.db2.gz CIXVOEUBPPYCIA-MRXNPFEDSA-N 1 1 355.438 4.224 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000503437663 1096402175 /nfs/dbraw/zinc/40/21/75/1096402175.db2.gz FOINJGUOMDBYGI-AWEZNQCLSA-N 1 1 374.872 4.161 20 5 FIBDMO CCCCN1CCC([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000513790472 1096436429 /nfs/dbraw/zinc/43/64/29/1096436429.db2.gz YKRSDVXULWEMLW-YLJYHZDGSA-N 1 1 359.514 4.160 20 5 FIBDMO CC[C@H](C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000504230908 1096713810 /nfs/dbraw/zinc/71/38/10/1096713810.db2.gz WQVGQMKAYIUTHO-INIZCTEOSA-N 1 1 355.438 4.224 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](Cc1ccccc1F)C(C)C ZINC000533250713 1098911806 /nfs/dbraw/zinc/91/18/06/1098911806.db2.gz JPMHQXMVCMVAJS-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](c3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000533435036 1099053749 /nfs/dbraw/zinc/05/37/49/1099053749.db2.gz HYLFWBLEDRUPIH-QILLFSRXSA-N 1 1 367.449 4.108 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000505844968 1099106857 /nfs/dbraw/zinc/10/68/57/1099106857.db2.gz JEQXJCHGDLZBFS-HJCTWCACSA-N 1 1 365.433 4.020 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000505844968 1099106861 /nfs/dbraw/zinc/10/68/61/1099106861.db2.gz JEQXJCHGDLZBFS-HJCTWCACSA-N 1 1 365.433 4.020 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)c2c(c1)COCO2 ZINC000505880413 1099307699 /nfs/dbraw/zinc/30/76/99/1099307699.db2.gz TYBTXSCPYSUKED-SGQUHAKNSA-N 1 1 366.417 4.139 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2/C=C/c2ccccc2)c2c(c1)COCO2 ZINC000505880413 1099307711 /nfs/dbraw/zinc/30/77/11/1099307711.db2.gz TYBTXSCPYSUKED-SGQUHAKNSA-N 1 1 366.417 4.139 20 5 FIBDMO CC1(C)C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1[C@H]1CCCO1 ZINC000516357245 1099407762 /nfs/dbraw/zinc/40/77/62/1099407762.db2.gz TZNNOCNOJBFYSX-MOPGFXCFSA-N 1 1 356.422 4.244 20 5 FIBDMO C[C@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000536667726 1100125609 /nfs/dbraw/zinc/12/56/09/1100125609.db2.gz OJWHBZHYXGCNNB-QWHCGFSZSA-N 1 1 364.829 4.244 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1OC(F)F ZINC000506202279 1100580673 /nfs/dbraw/zinc/58/06/73/1100580673.db2.gz GSKWJKMPVTVSTR-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO CC[C@H](CSC)[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000518011824 1100862675 /nfs/dbraw/zinc/86/26/75/1100862675.db2.gz VMCXFCSZGUKSQG-CQSZACIVSA-N 1 1 351.497 4.292 20 5 FIBDMO CC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCO1 ZINC000506368528 1100933240 /nfs/dbraw/zinc/93/32/40/1100933240.db2.gz IXNJJXTZQYMSJK-ZDUSSCGKSA-N 1 1 350.802 4.119 20 5 FIBDMO CC[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCO1 ZINC000506368528 1100933243 /nfs/dbraw/zinc/93/32/43/1100933243.db2.gz IXNJJXTZQYMSJK-ZDUSSCGKSA-N 1 1 350.802 4.119 20 5 FIBDMO C[N@@H+](CCc1ccccc1)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000506382262 1100946466 /nfs/dbraw/zinc/94/64/66/1100946466.db2.gz PJOJQSVEKUNBAI-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000439312462 1101325654 /nfs/dbraw/zinc/32/56/54/1101325654.db2.gz FDJUYLGLSILTPI-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000439329448 1101350892 /nfs/dbraw/zinc/35/08/92/1101350892.db2.gz VHWPAHPFQGTXGK-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](c2ccccc2)C[C@@H]1C ZINC000439329448 1101350904 /nfs/dbraw/zinc/35/09/04/1101350904.db2.gz VHWPAHPFQGTXGK-FUHWJXTLSA-N 1 1 367.449 4.110 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[NH+]1CCC(C)CC1 ZINC000518786215 1101566963 /nfs/dbraw/zinc/56/69/63/1101566963.db2.gz VJBRBCBGCGFBRQ-INIZCTEOSA-N 1 1 357.454 4.065 20 5 FIBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)c2C1 ZINC000518789787 1101572402 /nfs/dbraw/zinc/57/24/02/1101572402.db2.gz CJNLISDELVZPCC-UHFFFAOYSA-N 1 1 371.412 4.348 20 5 FIBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(Br)cc2Cl)c1 ZINC000133827465 1102368077 /nfs/dbraw/zinc/36/80/77/1102368077.db2.gz IEDRXSYJIZPJCK-UHFFFAOYSA-N 1 1 355.619 4.301 20 5 FIBDMO COc1cc(C[N@@H+]2CCC2(C)C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000537635816 1102381736 /nfs/dbraw/zinc/38/17/36/1102381736.db2.gz YSNYBTBDWPYDCT-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO COc1cc(C[N@H+]2CCC2(C)C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000537635816 1102381742 /nfs/dbraw/zinc/38/17/42/1102381742.db2.gz YSNYBTBDWPYDCT-UHFFFAOYSA-N 1 1 356.422 4.167 20 5 FIBDMO CC(C)[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccc(F)cc1 ZINC000532490156 1102430163 /nfs/dbraw/zinc/43/01/63/1102430163.db2.gz QOFRXEHMERWGJQ-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO CC(C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccc(F)cc1 ZINC000532490156 1102430168 /nfs/dbraw/zinc/43/01/68/1102430168.db2.gz QOFRXEHMERWGJQ-UHFFFAOYSA-N 1 1 370.384 4.195 20 5 FIBDMO Cc1ccc([C@@H]2CCCCC[N@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000532570720 1102493255 /nfs/dbraw/zinc/49/32/55/1102493255.db2.gz CCKALSRZPAMOSJ-SFHVURJKSA-N 1 1 371.437 4.076 20 5 FIBDMO Cc1ccc([C@@H]2CCCCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000532570720 1102493260 /nfs/dbraw/zinc/49/32/60/1102493260.db2.gz CCKALSRZPAMOSJ-SFHVURJKSA-N 1 1 371.437 4.076 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCOC(C)(C)C1 ZINC000550105053 1102493863 /nfs/dbraw/zinc/49/38/63/1102493863.db2.gz GMNDLDFNIVIYJG-AWEZNQCLSA-N 1 1 360.376 4.393 20 5 FIBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000537647005 1102639868 /nfs/dbraw/zinc/63/98/68/1102639868.db2.gz FWNZGJKNGCABNZ-KRWDZBQOSA-N 1 1 369.465 4.019 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000537660106 1102784695 /nfs/dbraw/zinc/78/46/95/1102784695.db2.gz ZDQHOGMJNKSCNM-VFNWGFHPSA-N 1 1 362.433 4.188 20 5 FIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000507160824 1103160208 /nfs/dbraw/zinc/16/02/08/1103160208.db2.gz NMBRUEPRQLEUPK-GOSISDBHSA-N 1 1 356.422 4.121 20 5 FIBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@@H](OCC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000536638812 1103176581 /nfs/dbraw/zinc/17/65/81/1103176581.db2.gz JVWCHDZGVPWWAG-CQSZACIVSA-N 1 1 360.376 4.262 20 5 FIBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H](OCC(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000536638812 1103176594 /nfs/dbraw/zinc/17/65/94/1103176594.db2.gz JVWCHDZGVPWWAG-CQSZACIVSA-N 1 1 360.376 4.262 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2c[nH]nc2-c2ccc(F)cc2)C2CC2)cc1 ZINC000507170136 1103186945 /nfs/dbraw/zinc/18/69/45/1103186945.db2.gz ZIPVDIFAZNFHGZ-UHFFFAOYSA-N 1 1 366.396 4.289 20 5 FIBDMO C[C@@H]([NH2+]Cc1cc(F)c(F)cc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000507242327 1103238338 /nfs/dbraw/zinc/23/83/38/1103238338.db2.gz FLEHVRVIFDWQFV-SECBINFHSA-N 1 1 371.181 4.486 20 5 FIBDMO Cc1ccc(C[NH2+]Cc2cc(Br)ccc2F)cc1[N+](=O)[O-] ZINC000041065491 1103594666 /nfs/dbraw/zinc/59/46/66/1103594666.db2.gz AHDXADTUOSJWIT-UHFFFAOYSA-N 1 1 353.191 4.095 20 5 FIBDMO CC[C@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1cccc([N+](=O)[O-])c1 ZINC000467416130 1104126244 /nfs/dbraw/zinc/12/62/44/1104126244.db2.gz HEVBDWGNQWEQFF-HOTGVXAUSA-N 1 1 352.793 4.162 20 5 FIBDMO CC[C@@H]([NH2+][C@@H](CO)c1cccc(Cl)c1F)c1cccc([N+](=O)[O-])c1 ZINC000467416129 1104126317 /nfs/dbraw/zinc/12/63/17/1104126317.db2.gz HEVBDWGNQWEQFF-CVEARBPZSA-N 1 1 352.793 4.162 20 5 FIBDMO COc1ccc(OCC[N@H+]2C[C@@H](C)C[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000441338162 1104282244 /nfs/dbraw/zinc/28/22/44/1104282244.db2.gz SHXVDYDTCUTSQQ-KBXCAEBGSA-N 1 1 374.412 4.204 20 5 FIBDMO COc1ccc(OCC[N@H+](Cc2ccc(F)cc2)CC2CC2)c([N+](=O)[O-])c1 ZINC000441397741 1104330004 /nfs/dbraw/zinc/33/00/04/1104330004.db2.gz FWCOBMRWJTVMKL-UHFFFAOYSA-N 1 1 374.412 4.034 20 5 FIBDMO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1c(F)cccc1F ZINC000550337138 1104359344 /nfs/dbraw/zinc/35/93/44/1104359344.db2.gz JNLXKYUYTXSJBD-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1c(F)cccc1F ZINC000550337138 1104359357 /nfs/dbraw/zinc/35/93/57/1104359357.db2.gz JNLXKYUYTXSJBD-UHFFFAOYSA-N 1 1 373.359 4.203 20 5 FIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCc2ccccc2C1 ZINC000536365866 1104819935 /nfs/dbraw/zinc/81/99/35/1104819935.db2.gz QNTPNSVDBSKCTJ-HXUWFJFHSA-N 1 1 363.417 4.239 20 5 FIBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cc2cccc(F)c2o1 ZINC000473989325 1104885491 /nfs/dbraw/zinc/88/54/91/1104885491.db2.gz LPAKKYKXYLFBDZ-LLVKDONJSA-N 1 1 372.352 4.197 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000520786402 1105279891 /nfs/dbraw/zinc/27/98/91/1105279891.db2.gz JBRXISBOIYZNNQ-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO CCc1ccc([C@H]([NH2+]C[C@@H]2CCC(C)(C)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427957727 1105327885 /nfs/dbraw/zinc/32/78/85/1105327885.db2.gz LAQXVCIISQQLCG-PKOBYXMFSA-N 1 1 358.438 4.387 20 5 FIBDMO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]2CCCC[C@H]21 ZINC000543906029 1106847826 /nfs/dbraw/zinc/84/78/26/1106847826.db2.gz QRAAUPGEECQNQG-FHLIZLRMSA-N 1 1 355.438 4.303 20 5 FIBDMO C[C@@H]1Cc2c([nH+]cn2CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C ZINC000451341543 1107042768 /nfs/dbraw/zinc/04/27/68/1107042768.db2.gz MFMMEYRRPQBKLG-UONOGXRCSA-N 1 1 366.421 4.060 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nc(-c4cccs4)no3)C2)cc1 ZINC000451555497 1107174142 /nfs/dbraw/zinc/17/41/42/1107174142.db2.gz BTICLNKXRNGUHE-CQSZACIVSA-N 1 1 370.434 4.086 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc(-c4cccs4)no3)C2)cc1 ZINC000451555497 1107174150 /nfs/dbraw/zinc/17/41/50/1107174150.db2.gz BTICLNKXRNGUHE-CQSZACIVSA-N 1 1 370.434 4.086 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CC3(CCC3)[C@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000451848890 1107340395 /nfs/dbraw/zinc/34/03/95/1107340395.db2.gz GZDDHGUEEYGZJI-LJQANCHMSA-N 1 1 369.421 4.052 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)OCc2c(F)cccc2[N+](=O)[O-])cc1)C(C)C ZINC000728997371 1107386919 /nfs/dbraw/zinc/38/69/19/1107386919.db2.gz NAZLOSSNGUXZDX-UHFFFAOYSA-N 1 1 374.412 4.321 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1)C1CC1 ZINC000452183349 1107516073 /nfs/dbraw/zinc/51/60/73/1107516073.db2.gz OSPHHQUFDWGLDQ-HNNXBMFYSA-N 1 1 367.449 4.070 20 5 FIBDMO CCN(CC)C(=O)[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000531203848 1107646107 /nfs/dbraw/zinc/64/61/07/1107646107.db2.gz YHNKBCYOXNDDDV-OXJNMPFZSA-N 1 1 369.465 4.164 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](c4ccc(Cl)cc4)C3)nc2c1 ZINC000444656127 1108052714 /nfs/dbraw/zinc/05/27/14/1108052714.db2.gz ZNXRBIFBEMMDOI-CYBMUJFWSA-N 1 1 356.813 4.114 20 5 FIBDMO Cc1cc(C[N@@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1F ZINC000444727748 1108137382 /nfs/dbraw/zinc/13/73/82/1108137382.db2.gz CVIQOYDCOALCKA-CYBMUJFWSA-N 1 1 370.384 4.285 20 5 FIBDMO Cc1cc(C[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1F ZINC000444727748 1108137391 /nfs/dbraw/zinc/13/73/91/1108137391.db2.gz CVIQOYDCOALCKA-CYBMUJFWSA-N 1 1 370.384 4.285 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000520279259 1108276560 /nfs/dbraw/zinc/27/65/60/1108276560.db2.gz UCOYGFUUVCQICD-SFHVURJKSA-N 1 1 360.841 4.120 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1sc(C)cc1Br ZINC000453579057 1108641798 /nfs/dbraw/zinc/64/17/98/1108641798.db2.gz ACTHHFNRBKOFHR-UHFFFAOYSA-N 1 1 371.256 4.026 20 5 FIBDMO O=[N+]([O-])c1ccccc1CN1CC[C@H]2[C@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000532244181 1108733848 /nfs/dbraw/zinc/73/38/48/1108733848.db2.gz XIRHIXTVWMNIEQ-CTNGQTDRSA-N 1 1 365.477 4.081 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](CO)c2ccc(Cl)cc2C(F)(F)F)cc1 ZINC000475633899 1108951111 /nfs/dbraw/zinc/95/11/11/1108951111.db2.gz KKGQPMVGBCPAPN-HNNXBMFYSA-N 1 1 374.746 4.090 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@@H]2c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC000441208061 1109453201 /nfs/dbraw/zinc/45/32/01/1109453201.db2.gz NUWQDLJECOAJAC-GOSISDBHSA-N 1 1 356.422 4.128 20 5 FIBDMO Cc1ccc(C[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C(C)C)s1 ZINC000144922395 1109465127 /nfs/dbraw/zinc/46/51/27/1109465127.db2.gz LZTKYYPOWUSXGA-UHFFFAOYSA-N 1 1 361.467 4.122 20 5 FIBDMO Cc1ccc(C[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C(C)C)s1 ZINC000144922395 1109465130 /nfs/dbraw/zinc/46/51/30/1109465130.db2.gz LZTKYYPOWUSXGA-UHFFFAOYSA-N 1 1 361.467 4.122 20 5 FIBDMO C[C@@H](O)C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H](C)Cc1ccc(Cl)cc1 ZINC000441234956 1109504606 /nfs/dbraw/zinc/50/46/06/1109504606.db2.gz RMEHUYASLXRPKS-CHWSQXEVSA-N 1 1 368.886 4.124 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H](CN1CCCC1)c1ccccc1)CCC2 ZINC000447533933 1109569527 /nfs/dbraw/zinc/56/95/27/1109569527.db2.gz ZJVOOHDAIKQWEB-FCHUYYIVSA-N 1 1 365.477 4.399 20 5 FIBDMO COc1cc(C[N@H+]2[C@H](C)C[C@@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000526989468 1109660911 /nfs/dbraw/zinc/66/09/11/1109660911.db2.gz HOORTPGIUCSPJB-GASCZTMLSA-N 1 1 356.422 4.165 20 5 FIBDMO COc1cc(C[N@@H+]2[C@H](C)C[C@@H]2C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000526989468 1109660912 /nfs/dbraw/zinc/66/09/12/1109660912.db2.gz HOORTPGIUCSPJB-GASCZTMLSA-N 1 1 356.422 4.165 20 5 FIBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1nc(C2CCCCC2)no1 ZINC000449277194 1110013745 /nfs/dbraw/zinc/01/37/45/1110013745.db2.gz FFRMGEAUYOLWAE-ZIAGYGMSSA-N 1 1 358.442 4.307 20 5 FIBDMO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000449363774 1110049460 /nfs/dbraw/zinc/04/94/60/1110049460.db2.gz OTXCJPSGEWBZPS-QJPTWQEYSA-N 1 1 374.359 4.013 20 5 FIBDMO CCOc1cc(Nc2cccc([C@@H](C)[NH+]3CCOCC3)c2)ccc1[N+](=O)[O-] ZINC000538937382 1111351132 /nfs/dbraw/zinc/35/11/32/1111351132.db2.gz UNOWHNBWEQICNK-OAHLLOKOSA-N 1 1 371.437 4.130 20 5 FIBDMO CCS[C@@H]1CCC[C@@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552044582 1111555429 /nfs/dbraw/zinc/55/54/29/1111555429.db2.gz GWODRNJHBVCSPG-NXHRZFHOSA-N 1 1 374.510 4.072 20 5 FIBDMO C[C@@H](CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000552048925 1111557547 /nfs/dbraw/zinc/55/75/47/1111557547.db2.gz DCOUHQISXOOXMT-OXJNMPFZSA-N 1 1 364.449 4.201 20 5 FIBDMO CC(=O)c1cc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000553076523 1111903137 /nfs/dbraw/zinc/90/31/37/1111903137.db2.gz PQBWISONBPABDB-LIRRHRJNSA-N 1 1 373.478 4.354 20 5 FIBDMO CCC(=O)c1ccc(SCC[N@@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000480514883 1112459762 /nfs/dbraw/zinc/45/97/62/1112459762.db2.gz VKPCTODRVVSXJO-UHFFFAOYSA-N 1 1 358.463 4.412 20 5 FIBDMO C[C@@H](c1cccc(Cl)c1F)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000480767183 1112585840 /nfs/dbraw/zinc/58/58/40/1112585840.db2.gz DLMQKDMVPNPWLU-RYUDHWBXSA-N 1 1 364.808 4.030 20 5 FIBDMO C[C@@H](c1cccc(Cl)c1F)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000480767183 1112585844 /nfs/dbraw/zinc/58/58/44/1112585844.db2.gz DLMQKDMVPNPWLU-RYUDHWBXSA-N 1 1 364.808 4.030 20 5 FIBDMO CC(C)[N@H+](C)Cc1nc(-c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000555126718 1112689913 /nfs/dbraw/zinc/68/99/13/1112689913.db2.gz ABSFAKHFXQQRLB-UHFFFAOYSA-N 1 1 368.393 4.277 20 5 FIBDMO CC(C)[N@@H+](C)Cc1nc(-c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)no1 ZINC000555126718 1112689914 /nfs/dbraw/zinc/68/99/14/1112689914.db2.gz ABSFAKHFXQQRLB-UHFFFAOYSA-N 1 1 368.393 4.277 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC(c3ccncc3)CC2)c1 ZINC000555461165 1112862943 /nfs/dbraw/zinc/86/29/43/1112862943.db2.gz RYTRGTCQVGYZJH-UHFFFAOYSA-N 1 1 365.355 4.388 20 5 FIBDMO Cc1c([C@H](C)N[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000482358516 1113231943 /nfs/dbraw/zinc/23/19/43/1113231943.db2.gz MPTUAIXPXLQLKQ-SCTDSRPQSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1c([C@H](C)N[C@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000482358516 1113231946 /nfs/dbraw/zinc/23/19/46/1113231946.db2.gz MPTUAIXPXLQLKQ-SCTDSRPQSA-N 1 1 353.466 4.389 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000482420490 1113246973 /nfs/dbraw/zinc/24/69/73/1113246973.db2.gz AICVZRKWCBIGLV-BHQIVLKMSA-N 1 1 350.418 4.130 20 5 FIBDMO COCC1=CC[N@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000482505809 1113279858 /nfs/dbraw/zinc/27/98/58/1113279858.db2.gz IJRRMTCQGSKLRU-UHFFFAOYSA-N 1 1 367.449 4.141 20 5 FIBDMO COCC1=CC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000482505809 1113279862 /nfs/dbraw/zinc/27/98/62/1113279862.db2.gz IJRRMTCQGSKLRU-UHFFFAOYSA-N 1 1 367.449 4.141 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CNC3CC[NH+](CC4CC4)CC3)s2)cc1 ZINC000171050210 1113304440 /nfs/dbraw/zinc/30/44/40/1113304440.db2.gz QOPVXSISUNCMFI-UHFFFAOYSA-N 1 1 371.506 4.287 20 5 FIBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3ccsc3Cl)CC2)cc1 ZINC000483259211 1113475519 /nfs/dbraw/zinc/47/55/19/1113475519.db2.gz WMWWTXULFUDDGC-UHFFFAOYSA-N 1 1 352.843 4.353 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000913039444 1114284735 /nfs/dbraw/zinc/28/47/35/1114284735.db2.gz HSWFXVXAAIWVTD-UHFFFAOYSA-N 1 1 363.417 4.374 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC=C(c2c[nH]c3ccccc32)CC1 ZINC000913039444 1114284736 /nfs/dbraw/zinc/28/47/36/1114284736.db2.gz HSWFXVXAAIWVTD-UHFFFAOYSA-N 1 1 363.417 4.374 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)cc1)C1CC1 ZINC000129520780 1114336744 /nfs/dbraw/zinc/33/67/44/1114336744.db2.gz WNRPEJGXORFCCA-UHFFFAOYSA-N 1 1 367.449 4.448 20 5 FIBDMO COc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1SC ZINC000490821505 1114339217 /nfs/dbraw/zinc/33/92/17/1114339217.db2.gz PAQRFWWJZVSLBL-UHFFFAOYSA-N 1 1 358.463 4.490 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(F)c3cccnc23)C2CC2)cc1 ZINC000490847534 1114342442 /nfs/dbraw/zinc/34/24/42/1114342442.db2.gz VDMKTLUDOAFYPN-UHFFFAOYSA-N 1 1 351.381 4.447 20 5 FIBDMO C[N@@H+](CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000491035700 1114365142 /nfs/dbraw/zinc/36/51/42/1114365142.db2.gz JRYIZICOBCCNOJ-NRFANRHFSA-N 1 1 353.466 4.148 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 ZINC000586778942 1114391849 /nfs/dbraw/zinc/39/18/49/1114391849.db2.gz GPNLULMFTSPMPN-QRVBRYPASA-N 1 1 372.852 4.253 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1nccn1CCc1ccccc1 ZINC000164279216 1114447021 /nfs/dbraw/zinc/44/70/21/1114447021.db2.gz ZUMCMWQPOZLBNB-KRWDZBQOSA-N 1 1 364.449 4.193 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1nccn1CCc1ccccc1 ZINC000164279120 1114447117 /nfs/dbraw/zinc/44/71/17/1114447117.db2.gz ZUMCMWQPOZLBNB-QGZVFWFLSA-N 1 1 364.449 4.193 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000164405405 1114494111 /nfs/dbraw/zinc/49/41/11/1114494111.db2.gz BWQGBMCALDQRTN-IBGZPJMESA-N 1 1 371.412 4.208 20 5 FIBDMO COC[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000588986500 1114685366 /nfs/dbraw/zinc/68/53/66/1114685366.db2.gz ABADABWZFMYNNP-HNNXBMFYSA-N 1 1 355.221 4.379 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1nn(-c2ccccc2)c2c1CCC2 ZINC000573814928 1115184390 /nfs/dbraw/zinc/18/43/90/1115184390.db2.gz KGNUWZJWZLGZGU-IBGZPJMESA-N 1 1 374.444 4.046 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3c3ccsc3)o2)cc1 ZINC000046089274 1115185399 /nfs/dbraw/zinc/18/53/99/1115185399.db2.gz LIWFXGWQGYNJDV-OAHLLOKOSA-N 1 1 356.407 4.043 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]3c3ccsc3)o2)cc1 ZINC000046089274 1115185403 /nfs/dbraw/zinc/18/54/03/1115185403.db2.gz LIWFXGWQGYNJDV-OAHLLOKOSA-N 1 1 356.407 4.043 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+]C2(c3ccccc3OC)CC2)cc1[N+](=O)[O-] ZINC000592393433 1115222911 /nfs/dbraw/zinc/22/29/11/1115222911.db2.gz IHFPSTCOYOCRBI-CQSZACIVSA-N 1 1 356.422 4.342 20 5 FIBDMO CC[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1[NH3+] ZINC000592427717 1115307284 /nfs/dbraw/zinc/30/72/84/1115307284.db2.gz TUCIYQAQAIGIKG-SJCJKPOMSA-N 1 1 363.845 4.067 20 5 FIBDMO Cc1ccc(-c2nn(C)cc2C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)o1 ZINC000592498048 1115326812 /nfs/dbraw/zinc/32/68/12/1115326812.db2.gz VZNMWYNWGXNVKH-UHFFFAOYSA-N 1 1 366.421 4.061 20 5 FIBDMO Cc1ccc(-c2nn(C)cc2C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)o1 ZINC000592498048 1115326813 /nfs/dbraw/zinc/32/68/13/1115326813.db2.gz VZNMWYNWGXNVKH-UHFFFAOYSA-N 1 1 366.421 4.061 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccccc1OC(F)(F)F ZINC000595004814 1115507467 /nfs/dbraw/zinc/50/74/67/1115507467.db2.gz UCZVSULEBAKYDF-LLVKDONJSA-N 1 1 370.327 4.353 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCCOc2c(F)cccc21 ZINC000595034639 1115510791 /nfs/dbraw/zinc/51/07/91/1115510791.db2.gz RHVGNZATIGIZBL-SJCJKPOMSA-N 1 1 360.385 4.307 20 5 FIBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000595431744 1115536007 /nfs/dbraw/zinc/53/60/07/1115536007.db2.gz GYZRKJKGQZNMHA-IEBWSBKVSA-N 1 1 362.376 4.225 20 5 FIBDMO O=C(CC[N@H+]1CC2(CCCC2)[C@H]1c1ccco1)Nc1ccccc1[N+](=O)[O-] ZINC000595673468 1115556537 /nfs/dbraw/zinc/55/65/37/1115556537.db2.gz FJOVOXWSRUFMQS-LJQANCHMSA-N 1 1 369.421 4.134 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCc2ccccc2-n2ccnc21 ZINC000596095304 1115574523 /nfs/dbraw/zinc/57/45/23/1115574523.db2.gz OSWHROKRPAAPJD-HNAYVOBHSA-N 1 1 362.433 4.427 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1CCc2ccccc2-n2ccnc21 ZINC000596118263 1115574662 /nfs/dbraw/zinc/57/46/62/1115574662.db2.gz UZDRKWHCZJVULR-MSOLQXFVSA-N 1 1 360.417 4.045 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000597207321 1115647626 /nfs/dbraw/zinc/64/76/26/1115647626.db2.gz ZWXXEDNJXCJEQG-COOTTXPVSA-N 1 1 366.461 4.096 20 5 FIBDMO O=[N+]([O-])c1sc(C[NH2+][C@H]2CCCc3occc32)cc1Br ZINC000602510759 1115709229 /nfs/dbraw/zinc/70/92/29/1115709229.db2.gz NILOYWJKMGFVMG-NSHDSACASA-N 1 1 357.229 4.179 20 5 FIBDMO O=[N+]([O-])c1sc(C[NH2+][C@@H](c2cccnc2)C2CC2)cc1Br ZINC000602578810 1115713037 /nfs/dbraw/zinc/71/30/37/1115713037.db2.gz HGPOPDZVEWYRKJ-CYBMUJFWSA-N 1 1 368.256 4.055 20 5 FIBDMO CCc1cnccc1[C@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602581089 1115713116 /nfs/dbraw/zinc/71/31/16/1115713116.db2.gz HFBRMUYZYYIJPL-VIFPVBQESA-N 1 1 370.272 4.227 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(c4ccccc4)CC3)n2)c1 ZINC000603580986 1115796072 /nfs/dbraw/zinc/79/60/72/1115796072.db2.gz YBPSCVLKYLAVMX-UHFFFAOYSA-N 1 1 364.405 4.024 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CC[C@]4(CC4(F)F)C3)o2)c([N+](=O)[O-])c1 ZINC000593696285 1115797802 /nfs/dbraw/zinc/79/78/02/1115797802.db2.gz ZTPGWFBUCDORPI-KRWDZBQOSA-N 1 1 364.348 4.095 20 5 FIBDMO CC[C@H]([NH2+][C@H](Cc1ccccc1)c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000593723560 1115803867 /nfs/dbraw/zinc/80/38/67/1115803867.db2.gz YKGBYLVCKYYAKA-VQTJNVASSA-N 1 1 364.449 4.353 20 5 FIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccnc1C(F)(F)F ZINC000599270906 1115804916 /nfs/dbraw/zinc/80/49/16/1115804916.db2.gz RGDVIMJGGOGCDZ-UHFFFAOYSA-N 1 1 353.344 4.419 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccnc1C(F)(F)F ZINC000599270906 1115804919 /nfs/dbraw/zinc/80/49/19/1115804919.db2.gz RGDVIMJGGOGCDZ-UHFFFAOYSA-N 1 1 353.344 4.419 20 5 FIBDMO COc1ccc(OC)c([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000603846155 1115820710 /nfs/dbraw/zinc/82/07/10/1115820710.db2.gz WVZQKXPKLFNUIR-LJQANCHMSA-N 1 1 356.422 4.258 20 5 FIBDMO Cc1ccc([C@H](C)[N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000603882090 1115825578 /nfs/dbraw/zinc/82/55/78/1115825578.db2.gz MHBHMCXWMORQGZ-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000603882090 1115825582 /nfs/dbraw/zinc/82/55/82/1115825582.db2.gz MHBHMCXWMORQGZ-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO COc1ccc(C(C)(C)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc1F ZINC000599600127 1115830893 /nfs/dbraw/zinc/83/08/93/1115830893.db2.gz YPRZHHAANHRRHI-UHFFFAOYSA-N 1 1 352.793 4.421 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000604012928 1115840929 /nfs/dbraw/zinc/84/09/29/1115840929.db2.gz FYAAMFGEFCBUFC-CQSZACIVSA-N 1 1 370.396 4.359 20 5 FIBDMO Cc1ccc(NC(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000604079937 1115846535 /nfs/dbraw/zinc/84/65/35/1115846535.db2.gz DNUVJIYQPOSBMJ-UHFFFAOYSA-N 1 1 374.485 4.023 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c(C)c1 ZINC000604081449 1115846836 /nfs/dbraw/zinc/84/68/36/1115846836.db2.gz UDOHPQIARCJZPW-OAHLLOKOSA-N 1 1 356.422 4.271 20 5 FIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCC(C(C)(C)C)CC1 ZINC000604414834 1115865094 /nfs/dbraw/zinc/86/50/94/1115865094.db2.gz PIAGFHWUQKYIJM-UHFFFAOYSA-N 1 1 362.470 4.498 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCc3noc4ccccc43)C2)cc1 ZINC000594005313 1115957482 /nfs/dbraw/zinc/95/74/82/1115957482.db2.gz HBCUIHHHNYAWTQ-INIZCTEOSA-N 1 1 351.406 4.158 20 5 FIBDMO Cc1ccnc([C@@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3OC(C)C)C2)c1 ZINC000594007730 1115958741 /nfs/dbraw/zinc/95/87/41/1115958741.db2.gz FGFJVZVTJKHOOH-MRXNPFEDSA-N 1 1 355.438 4.075 20 5 FIBDMO C[N@@H+](Cc1cccc2ccccc21)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172896199 1116001182 /nfs/dbraw/zinc/00/11/82/1116001182.db2.gz RFRBXWHGNMKHRG-UHFFFAOYSA-N 1 1 373.416 4.096 20 5 FIBDMO C[N@H+](Cc1cccc2ccccc21)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172896199 1116001185 /nfs/dbraw/zinc/00/11/85/1116001185.db2.gz RFRBXWHGNMKHRG-UHFFFAOYSA-N 1 1 373.416 4.096 20 5 FIBDMO CN(C)C1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCCCC1 ZINC000608835470 1116130958 /nfs/dbraw/zinc/13/09/58/1116130958.db2.gz KJPDXHGGPMPSPU-UHFFFAOYSA-N 1 1 357.454 4.209 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000608835523 1116130990 /nfs/dbraw/zinc/13/09/90/1116130990.db2.gz RHXFMBPAKJPEKE-MRXNPFEDSA-N 1 1 357.454 4.209 20 5 FIBDMO C[C@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@@H+]1CCCC[C@@H]1C ZINC000608836452 1116131127 /nfs/dbraw/zinc/13/11/27/1116131127.db2.gz YOJKWFJRZYJBSD-JKSUJKDBSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[N@H+]1CCCC[C@@H]1C ZINC000608836452 1116131128 /nfs/dbraw/zinc/13/11/28/1116131128.db2.gz YOJKWFJRZYJBSD-JKSUJKDBSA-N 1 1 357.454 4.207 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@@H+]1CCC[C@H](C)C1 ZINC000608836400 1116131222 /nfs/dbraw/zinc/13/12/22/1116131222.db2.gz WCGZRJZXIXSHGS-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@H+]1CCC[C@H](C)C1 ZINC000608836400 1116131223 /nfs/dbraw/zinc/13/12/23/1116131223.db2.gz WCGZRJZXIXSHGS-HOTGVXAUSA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1ccc(C[NH2+][C@H](C)c2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-] ZINC000609006348 1116140121 /nfs/dbraw/zinc/14/01/21/1116140121.db2.gz BCDWDTSYNFPGBE-GFCCVEGCSA-N 1 1 360.364 4.499 20 5 FIBDMO C[C@H]1C[C@H](N(C)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1Cc1ccccc1 ZINC000491228787 1116225952 /nfs/dbraw/zinc/22/59/52/1116225952.db2.gz SHXZGAFUMYAYMG-QFBILLFUSA-N 1 1 371.456 4.219 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOC4(CCC4)C3)o2)c(Cl)c1 ZINC000539816963 1116384349 /nfs/dbraw/zinc/38/43/49/1116384349.db2.gz HDNCXGGXBQNHHR-UHFFFAOYSA-N 1 1 362.813 4.263 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC4(CCC4)C3)o2)c(Cl)c1 ZINC000539816963 1116384351 /nfs/dbraw/zinc/38/43/51/1116384351.db2.gz HDNCXGGXBQNHHR-UHFFFAOYSA-N 1 1 362.813 4.263 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]4COCC[C@@H]43)s2)cc1 ZINC000539891334 1116395797 /nfs/dbraw/zinc/39/57/97/1116395797.db2.gz LMZKIIOOZBJTGN-QAPCUYQASA-N 1 1 358.463 4.324 20 5 FIBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1)C1CCCCC1 ZINC000462916553 1117860571 /nfs/dbraw/zinc/86/05/71/1117860571.db2.gz FKNNRFWLCKGDQW-UHFFFAOYSA-N 1 1 357.401 4.263 20 5 FIBDMO CCc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000540146500 1117898275 /nfs/dbraw/zinc/89/82/75/1117898275.db2.gz ZVENMMTYSXQJCB-NEPJUHHUSA-N 1 1 371.466 4.416 20 5 FIBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])s3)c2C1 ZINC000076171309 1118135957 /nfs/dbraw/zinc/13/59/57/1118135957.db2.gz DHJDYDCZUSGDSO-UHFFFAOYSA-N 1 1 359.451 4.270 20 5 FIBDMO CN(C)c1ccccc1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000540808722 1118256926 /nfs/dbraw/zinc/25/69/26/1118256926.db2.gz CXLHKWVASACWOB-UHFFFAOYSA-N 1 1 368.462 4.074 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCOc2ccc(Cl)cc21 ZINC000541570573 1118566973 /nfs/dbraw/zinc/56/69/73/1118566973.db2.gz VYKGQKWUNROKPR-INIZCTEOSA-N 1 1 362.813 4.260 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCOc2ccccc2)C2CCOCC2)cc1 ZINC000464589710 1118618000 /nfs/dbraw/zinc/61/80/00/1118618000.db2.gz VYNPCAKPPMQJBE-UHFFFAOYSA-N 1 1 370.449 4.045 20 5 FIBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+]2CCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000464841715 1118718109 /nfs/dbraw/zinc/71/81/09/1118718109.db2.gz YVLMPMDWSIZGEH-HNAYVOBHSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000464841715 1118718114 /nfs/dbraw/zinc/71/81/14/1118718114.db2.gz YVLMPMDWSIZGEH-HNAYVOBHSA-N 1 1 353.422 4.067 20 5 FIBDMO COc1ccc(OCC[N@H+]2CC[C@@H](C)C[C@@H]2c2ccco2)c([N+](=O)[O-])c1 ZINC000464849741 1118721828 /nfs/dbraw/zinc/72/18/28/1118721828.db2.gz IHBZLVCYRBGHFR-GDBMZVCRSA-N 1 1 360.410 4.048 20 5 FIBDMO Cc1ccc([C@@H]2CC[N@@H+](CCC(=O)Nc3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC000542319691 1118903695 /nfs/dbraw/zinc/90/36/95/1118903695.db2.gz LHGRTYNPSVKJCF-GOSISDBHSA-N 1 1 367.449 4.030 20 5 FIBDMO CN(Cc1c(Cl)cccc1[N+](=O)[O-])C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000493210854 1119345176 /nfs/dbraw/zinc/34/51/76/1119345176.db2.gz NLKFEOPJROFGPW-KRWDZBQOSA-N 1 1 373.884 4.202 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000494269290 1119816680 /nfs/dbraw/zinc/81/66/80/1119816680.db2.gz WTSMQPWOGVXYBO-SSZFMOIBSA-N 1 1 367.449 4.267 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000915211485 1120870027 /nfs/dbraw/zinc/87/00/27/1120870027.db2.gz UEZVYKJBXBWCKE-SECBINFHSA-N 1 1 363.767 4.163 20 5 FIBDMO CCOc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000090585813 1121016761 /nfs/dbraw/zinc/01/67/61/1121016761.db2.gz HDBIYJWYJMLIRX-IRXDYDNUSA-N 1 1 363.502 4.012 20 5 FIBDMO COc1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC(F)F ZINC000026453280 1121091174 /nfs/dbraw/zinc/09/11/74/1121091174.db2.gz UXMAPKHEWHWIOA-LBPRGKRZSA-N 1 1 366.364 4.398 20 5 FIBDMO CCc1nc(C[NH+]2CCC(CNc3ccc([N+](=O)[O-])cc3C)CC2)cs1 ZINC000301431784 1121154687 /nfs/dbraw/zinc/15/46/87/1121154687.db2.gz HBQUGUSVZIBFHS-UHFFFAOYSA-N 1 1 374.510 4.246 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609233309 1121228479 /nfs/dbraw/zinc/22/84/79/1121228479.db2.gz CWZWZQFCCQABFT-OAQYLSRUSA-N 1 1 370.449 4.346 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000609233309 1121228485 /nfs/dbraw/zinc/22/84/85/1121228485.db2.gz CWZWZQFCCQABFT-OAQYLSRUSA-N 1 1 370.449 4.346 20 5 FIBDMO Cc1ccc(C[N@@H+](Cc2ccco2)C[C@@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000153775204 1121344919 /nfs/dbraw/zinc/34/49/19/1121344919.db2.gz UEMQTKXZIQUCJT-LJQANCHMSA-N 1 1 372.446 4.294 20 5 FIBDMO Cc1ccc(C[N@H+](Cc2ccco2)C[C@@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000153775204 1121344927 /nfs/dbraw/zinc/34/49/27/1121344927.db2.gz UEMQTKXZIQUCJT-LJQANCHMSA-N 1 1 372.446 4.294 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2c[nH]nc2-c2cccs2)C2CC2)c1 ZINC000154281528 1122137738 /nfs/dbraw/zinc/13/77/38/1122137738.db2.gz MZYWIPDAYLYSRS-UHFFFAOYSA-N 1 1 354.435 4.211 20 5 FIBDMO CC(=O)c1ccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000301542071 1122218508 /nfs/dbraw/zinc/21/85/08/1122218508.db2.gz NTIJRJMAFFYNPZ-HNAYVOBHSA-N 1 1 367.449 4.262 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000301551229 1122220230 /nfs/dbraw/zinc/22/02/30/1122220230.db2.gz QRKNULZEKKYDQI-LPHOPBHVSA-N 1 1 369.465 4.206 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000542709035 1122310793 /nfs/dbraw/zinc/31/07/93/1122310793.db2.gz GECWAOKPVYBTOW-QUCCMNQESA-N 1 1 358.413 4.394 20 5 FIBDMO C[N@@H+](Cc1cccc2ccccc21)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917469003 1122328632 /nfs/dbraw/zinc/32/86/32/1122328632.db2.gz AGWVHDADMJRUFS-UHFFFAOYSA-N 1 1 373.416 4.096 20 5 FIBDMO C[N@H+](Cc1cccc2ccccc21)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917469003 1122328640 /nfs/dbraw/zinc/32/86/40/1122328640.db2.gz AGWVHDADMJRUFS-UHFFFAOYSA-N 1 1 373.416 4.096 20 5 FIBDMO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000069222418 1122562634 /nfs/dbraw/zinc/56/26/34/1122562634.db2.gz ZXNICXRVJOYZNI-SNVBAGLBSA-N 1 1 368.220 4.191 20 5 FIBDMO CC[NH+](CC)[C@H](C(=O)OCc1ccc([N+](=O)[O-])c(C)c1)c1ccccc1 ZINC001127500889 1123023232 /nfs/dbraw/zinc/02/32/32/1123023232.db2.gz PNXNCFSPOIVQKB-IBGZPJMESA-N 1 1 356.422 4.030 20 5 FIBDMO CC[C@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133743 1123160757 /nfs/dbraw/zinc/16/07/57/1123160757.db2.gz UTMQWPPVFSNRLV-NQIIRXRSSA-N 1 1 353.466 4.158 20 5 FIBDMO CC[C@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133743 1123160764 /nfs/dbraw/zinc/16/07/64/1123160764.db2.gz UTMQWPPVFSNRLV-NQIIRXRSSA-N 1 1 353.466 4.158 20 5 FIBDMO CC[C@H]([NH2+]C[C@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133743 1123160776 /nfs/dbraw/zinc/16/07/76/1123160776.db2.gz UTMQWPPVFSNRLV-NQIIRXRSSA-N 1 1 353.466 4.158 20 5 FIBDMO CC(C)[C@]1(CO)CCC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000556959510 1123272679 /nfs/dbraw/zinc/27/26/79/1123272679.db2.gz XCRGGPGNAOJBJF-HXUWFJFHSA-N 1 1 358.438 4.085 20 5 FIBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000609441810 1123713799 /nfs/dbraw/zinc/71/37/99/1123713799.db2.gz DPGBQHKCHXGQEQ-AWEZNQCLSA-N 1 1 371.412 4.361 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705023 1123803730 /nfs/dbraw/zinc/80/37/30/1123803730.db2.gz HSFJJDNTLJGZAB-CVEARBPZSA-N 1 1 365.905 4.335 20 5 FIBDMO CCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000610133381 1123950147 /nfs/dbraw/zinc/95/01/47/1123950147.db2.gz LSIDWHKNGZJGKI-UAGQMJEPSA-N 1 1 352.862 4.274 20 5 FIBDMO CN1Cc2ccccc2[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000542776809 1124256595 /nfs/dbraw/zinc/25/65/95/1124256595.db2.gz JONINFBGUWVVJT-XZOQPEGZSA-N 1 1 373.456 4.461 20 5 FIBDMO C[N@@H+](Cc1ccccc1NC(=O)c1ccc([N+](=O)[O-])o1)C1CCCCC1 ZINC000069526090 1124938750 /nfs/dbraw/zinc/93/87/50/1124938750.db2.gz CQULWJSAAPGMHL-UHFFFAOYSA-N 1 1 357.410 4.205 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](n3ncc4ccccc43)C2)c(Cl)c1 ZINC000542979839 1125110528 /nfs/dbraw/zinc/11/05/28/1125110528.db2.gz ASLIFMACJDQPIC-INIZCTEOSA-N 1 1 356.813 4.045 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](n3ncc4ccccc43)C2)c(Cl)c1 ZINC000542979839 1125110534 /nfs/dbraw/zinc/11/05/34/1125110534.db2.gz ASLIFMACJDQPIC-INIZCTEOSA-N 1 1 356.813 4.045 20 5 FIBDMO CCOc1ccc(C(C)=O)cc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181822195 1125143762 /nfs/dbraw/zinc/14/37/62/1125143762.db2.gz VDGOLSBBOZHLGP-AWEZNQCLSA-N 1 1 356.422 4.355 20 5 FIBDMO C[C@H]1C[C@@H](N(C)c2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000301748822 1125189504 /nfs/dbraw/zinc/18/95/04/1125189504.db2.gz SOWMJELOEDTRRJ-YOEHRIQHSA-N 1 1 374.872 4.133 20 5 FIBDMO C[N@H+]1CCC[C@@H](CNc2ncc(Cl)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301753109 1125212604 /nfs/dbraw/zinc/21/26/04/1125212604.db2.gz VYIZDQRIITWQKY-NHYWBVRUSA-N 1 1 366.874 4.200 20 5 FIBDMO CCN(Cc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000517900734 567836598 /nfs/dbraw/zinc/83/65/98/567836598.db2.gz VAOCCPZATYKCRX-FXAWDEMLSA-N 1 1 353.466 4.252 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)NCc2cccc([N+](=O)[O-])c2C)cc1)C(C)C ZINC000481464115 567965723 /nfs/dbraw/zinc/96/57/23/567965723.db2.gz INGHTPJORRQJOQ-UHFFFAOYSA-N 1 1 369.465 4.064 20 5 FIBDMO COc1ccc(CNc2cc(C)[nH+]c3c(OC)cccc23)cc1[N+](=O)[O-] ZINC000481670303 568080919 /nfs/dbraw/zinc/08/09/19/568080919.db2.gz LVWGNXDHSSWZMJ-UHFFFAOYSA-N 1 1 353.378 4.081 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481701799 568092495 /nfs/dbraw/zinc/09/24/95/568092495.db2.gz FYBZIHHRESFMHF-IBGZPJMESA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481701799 568092496 /nfs/dbraw/zinc/09/24/96/568092496.db2.gz FYBZIHHRESFMHF-IBGZPJMESA-N 1 1 358.825 4.270 20 5 FIBDMO O=C(C[NH+]1CCC(c2ccc(Cl)cc2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000481836630 568145727 /nfs/dbraw/zinc/14/57/27/568145727.db2.gz CVIPSEPAHMPXQN-UHFFFAOYSA-N 1 1 373.840 4.066 20 5 FIBDMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000541951230 568272608 /nfs/dbraw/zinc/27/26/08/568272608.db2.gz CYQJEKXXKUQJLT-LPMFXHHGSA-N 1 1 356.426 4.218 20 5 FIBDMO Cc1ccc(C[NH2+]Cc2nc(-c3ccccc3F)cs2)cc1[N+](=O)[O-] ZINC000569515620 568404558 /nfs/dbraw/zinc/40/45/58/568404558.db2.gz LZSDGWSJIUFEBK-UHFFFAOYSA-N 1 1 357.410 4.456 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1F ZINC000182024583 568557443 /nfs/dbraw/zinc/55/74/43/568557443.db2.gz IRMNPQWDFBTQEB-LBPRGKRZSA-N 1 1 371.368 4.248 20 5 FIBDMO Cc1cc(N2CCC(C[N@@H+](C)C(C)C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000543030794 1125486969 /nfs/dbraw/zinc/48/69/69/1125486969.db2.gz GRIDLPOLKXSBFX-UHFFFAOYSA-N 1 1 356.470 4.008 20 5 FIBDMO Cc1cc(N2CCC(C[N@H+](C)C(C)C)CC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000543030794 1125486971 /nfs/dbraw/zinc/48/69/71/1125486971.db2.gz GRIDLPOLKXSBFX-UHFFFAOYSA-N 1 1 356.470 4.008 20 5 FIBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093742174 1125506717 /nfs/dbraw/zinc/50/67/17/1125506717.db2.gz RQEQWAWKKXBKAR-MRXNPFEDSA-N 1 1 357.454 4.019 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000619531348 1125608827 /nfs/dbraw/zinc/60/88/27/1125608827.db2.gz QXDJHPDPOREKCC-NQIIRXRSSA-N 1 1 370.449 4.203 20 5 FIBDMO CC(C)C[C@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000246962178 1080653370 /nfs/dbraw/zinc/65/33/70/1080653370.db2.gz CIBVFPHXWYPYTA-HUUCEWRRSA-N 1 1 358.442 4.464 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC001167131148 1080660691 /nfs/dbraw/zinc/66/06/91/1080660691.db2.gz KWSHRMODPXDHSG-HNNXBMFYSA-N 1 1 371.437 4.015 20 5 FIBDMO COc1ccc(C[NH2+][C@H]2COc3c2ccc(Cl)c3Cl)cc1[N+](=O)[O-] ZINC000610271623 1080999445 /nfs/dbraw/zinc/99/94/45/1080999445.db2.gz CMRWWQYDYSHTOA-LBPRGKRZSA-N 1 1 369.204 4.134 20 5 FIBDMO COc1ccc(C[NH2+]Cc2ccc(Sc3ccccn3)o2)cc1[N+](=O)[O-] ZINC000510285298 1081138299 /nfs/dbraw/zinc/13/82/99/1081138299.db2.gz BXEACHKTNWGLQO-UHFFFAOYSA-N 1 1 371.418 4.032 20 5 FIBDMO Cc1cccc(NC2CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC2)c1 ZINC000083209657 1081555418 /nfs/dbraw/zinc/55/54/18/1081555418.db2.gz PACCKDDDWFNHLM-UHFFFAOYSA-N 1 1 366.421 4.121 20 5 FIBDMO CC[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001167376286 1081811925 /nfs/dbraw/zinc/81/19/25/1081811925.db2.gz IBWRHGDLDZJIHD-QWHCGFSZSA-N 1 1 353.850 4.087 20 5 FIBDMO CC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001167376286 1081811937 /nfs/dbraw/zinc/81/19/37/1081811937.db2.gz IBWRHGDLDZJIHD-QWHCGFSZSA-N 1 1 353.850 4.087 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H]3C3CCOCC3)o2)c1 ZINC000537464862 1082075367 /nfs/dbraw/zinc/07/53/67/1082075367.db2.gz ANNYVOWJNMMMEG-IBGZPJMESA-N 1 1 356.422 4.246 20 5 FIBDMO C[C@@H](NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311547104 1082105813 /nfs/dbraw/zinc/10/58/13/1082105813.db2.gz OUOZAOGHOCYDRE-CRAIPNDOSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H](c1ccccc1)[NH+]1CCC(N[C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000581142668 1082341710 /nfs/dbraw/zinc/34/17/10/1082341710.db2.gz PPIPJEGPZOHRRY-IERDGZPVSA-N 1 1 365.477 4.397 20 5 FIBDMO Cc1cccc([C@@H]2CCCCC[N@H+]2CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC001167457555 1082517843 /nfs/dbraw/zinc/51/78/43/1082517843.db2.gz FBAGQJHCPLBNNB-IBGZPJMESA-N 1 1 367.449 4.459 20 5 FIBDMO CCOc1ccc([C@H]2CCC[N@@H+]2Cn2ncc3cc([N+](=O)[O-])ccc32)cc1 ZINC000023855359 1082669165 /nfs/dbraw/zinc/66/91/65/1082669165.db2.gz DNGPDAIRXLLOPI-LJQANCHMSA-N 1 1 366.421 4.138 20 5 FIBDMO CCOc1ccc([C@H]2CCC[N@H+]2Cn2ncc3cc([N+](=O)[O-])ccc32)cc1 ZINC000023855359 1082669169 /nfs/dbraw/zinc/66/91/69/1082669169.db2.gz DNGPDAIRXLLOPI-LJQANCHMSA-N 1 1 366.421 4.138 20 5 FIBDMO CC[N@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000510468156 1082923654 /nfs/dbraw/zinc/92/36/54/1082923654.db2.gz XOFZCBBJELVZGH-ZDUSSCGKSA-N 1 1 362.401 4.334 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 ZINC000510468156 1082923658 /nfs/dbraw/zinc/92/36/58/1082923658.db2.gz XOFZCBBJELVZGH-ZDUSSCGKSA-N 1 1 362.401 4.334 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000055909425 1082927322 /nfs/dbraw/zinc/92/73/22/1082927322.db2.gz INZZQVWQBFEPHC-GOSISDBHSA-N 1 1 364.405 4.290 20 5 FIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1ccc(OC)cc1 ZINC000610581573 1083209469 /nfs/dbraw/zinc/20/94/69/1083209469.db2.gz UPVRAHAVONWPKZ-UHFFFAOYSA-N 1 1 355.394 4.157 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+](Cc3ccc(F)cc3)CC3CC3)nc2c1 ZINC000610581722 1083214297 /nfs/dbraw/zinc/21/42/97/1083214297.db2.gz FZXLLNYBJMXVOJ-UHFFFAOYSA-N 1 1 355.369 4.287 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604868 1083260366 /nfs/dbraw/zinc/26/03/66/1083260366.db2.gz QEPXNZDZEVIXHO-IEBDPFPHSA-N 1 1 356.266 4.328 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604868 1083260371 /nfs/dbraw/zinc/26/03/71/1083260371.db2.gz QEPXNZDZEVIXHO-IEBDPFPHSA-N 1 1 356.266 4.328 20 5 FIBDMO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)c(F)c1 ZINC000510799926 1083316958 /nfs/dbraw/zinc/31/69/58/1083316958.db2.gz XKUZTTWESFONBT-IAGOWNOFSA-N 1 1 368.767 4.146 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000510870425 1083349247 /nfs/dbraw/zinc/34/92/47/1083349247.db2.gz VDLMXTPPKOPKGH-OAHLLOKOSA-N 1 1 367.449 4.387 20 5 FIBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001167496446 1083525045 /nfs/dbraw/zinc/52/50/45/1083525045.db2.gz MBRADGCRQLZHDN-GXTWGEPZSA-N 1 1 373.316 4.463 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)s1 ZINC000535799212 1083675200 /nfs/dbraw/zinc/67/52/00/1083675200.db2.gz HAEWTTXBRLNZOP-PBHICJAKSA-N 1 1 358.463 4.324 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)o2)c1 ZINC000535808673 1083694193 /nfs/dbraw/zinc/69/41/93/1083694193.db2.gz QYXFMRVFTSDHBS-SJORKVTESA-N 1 1 356.422 4.103 20 5 FIBDMO CCc1ccc([C@H](N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407808 1083775194 /nfs/dbraw/zinc/77/51/94/1083775194.db2.gz NSDZXTJWUFYITN-PLMTUMEDSA-N 1 1 369.465 4.056 20 5 FIBDMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@H]2c2ccccc2C(F)(F)F)n1 ZINC000478008509 1083948458 /nfs/dbraw/zinc/94/84/58/1083948458.db2.gz FQIHEICQLWMWGV-HNNXBMFYSA-N 1 1 368.359 4.037 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CC[C@@H](c4ccco4)C3)cs2)c1 ZINC000611271348 1084215356 /nfs/dbraw/zinc/21/53/56/1084215356.db2.gz TWAZOFSJAJBAPT-CQSZACIVSA-N 1 1 355.419 4.301 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc32)cc1Cl ZINC000478032060 1084294132 /nfs/dbraw/zinc/29/41/32/1084294132.db2.gz SEMBJFLCMYPWFE-UHFFFAOYSA-N 1 1 372.812 4.043 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](COC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000539088874 1084312914 /nfs/dbraw/zinc/31/29/14/1084312914.db2.gz BTSLLDJGVSLLBD-GUYCJALGSA-N 1 1 362.401 4.171 20 5 FIBDMO CCOc1cc(C[NH2+][C@H](COC)c2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000580625841 1084444164 /nfs/dbraw/zinc/44/41/64/1084444164.db2.gz FTXRXVSCNHHZTG-MRXNPFEDSA-N 1 1 364.829 4.124 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@H]2c2ccccc2)c2c(c1)COCO2 ZINC000580866197 1084490972 /nfs/dbraw/zinc/49/09/72/1084490972.db2.gz GWCDHYRXZHYGKT-IBGZPJMESA-N 1 1 354.406 4.189 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@H]2c2ccccc2)c2c(c1)COCO2 ZINC000580866197 1084490984 /nfs/dbraw/zinc/49/09/84/1084490984.db2.gz GWCDHYRXZHYGKT-IBGZPJMESA-N 1 1 354.406 4.189 20 5 FIBDMO CC1(C)COCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000511474965 1084559978 /nfs/dbraw/zinc/55/99/78/1084559978.db2.gz CJSAIDNQOKFEGU-UHFFFAOYSA-N 1 1 350.802 4.119 20 5 FIBDMO CC1(C)COCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000511474965 1084559987 /nfs/dbraw/zinc/55/99/87/1084559987.db2.gz CJSAIDNQOKFEGU-UHFFFAOYSA-N 1 1 350.802 4.119 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000463435581 1084600762 /nfs/dbraw/zinc/60/07/62/1084600762.db2.gz UBWMKVIMZJEZHQ-FQEVSTJZSA-N 1 1 374.868 4.065 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@](CO)(Cc2ccccc2)C1 ZINC000463435581 1084600776 /nfs/dbraw/zinc/60/07/76/1084600776.db2.gz UBWMKVIMZJEZHQ-FQEVSTJZSA-N 1 1 374.868 4.065 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)s1 ZINC000551565891 1084679859 /nfs/dbraw/zinc/67/98/59/1084679859.db2.gz XOAVVAXNHITLAS-ZWKOTPCHSA-N 1 1 358.463 4.467 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccn(C)n1 ZINC000414168940 1084732052 /nfs/dbraw/zinc/73/20/52/1084732052.db2.gz ASDFNIONWDYHOQ-CHWSQXEVSA-N 1 1 356.451 4.469 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1Cl ZINC000478048141 1084778610 /nfs/dbraw/zinc/77/86/10/1084778610.db2.gz QHTJBDBSAGCKKX-UHFFFAOYSA-N 1 1 368.220 4.216 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000582342193 1084892002 /nfs/dbraw/zinc/89/20/02/1084892002.db2.gz JMTHEOKOIOEECX-CVEARBPZSA-N 1 1 350.846 4.029 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H](OC(F)F)C3)o2)c1 ZINC000611609592 1085028017 /nfs/dbraw/zinc/02/80/17/1085028017.db2.gz RFNHUNXXYSJYLB-AWEZNQCLSA-N 1 1 352.337 4.058 20 5 FIBDMO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000479396449 1085154602 /nfs/dbraw/zinc/15/46/02/1085154602.db2.gz PXIHMXZNIILVSF-OAHLLOKOSA-N 1 1 371.485 4.106 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@@H+](Cc3ccccc3)C1)CCC2 ZINC000479446893 1085163156 /nfs/dbraw/zinc/16/31/56/1085163156.db2.gz OWHJNKBTZRUEGR-GCJKJVERSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@H]1CC[N@H+](Cc3ccccc3)C1)CCC2 ZINC000479446893 1085163164 /nfs/dbraw/zinc/16/31/64/1085163164.db2.gz OWHJNKBTZRUEGR-GCJKJVERSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC[C@H]1CC[N@@H+](Cc3ccccc3)C1)CCC2 ZINC000479446893 1085163169 /nfs/dbraw/zinc/16/31/69/1085163169.db2.gz OWHJNKBTZRUEGR-GCJKJVERSA-N 1 1 365.477 4.084 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCN(Cc3ccccc3)C1)CCC2 ZINC000479446893 1085163174 /nfs/dbraw/zinc/16/31/74/1085163174.db2.gz OWHJNKBTZRUEGR-GCJKJVERSA-N 1 1 365.477 4.084 20 5 FIBDMO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000181758010 1085396978 /nfs/dbraw/zinc/39/69/78/1085396978.db2.gz QBBHVBLKUANREM-LLVKDONJSA-N 1 1 373.796 4.284 20 5 FIBDMO CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](C)Cc1ccsc1 ZINC000187797742 1085556048 /nfs/dbraw/zinc/55/60/48/1085556048.db2.gz NHHNGPQRHNMUMG-ZDUSSCGKSA-N 1 1 372.450 4.159 20 5 FIBDMO CC[N@H+](Cc1cccc(Cl)c1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000047958692 1085751874 /nfs/dbraw/zinc/75/18/74/1085751874.db2.gz KIBBOHSKOIHJRJ-UHFFFAOYSA-N 1 1 362.813 4.137 20 5 FIBDMO CC[N@@H+](Cc1cccc(Cl)c1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000047958692 1085751882 /nfs/dbraw/zinc/75/18/82/1085751882.db2.gz KIBBOHSKOIHJRJ-UHFFFAOYSA-N 1 1 362.813 4.137 20 5 FIBDMO CC[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(OC)cc1 ZINC000181832034 1086056021 /nfs/dbraw/zinc/05/60/21/1086056021.db2.gz CIBZXTCPMFFUEL-LJQANCHMSA-N 1 1 367.405 4.499 20 5 FIBDMO C[C@H](CNc1ccnc2c1cccc2[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000432314459 1086504489 /nfs/dbraw/zinc/50/44/89/1086504489.db2.gz QQEFPHKATBKJAU-CYBMUJFWSA-N 1 1 368.462 4.063 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432340971 1086634298 /nfs/dbraw/zinc/63/42/98/1086634298.db2.gz RGAAZFUTOGZDHV-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000583757469 1086949251 /nfs/dbraw/zinc/94/92/51/1086949251.db2.gz RXJPZRXVTMTXAV-HNNXBMFYSA-N 1 1 371.485 4.106 20 5 FIBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)c1 ZINC000536187826 1087095857 /nfs/dbraw/zinc/09/58/57/1087095857.db2.gz GCCQBDNGHMQLRL-UHFFFAOYSA-N 1 1 365.380 4.260 20 5 FIBDMO CCCOc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1OC ZINC000584377811 1087301403 /nfs/dbraw/zinc/30/14/03/1087301403.db2.gz GNKBNJNIMFTLDQ-UHFFFAOYSA-N 1 1 358.438 4.067 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2OC(F)F)cc1[N+](=O)[O-] ZINC000090177285 1087410639 /nfs/dbraw/zinc/41/06/39/1087410639.db2.gz TZXOZYVIGHEDNW-LLVKDONJSA-N 1 1 354.328 4.495 20 5 FIBDMO Cc1c(C[NH2+][C@H](CN2CCCCC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000611938133 1087595805 /nfs/dbraw/zinc/59/58/05/1087595805.db2.gz KJPREJIXPXLJAK-HXUWFJFHSA-N 1 1 353.466 4.220 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000180417504 1087899034 /nfs/dbraw/zinc/89/90/34/1087899034.db2.gz POJNVXDLCVXBHS-OAHLLOKOSA-N 1 1 365.202 4.274 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2nc3cc(C)ccc3[nH]2)cc1[N+](=O)[O-] ZINC000504921525 1087972980 /nfs/dbraw/zinc/97/29/80/1087972980.db2.gz SVVUWIVXDWYUMD-ZDUSSCGKSA-N 1 1 354.410 4.029 20 5 FIBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(C2CCC2)CC1 ZINC000504912339 1087981426 /nfs/dbraw/zinc/98/14/26/1087981426.db2.gz UYCUHODYXUQYKG-OAHLLOKOSA-N 1 1 363.527 4.072 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c(C)c1 ZINC000434703600 1088952334 /nfs/dbraw/zinc/95/23/34/1088952334.db2.gz ALGYRNJKFRBRIY-MRXNPFEDSA-N 1 1 355.438 4.152 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000434896715 1089113628 /nfs/dbraw/zinc/11/36/28/1089113628.db2.gz QAHCFWVEYSRZSZ-QFBILLFUSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](c3ccccc3)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000434901354 1089119022 /nfs/dbraw/zinc/11/90/22/1089119022.db2.gz VDGKKKVSTCGSAF-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO C[N@H+](CCOc1ccccc1)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000434982205 1089169175 /nfs/dbraw/zinc/16/91/75/1089169175.db2.gz KIFYQPLDUWDXES-UHFFFAOYSA-N 1 1 369.446 4.229 20 5 FIBDMO C[N@@H+](CCOc1ccccc1)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000434982205 1089169197 /nfs/dbraw/zinc/16/91/97/1089169197.db2.gz KIFYQPLDUWDXES-UHFFFAOYSA-N 1 1 369.446 4.229 20 5 FIBDMO COc1ccc(-c2ccc(C[NH2+][C@H](C)c3ccncc3F)o2)c([N+](=O)[O-])c1 ZINC000510025290 1089352816 /nfs/dbraw/zinc/35/28/16/1089352816.db2.gz BOCCYRYAACIRSL-GFCCVEGCSA-N 1 1 371.368 4.248 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(CCCn3ccnc3)CC2)ccc1Cl ZINC000783032622 1089493297 /nfs/dbraw/zinc/49/32/97/1089493297.db2.gz VWODFXQAOVDLDZ-UHFFFAOYSA-N 1 1 362.861 4.137 20 5 FIBDMO CCC[N@@H+]1CC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236808579 1089928840 /nfs/dbraw/zinc/92/88/40/1089928840.db2.gz JYXOMYXPSSZNHV-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO CCC[N@H+]1CC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236808579 1089928843 /nfs/dbraw/zinc/92/88/43/1089928843.db2.gz JYXOMYXPSSZNHV-HNNXBMFYSA-N 1 1 359.495 4.145 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H](c2nc3ccccc3o2)C1 ZINC000103466618 1090100955 /nfs/dbraw/zinc/10/09/55/1090100955.db2.gz COMLFENJIODWQH-ZDUSSCGKSA-N 1 1 355.369 4.255 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc(-c2cnn(C)c2)s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000549401701 1090230841 /nfs/dbraw/zinc/23/08/41/1090230841.db2.gz VEOLIGNMSFCRTE-UHFFFAOYSA-N 1 1 370.478 4.467 20 5 FIBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCc1ccccc1 ZINC000104674595 1090293978 /nfs/dbraw/zinc/29/39/78/1090293978.db2.gz UVHSHBRURIIRNT-UHFFFAOYSA-N 1 1 365.433 4.357 20 5 FIBDMO Cc1ccn2cc(C[NH2+][C@@H]3CCCCc4ccc([N+](=O)[O-])cc43)nc2c1 ZINC000417306753 1090792671 /nfs/dbraw/zinc/79/26/71/1090792671.db2.gz GKSIRFYQBKWPHU-LJQANCHMSA-N 1 1 350.422 4.108 20 5 FIBDMO C[C@H]1C[C@H](c2cccc(F)c2)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500099847 1091037843 /nfs/dbraw/zinc/03/78/43/1091037843.db2.gz VGBLFXRSFBSNFT-IFXJQAMLSA-N 1 1 371.412 4.146 20 5 FIBDMO O=C(CC[N@H+]1CCCCC[C@H]1c1ccco1)Nc1ccccc1[N+](=O)[O-] ZINC000500111173 1091046316 /nfs/dbraw/zinc/04/63/16/1091046316.db2.gz ANDMICDYBFEMDW-KRWDZBQOSA-N 1 1 357.410 4.134 20 5 FIBDMO COc1cccc(C2(F)CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000500142279 1091063345 /nfs/dbraw/zinc/06/33/45/1091063345.db2.gz VJNOGIXOEQFQDH-UHFFFAOYSA-N 1 1 362.376 4.203 20 5 FIBDMO Cc1cc(NCCC[N@@H+]2CCCC[C@H]2C)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001167751466 1091151478 /nfs/dbraw/zinc/15/14/78/1091151478.db2.gz IUPCSVFJKTVOOI-MRXNPFEDSA-N 1 1 369.469 4.037 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)N1C[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000566706656 1091373969 /nfs/dbraw/zinc/37/39/69/1091373969.db2.gz FBWUISQMJWNPQI-DUXKGJEZSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1 ZINC000566706656 1091374025 /nfs/dbraw/zinc/37/40/25/1091374025.db2.gz FBWUISQMJWNPQI-DUXKGJEZSA-N 1 1 365.477 4.110 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1 ZINC000566706656 1091374036 /nfs/dbraw/zinc/37/40/36/1091374036.db2.gz FBWUISQMJWNPQI-DUXKGJEZSA-N 1 1 365.477 4.110 20 5 FIBDMO CC(C)[N@@H+](Cc1cccs1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899046 1091789517 /nfs/dbraw/zinc/78/95/17/1091789517.db2.gz MXEOBCMRPJVLIZ-UHFFFAOYSA-N 1 1 356.451 4.388 20 5 FIBDMO CC(C)[N@H+](Cc1cccs1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728899046 1091789524 /nfs/dbraw/zinc/78/95/24/1091789524.db2.gz MXEOBCMRPJVLIZ-UHFFFAOYSA-N 1 1 356.451 4.388 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+](CCc3ccccc3)C3CC3)c2)cc1 ZINC000728899073 1091790775 /nfs/dbraw/zinc/79/07/75/1091790775.db2.gz BQQACQVMKNYKDS-UHFFFAOYSA-N 1 1 362.433 4.123 20 5 FIBDMO Cc1sc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)cc1[N+](=O)[O-] ZINC000500763081 1092535856 /nfs/dbraw/zinc/53/58/56/1092535856.db2.gz UOZMWSLUSDURKO-ZDUSSCGKSA-N 1 1 373.478 4.449 20 5 FIBDMO Cc1cc(C(=O)Nc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)ccc1[N+](=O)[O-] ZINC000500775445 1092556931 /nfs/dbraw/zinc/55/69/31/1092556931.db2.gz OXOMLEFMROVCIG-OAHLLOKOSA-N 1 1 367.449 4.387 20 5 FIBDMO CCOc1cc2c(cc1OCC)C[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000521430106 1092692431 /nfs/dbraw/zinc/69/24/31/1092692431.db2.gz ODMOQHZSJJEMCP-UHFFFAOYSA-N 1 1 370.449 4.259 20 5 FIBDMO CCOc1cc2c(cc1OCC)C[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000521430106 1092692440 /nfs/dbraw/zinc/69/24/40/1092692440.db2.gz ODMOQHZSJJEMCP-UHFFFAOYSA-N 1 1 370.449 4.259 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000432926586 1092962020 /nfs/dbraw/zinc/96/20/20/1092962020.db2.gz YCBMLISCMDOJRN-UHFFFAOYSA-N 1 1 360.845 4.165 20 5 FIBDMO C[N@@H+]1CCC[C@H](CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])[C@H]1c1cccs1 ZINC000522013416 1093028509 /nfs/dbraw/zinc/02/85/09/1093028509.db2.gz GPWFEEFNVUBUOT-ZTQAJYAQSA-N 1 1 371.506 4.316 20 5 FIBDMO C[N@H+]1CCC[C@H](CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])[C@H]1c1cccs1 ZINC000522013416 1093028520 /nfs/dbraw/zinc/02/85/20/1093028520.db2.gz GPWFEEFNVUBUOT-ZTQAJYAQSA-N 1 1 371.506 4.316 20 5 FIBDMO C[N@@H+]1CCC[C@H](CN[C@H]2CCc3c2cccc3[N+](=O)[O-])[C@H]1c1cccs1 ZINC000522013414 1093029143 /nfs/dbraw/zinc/02/91/43/1093029143.db2.gz GPWFEEFNVUBUOT-LIVBEALHSA-N 1 1 371.506 4.316 20 5 FIBDMO C[N@H+]1CCC[C@H](CN[C@H]2CCc3c2cccc3[N+](=O)[O-])[C@H]1c1cccs1 ZINC000522013414 1093029154 /nfs/dbraw/zinc/02/91/54/1093029154.db2.gz GPWFEEFNVUBUOT-LIVBEALHSA-N 1 1 371.506 4.316 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](c4ccccc4)C3)n2)c1 ZINC000433072069 1093194848 /nfs/dbraw/zinc/19/48/48/1093194848.db2.gz MZBZFYVTMBSLSI-QGZVFWFLSA-N 1 1 364.405 4.024 20 5 FIBDMO Cc1cccc2nc(C[NH2+][C@@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)cn21 ZINC000433124441 1093307852 /nfs/dbraw/zinc/30/78/52/1093307852.db2.gz CKMDHMUJBNDLTI-GOSISDBHSA-N 1 1 350.422 4.063 20 5 FIBDMO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)on1 ZINC000509813221 1093421146 /nfs/dbraw/zinc/42/11/46/1093421146.db2.gz PPDFRCSUNWYXJX-QGZVFWFLSA-N 1 1 353.378 4.488 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](c4cccc(Cl)c4)C3)nc2c1 ZINC000433299025 1093554307 /nfs/dbraw/zinc/55/43/07/1093554307.db2.gz AUCCDZXFYJLALC-ZDUSSCGKSA-N 1 1 357.797 4.379 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](c4cccc(Cl)c4)C3)nc2c1 ZINC000433299025 1093554309 /nfs/dbraw/zinc/55/43/09/1093554309.db2.gz AUCCDZXFYJLALC-ZDUSSCGKSA-N 1 1 357.797 4.379 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[C@H]1C(C)(C)C ZINC000419325690 1093635786 /nfs/dbraw/zinc/63/57/86/1093635786.db2.gz LIYIVCCLLKWOPN-HZPDHXFCSA-N 1 1 358.442 4.291 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]1c1cccc2c1OCCO2 ZINC000513124091 1093861418 /nfs/dbraw/zinc/86/14/18/1093861418.db2.gz ZFSVLBQLXAPVHB-BQHGXPCASA-N 1 1 366.417 4.216 20 5 FIBDMO C[C@H]1[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC12CCOCC2 ZINC000542708870 1093883676 /nfs/dbraw/zinc/88/36/76/1093883676.db2.gz WNRCRGDSQMXCFO-OAHLLOKOSA-N 1 1 356.422 4.246 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000513246815 1094033930 /nfs/dbraw/zinc/03/39/30/1094033930.db2.gz DDEDYOHJOWZZQY-FOIQADDNSA-N 1 1 367.449 4.315 20 5 FIBDMO COc1ccccc1O[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000513406684 1094105413 /nfs/dbraw/zinc/10/54/13/1094105413.db2.gz WERYKRTZLKSINB-HOTGVXAUSA-N 1 1 356.422 4.208 20 5 FIBDMO C[C@H]1C[C@H](CC[NH2+]Cc2csc([N+](=O)[O-])c2)C[N@H+]1Cc1ccccc1 ZINC000513545575 1094206132 /nfs/dbraw/zinc/20/61/32/1094206132.db2.gz RIIGZUUCJZLXTO-RDJZCZTQSA-N 1 1 359.495 4.047 20 5 FIBDMO CC[N@@H+](C)Cc1cccc(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)c1 ZINC000413073608 1094425143 /nfs/dbraw/zinc/42/51/43/1094425143.db2.gz OSOHUCLJCPKHPA-UHFFFAOYSA-N 1 1 368.359 4.072 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@H](CC(F)(F)F)C3)co2)cc1 ZINC000420947336 1095188849 /nfs/dbraw/zinc/18/88/49/1095188849.db2.gz MSGIJLPCOWXEBE-GFCCVEGCSA-N 1 1 369.343 4.414 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC[C@H](CC(F)(F)F)C3)co2)cc1 ZINC000420947336 1095188859 /nfs/dbraw/zinc/18/88/59/1095188859.db2.gz MSGIJLPCOWXEBE-GFCCVEGCSA-N 1 1 369.343 4.414 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1OC(F)F ZINC000016420001 1095635169 /nfs/dbraw/zinc/63/51/69/1095635169.db2.gz PVGSAQUTGOBIIW-LBPRGKRZSA-N 1 1 366.364 4.398 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccncc2OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000281770286 1095697418 /nfs/dbraw/zinc/69/74/18/1095697418.db2.gz WUOIXDMXVLMJKH-LBPRGKRZSA-N 1 1 369.343 4.090 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(Cl)cc1OC ZINC000421826472 1095939853 /nfs/dbraw/zinc/93/98/53/1095939853.db2.gz SOQSKUMCMDCGHM-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425422434 1098584391 /nfs/dbraw/zinc/58/43/91/1098584391.db2.gz XDTMCFLKZYHGLG-NSHDSACASA-N 1 1 365.227 4.256 20 5 FIBDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425422434 1098584394 /nfs/dbraw/zinc/58/43/94/1098584394.db2.gz XDTMCFLKZYHGLG-NSHDSACASA-N 1 1 365.227 4.256 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1ccc(F)cc1)C(C)C ZINC000532929521 1098601896 /nfs/dbraw/zinc/60/18/96/1098601896.db2.gz CTICINZVWRNQCS-UHFFFAOYSA-N 1 1 373.428 4.282 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(C)c1 ZINC000532931175 1098603617 /nfs/dbraw/zinc/60/36/17/1098603617.db2.gz VCZAPXMQLMNYRC-MRXNPFEDSA-N 1 1 355.438 4.152 20 5 FIBDMO CC[C@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000532966465 1098635588 /nfs/dbraw/zinc/63/55/88/1098635588.db2.gz JHGWGKNAFOMNCU-NWDGAFQWSA-N 1 1 353.850 4.086 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CC1CCCCC1 ZINC000533222903 1098887401 /nfs/dbraw/zinc/88/74/01/1098887401.db2.gz AFJTYDVQACQURS-LBPRGKRZSA-N 1 1 353.850 4.087 20 5 FIBDMO CCN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1 ZINC000505790633 1098913359 /nfs/dbraw/zinc/91/33/59/1098913359.db2.gz ODYPRGROIRYNKV-SJLPKXTDSA-N 1 1 371.456 4.391 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436313826 1098922555 /nfs/dbraw/zinc/92/25/55/1098922555.db2.gz CLQZZNIFMWBFKK-LBPRGKRZSA-N 1 1 360.380 4.075 20 5 FIBDMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccccc2)[C@H](C)C1 ZINC000533290854 1098940168 /nfs/dbraw/zinc/94/01/68/1098940168.db2.gz SYNAJCITDRVXRZ-JFIYKMOQSA-N 1 1 367.449 4.047 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000533435535 1099055469 /nfs/dbraw/zinc/05/54/69/1099055469.db2.gz IAOYKGHLJPDULI-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000533435585 1099056451 /nfs/dbraw/zinc/05/64/51/1099056451.db2.gz LYBVWMIVCSHKDD-YJBOKZPZSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1noc(C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)n1 ZINC000428644073 1099957850 /nfs/dbraw/zinc/95/78/50/1099957850.db2.gz TVSKUOUHWMXXGG-QGZVFWFLSA-N 1 1 372.812 4.013 20 5 FIBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3ccc(Cl)s3)CC2)cc1 ZINC000536681688 1100149446 /nfs/dbraw/zinc/14/94/46/1100149446.db2.gz RCBBOUNDQYXZMY-UHFFFAOYSA-N 1 1 352.843 4.353 20 5 FIBDMO CC1(C)C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC[C@@H]1O ZINC000438336086 1100609952 /nfs/dbraw/zinc/60/99/52/1100609952.db2.gz SRUVXTVJAWAYCQ-IBGZPJMESA-N 1 1 374.412 4.119 20 5 FIBDMO CC1(C)C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC[C@@H]1O ZINC000438336086 1100609958 /nfs/dbraw/zinc/60/99/58/1100609958.db2.gz SRUVXTVJAWAYCQ-IBGZPJMESA-N 1 1 374.412 4.119 20 5 FIBDMO Cc1cc(C(=O)Nc2cccc3c2C[N@@H+](CC(C)C)C3)ccc1[N+](=O)[O-] ZINC000438343444 1100613356 /nfs/dbraw/zinc/61/33/56/1100613356.db2.gz SEYCRNQBEWYUFI-UHFFFAOYSA-N 1 1 353.422 4.127 20 5 FIBDMO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cc(Cl)ccc1Cl ZINC000426121764 1100881459 /nfs/dbraw/zinc/88/14/59/1100881459.db2.gz DPSUADJSZDBCCI-JTQLQIEISA-N 1 1 368.220 4.191 20 5 FIBDMO C[N@H+](CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000518271862 1101054902 /nfs/dbraw/zinc/05/49/02/1101054902.db2.gz NIONNIBQFIZMAX-UHFFFAOYSA-N 1 1 365.433 4.076 20 5 FIBDMO C[N@@H+](CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000518271862 1101054912 /nfs/dbraw/zinc/05/49/12/1101054912.db2.gz NIONNIBQFIZMAX-UHFFFAOYSA-N 1 1 365.433 4.076 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@@H+](C3CCCC3)C2)s1 ZINC000518284639 1101067153 /nfs/dbraw/zinc/06/71/53/1101067153.db2.gz WAUZZICQWHYWTL-HNNXBMFYSA-N 1 1 371.506 4.430 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@H+](C3CCCC3)C2)s1 ZINC000518284639 1101067163 /nfs/dbraw/zinc/06/71/63/1101067163.db2.gz WAUZZICQWHYWTL-HNNXBMFYSA-N 1 1 371.506 4.430 20 5 FIBDMO COc1cc(C[N@H+](C)C/C(C)=C\c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000426374912 1101410786 /nfs/dbraw/zinc/41/07/86/1101410786.db2.gz YUDHDEHMUIFNSI-GDNBJRDFSA-N 1 1 356.422 4.147 20 5 FIBDMO COc1cc(C[N@@H+](C)C/C(C)=C\c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000426374912 1101410796 /nfs/dbraw/zinc/41/07/96/1101410796.db2.gz YUDHDEHMUIFNSI-GDNBJRDFSA-N 1 1 356.422 4.147 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc(Oc2ccccc2)nn1)c1cccc([N+](=O)[O-])c1 ZINC000537078842 1101443077 /nfs/dbraw/zinc/44/30/77/1101443077.db2.gz UMTSPYNLFUQQRG-CQSZACIVSA-N 1 1 350.378 4.028 20 5 FIBDMO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])cc1OC ZINC000506640295 1101652445 /nfs/dbraw/zinc/65/24/45/1101652445.db2.gz XCIGFAJHOATVKR-MRXNPFEDSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])cc1OC ZINC000506640295 1101652453 /nfs/dbraw/zinc/65/24/53/1101652453.db2.gz XCIGFAJHOATVKR-MRXNPFEDSA-N 1 1 360.385 4.088 20 5 FIBDMO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000519026490 1101845395 /nfs/dbraw/zinc/84/53/95/1101845395.db2.gz OPTUVQVUJSCFNN-GOSISDBHSA-N 1 1 354.410 4.063 20 5 FIBDMO CC[C@H](c1cccc(OC)c1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000519026490 1101845413 /nfs/dbraw/zinc/84/54/13/1101845413.db2.gz OPTUVQVUJSCFNN-GOSISDBHSA-N 1 1 354.410 4.063 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000506710821 1101862018 /nfs/dbraw/zinc/86/20/18/1101862018.db2.gz JZSFURWFVKYOFY-GALSZHCDSA-N 1 1 358.463 4.351 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1Cc1ccc([N+](=O)[O-])cc1Cl ZINC001168192132 1102256325 /nfs/dbraw/zinc/25/63/25/1102256325.db2.gz IDSBPNXSXASJIP-JKSUJKDBSA-N 1 1 373.884 4.343 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1ccc(F)cc1 ZINC000532486478 1102427929 /nfs/dbraw/zinc/42/79/29/1102427929.db2.gz FSOQXTMASVACLH-OAHLLOKOSA-N 1 1 373.428 4.454 20 5 FIBDMO C[N@@H+](CC1CC1)C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000537649429 1102672238 /nfs/dbraw/zinc/67/22/38/1102672238.db2.gz LAPOVCFTJIIRCA-QGZVFWFLSA-N 1 1 369.465 4.019 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000537651174 1102704847 /nfs/dbraw/zinc/70/48/47/1102704847.db2.gz ZJGWZLNDHCEWHC-FUKWUPMWSA-N 1 1 352.434 4.147 20 5 FIBDMO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184303131 1102808069 /nfs/dbraw/zinc/80/80/69/1102808069.db2.gz PGCUZCYHJYCJSB-MRXNPFEDSA-N 1 1 362.401 4.382 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CSc3ccc(Br)cc32)cc1 ZINC000486805525 1102939029 /nfs/dbraw/zinc/93/90/29/1102939029.db2.gz XGJMROHYQUHKCJ-CQSZACIVSA-N 1 1 365.252 4.294 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000506944010 1102985901 /nfs/dbraw/zinc/98/59/01/1102985901.db2.gz KDBKSXBNDMIUPS-VNHYZAJKSA-N 1 1 371.403 4.455 20 5 FIBDMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000507008469 1103030778 /nfs/dbraw/zinc/03/07/78/1103030778.db2.gz UCPXSOKTUMSEHW-WBVHZDCISA-N 1 1 362.433 4.390 20 5 FIBDMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccccc1F)C1CCCCC1 ZINC001168266015 1103103514 /nfs/dbraw/zinc/10/35/14/1103103514.db2.gz ZVJODBMTQGILMS-UHFFFAOYSA-N 1 1 360.433 4.074 20 5 FIBDMO COc1cc(C[N@H+](Cc2ccc(F)cc2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000507173398 1103193621 /nfs/dbraw/zinc/19/36/21/1103193621.db2.gz MGFWRVHOIKAFPR-UHFFFAOYSA-N 1 1 362.401 4.162 20 5 FIBDMO COc1cc(C[N@@H+](Cc2ccc(F)cc2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000507173398 1103193631 /nfs/dbraw/zinc/19/36/31/1103193631.db2.gz MGFWRVHOIKAFPR-UHFFFAOYSA-N 1 1 362.401 4.162 20 5 FIBDMO COc1cc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000507189671 1103206574 /nfs/dbraw/zinc/20/65/74/1103206574.db2.gz WENWERGIHJRIGV-INIZCTEOSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])cc1OC ZINC000507189671 1103206580 /nfs/dbraw/zinc/20/65/80/1103206580.db2.gz WENWERGIHJRIGV-INIZCTEOSA-N 1 1 360.385 4.088 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)s1 ZINC000551565890 1103367534 /nfs/dbraw/zinc/36/75/34/1103367534.db2.gz XOAVVAXNHITLAS-ROUUACIJSA-N 1 1 358.463 4.467 20 5 FIBDMO CC[C@@H](C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)Cc1ccccc1 ZINC000507695813 1103625909 /nfs/dbraw/zinc/62/59/09/1103625909.db2.gz XRZDBZZWRWCMJX-OAHLLOKOSA-N 1 1 366.421 4.446 20 5 FIBDMO Cc1ccccc1[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441456371 1104759705 /nfs/dbraw/zinc/75/97/05/1104759705.db2.gz ZJXZGVRMWWDCBT-LAUBAEHRSA-N 1 1 370.449 4.134 20 5 FIBDMO Cc1ccccc1[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441456371 1104759711 /nfs/dbraw/zinc/75/97/11/1104759711.db2.gz ZJXZGVRMWWDCBT-LAUBAEHRSA-N 1 1 370.449 4.134 20 5 FIBDMO CCC[C@@H]([NH2+]Cc1ccc(F)c(CN(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000120920772 1104919933 /nfs/dbraw/zinc/91/99/33/1104919933.db2.gz CFGUCXPQTNGTMC-HXUWFJFHSA-N 1 1 359.445 4.427 20 5 FIBDMO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CCO2 ZINC000184663185 1104937746 /nfs/dbraw/zinc/93/77/46/1104937746.db2.gz CQSZMIZUESWPCW-KRWDZBQOSA-N 1 1 362.813 4.260 20 5 FIBDMO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000520747958 1105193236 /nfs/dbraw/zinc/19/32/36/1105193236.db2.gz QWQMPFCUXFNOEI-CYBMUJFWSA-N 1 1 368.462 4.063 20 5 FIBDMO Cc1c([C@H](C)[NH2+]Cc2nc3cc(Cl)ccc3n2C)cccc1[N+](=O)[O-] ZINC000427894091 1105312254 /nfs/dbraw/zinc/31/22/54/1105312254.db2.gz KFNUTVQTSYMDLZ-LBPRGKRZSA-N 1 1 358.829 4.294 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c1 ZINC000451358068 1107051023 /nfs/dbraw/zinc/05/10/23/1107051023.db2.gz ZQLCWKXOLAVBEB-DJIMGWMZSA-N 1 1 372.387 4.129 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nc4ccc(F)cc4o3)C2)cc1 ZINC000451545909 1107163461 /nfs/dbraw/zinc/16/34/61/1107163461.db2.gz HUVJWIGGXNTZON-CQSZACIVSA-N 1 1 355.369 4.255 20 5 FIBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3nnc(-c4ccccc4)o3)C2)cc1 ZINC000451546392 1107167081 /nfs/dbraw/zinc/16/70/81/1107167081.db2.gz JFROACGATGQNEY-QGZVFWFLSA-N 1 1 364.405 4.024 20 5 FIBDMO Cc1ccccc1NC(=O)[C@H](C)[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548446 1107169659 /nfs/dbraw/zinc/16/96/59/1107169659.db2.gz NGJKDNWLUPQIER-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccccc1NC(=O)[C@H](C)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548446 1107169668 /nfs/dbraw/zinc/16/96/68/1107169668.db2.gz NGJKDNWLUPQIER-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@@]4(CCSC4)C3)o2)c1 ZINC000451986500 1107417464 /nfs/dbraw/zinc/41/74/64/1107417464.db2.gz XSEYPUCTZTXCDF-LJQANCHMSA-N 1 1 373.478 4.011 20 5 FIBDMO CCN(CC)C(=O)[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000531203849 1107645182 /nfs/dbraw/zinc/64/51/82/1107645182.db2.gz YHNKBCYOXNDDDV-OXQOHEQNSA-N 1 1 369.465 4.164 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+](C)Cc3cnccc3C)o2)c([N+](=O)[O-])c1 ZINC000475571506 1107773138 /nfs/dbraw/zinc/77/31/38/1107773138.db2.gz VMJVMDOOZFYDGJ-UHFFFAOYSA-N 1 1 367.405 4.199 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)Cc3cnccc3C)o2)c([N+](=O)[O-])c1 ZINC000475571506 1107773152 /nfs/dbraw/zinc/77/31/52/1107773152.db2.gz VMJVMDOOZFYDGJ-UHFFFAOYSA-N 1 1 367.405 4.199 20 5 FIBDMO CO[C@]1(C)CCC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000475584044 1107806125 /nfs/dbraw/zinc/80/61/25/1107806125.db2.gz XSEMXURCBHTWGC-GOSISDBHSA-N 1 1 361.467 4.109 20 5 FIBDMO Cc1c([C@@H](C)[NH2+][C@H](c2cnn(C)c2)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000186646812 1107831986 /nfs/dbraw/zinc/83/19/86/1107831986.db2.gz UPYUVIKXUZRZHK-VLIAUNLRSA-N 1 1 368.412 4.216 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](C)C1 ZINC000520204189 1108020777 /nfs/dbraw/zinc/02/07/77/1108020777.db2.gz UCXJLOWSNZYXMP-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C)C1 ZINC000520204189 1108020792 /nfs/dbraw/zinc/02/07/92/1108020792.db2.gz UCXJLOWSNZYXMP-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H]1CCCC[N@H+]1CCCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000520208397 1108021187 /nfs/dbraw/zinc/02/11/87/1108021187.db2.gz RGSFAONKLHBWJT-INIZCTEOSA-N 1 1 357.454 4.209 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[NH+]1CCC(C)CC1 ZINC000520221077 1108066999 /nfs/dbraw/zinc/06/69/99/1108066999.db2.gz LRTGKCQVJFJZEV-INIZCTEOSA-N 1 1 357.454 4.065 20 5 FIBDMO COCCc1cc[nH+]c(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1 ZINC000508506592 1108138319 /nfs/dbraw/zinc/13/83/19/1108138319.db2.gz SPWZPZITFTWOOD-UHFFFAOYSA-N 1 1 353.378 4.051 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000520279258 1108276088 /nfs/dbraw/zinc/27/60/88/1108276088.db2.gz UCOYGFUUVCQICD-GOSISDBHSA-N 1 1 360.841 4.120 20 5 FIBDMO C[C@H](NCc1n[nH]c(C2CC2)n1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000453298031 1108374709 /nfs/dbraw/zinc/37/47/09/1108374709.db2.gz UDVVWFAWVVETEI-NSHDSACASA-N 1 1 369.450 4.170 20 5 FIBDMO C[C@H]([NH2+]Cc1nnc(C2CC2)[nH]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000453298031 1108374734 /nfs/dbraw/zinc/37/47/34/1108374734.db2.gz UDVVWFAWVVETEI-NSHDSACASA-N 1 1 369.450 4.170 20 5 FIBDMO COc1ccc(C[N@@H+]2CCS[C@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000524037096 1108768194 /nfs/dbraw/zinc/76/81/94/1108768194.db2.gz UHLYSHINKSFVQG-KUHUBIRLSA-N 1 1 358.463 4.282 20 5 FIBDMO COc1ccc(C[N@H+]2CCS[C@H](C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000524037096 1108768207 /nfs/dbraw/zinc/76/82/07/1108768207.db2.gz UHLYSHINKSFVQG-KUHUBIRLSA-N 1 1 358.463 4.282 20 5 FIBDMO Cc1ccsc1C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000021793404 1108944528 /nfs/dbraw/zinc/94/45/28/1108944528.db2.gz OLQQNHKETNYBBQ-NSHDSACASA-N 1 1 367.858 4.077 20 5 FIBDMO Cc1ccsc1C[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000021793404 1108944532 /nfs/dbraw/zinc/94/45/32/1108944532.db2.gz OLQQNHKETNYBBQ-NSHDSACASA-N 1 1 367.858 4.077 20 5 FIBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCc2ccccc21 ZINC000508592725 1109500942 /nfs/dbraw/zinc/50/09/42/1109500942.db2.gz BOIBBRISSDIHOB-FQEVSTJZSA-N 1 1 368.433 4.361 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cccnc1OC1CCCC1)CCC2 ZINC000447533688 1109569706 /nfs/dbraw/zinc/56/97/06/1109569706.db2.gz YHEXRZSJKKMDQT-FQEVSTJZSA-N 1 1 367.449 4.478 20 5 FIBDMO CCO[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)C[C@H]1C ZINC000449496991 1110093403 /nfs/dbraw/zinc/09/34/03/1110093403.db2.gz QPSLVGCXWLVQPX-AUUYWEPGSA-N 1 1 374.437 4.110 20 5 FIBDMO Cc1cc(N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461965187 1111443626 /nfs/dbraw/zinc/44/36/26/1111443626.db2.gz LYBNAJYEOGQDIA-AWEZNQCLSA-N 1 1 371.403 4.090 20 5 FIBDMO CCc1nc2c(s1)[C@H]([N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000478051479 1111666625 /nfs/dbraw/zinc/66/66/25/1111666625.db2.gz CBSZQFXGWYSSND-MRXNPFEDSA-N 1 1 361.467 4.002 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccc2)C2(CO)CCC2)c(Cl)c1 ZINC000552316732 1111675641 /nfs/dbraw/zinc/67/56/41/1111675641.db2.gz KWXOARQQLBHRSF-SFHVURJKSA-N 1 1 360.841 4.242 20 5 FIBDMO CC(=O)c1cc(NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000553076520 1111903200 /nfs/dbraw/zinc/90/32/00/1111903200.db2.gz PQBWISONBPABDB-AUUYWEPGSA-N 1 1 373.478 4.354 20 5 FIBDMO C[C@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000479511289 1112055140 /nfs/dbraw/zinc/05/51/40/1112055140.db2.gz IZIDBORLDLLQPR-QWRGUYRKSA-N 1 1 350.216 4.164 20 5 FIBDMO CC[C@@H]([NH2+][C@H](CN1CCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000480278554 1112370692 /nfs/dbraw/zinc/37/06/92/1112370692.db2.gz PAHYEOBISPWQIK-NHCUHLMSSA-N 1 1 353.466 4.473 20 5 FIBDMO C[C@H](O)C[C@@H]1CCCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555524410 1112910604 /nfs/dbraw/zinc/91/06/04/1112910604.db2.gz KSXOGQYHBLWEMN-JSGCOSHPSA-N 1 1 360.376 4.129 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCc2nc(C(C)(C)C)ncc2C1 ZINC000600185331 1112919061 /nfs/dbraw/zinc/91/90/61/1112919061.db2.gz LAGWPRDIWCEAST-GDNBJRDFSA-N 1 1 366.465 4.144 20 5 FIBDMO CC1(C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]2CCC[C@@H]21 ZINC000555721352 1112978538 /nfs/dbraw/zinc/97/85/38/1112978538.db2.gz LNMNNRVKNBLXBB-IRXDYDNUSA-N 1 1 355.438 4.303 20 5 FIBDMO Cc1c([C@H](C)N[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000482358517 1113232155 /nfs/dbraw/zinc/23/21/55/1113232155.db2.gz MPTUAIXPXLQLKQ-YQVWRLOYSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1c([C@H](C)N[C@@H]2CC[N@H+]([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000482358517 1113232158 /nfs/dbraw/zinc/23/21/58/1113232158.db2.gz MPTUAIXPXLQLKQ-YQVWRLOYSA-N 1 1 353.466 4.389 20 5 FIBDMO CC[N@@H+](CC1CCN(c2ccccn2)CC1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000160041316 1113286766 /nfs/dbraw/zinc/28/67/66/1113286766.db2.gz GXNLJYKFARYBJA-KRWDZBQOSA-N 1 1 368.481 4.289 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(Br)o2)C2CC2)c1 ZINC000483174589 1113457260 /nfs/dbraw/zinc/45/72/60/1113457260.db2.gz RHLJJGFMLCONAN-UHFFFAOYSA-N 1 1 351.200 4.115 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc(Br)o2)C2CC2)c1 ZINC000483174589 1113457262 /nfs/dbraw/zinc/45/72/62/1113457262.db2.gz RHLJJGFMLCONAN-UHFFFAOYSA-N 1 1 351.200 4.115 20 5 FIBDMO CC(C)[C@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000246651126 1113899154 /nfs/dbraw/zinc/89/91/54/1113899154.db2.gz BWNCHOFQZCSZEZ-CABCVRRESA-N 1 1 358.442 4.464 20 5 FIBDMO CC[C@@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)N1CCCC1 ZINC000490171811 1114229971 /nfs/dbraw/zinc/22/99/71/1114229971.db2.gz ILTLODXSYOQTJD-PZJWPPBQSA-N 1 1 353.466 4.148 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OCC(F)F ZINC000491095629 1114373095 /nfs/dbraw/zinc/37/30/95/1114373095.db2.gz ZUODJRRRWWCVLY-JSGCOSHPSA-N 1 1 370.396 4.012 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000164405264 1114494161 /nfs/dbraw/zinc/49/41/61/1114494161.db2.gz BWQGBMCALDQRTN-LJQANCHMSA-N 1 1 371.412 4.208 20 5 FIBDMO O=[N+]([O-])c1c(F)cccc1NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000057139506 1114882168 /nfs/dbraw/zinc/88/21/68/1114882168.db2.gz YKAJBRYQOZBVOF-UHFFFAOYSA-N 1 1 365.355 4.089 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c1 ZINC000590170157 1114907206 /nfs/dbraw/zinc/90/72/06/1114907206.db2.gz AZPZYVKIFGTACT-ZIAGYGMSSA-N 1 1 372.387 4.252 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[NH2+]C4(CCC4)C3)s2)cc1 ZINC000591282638 1115055037 /nfs/dbraw/zinc/05/50/37/1115055037.db2.gz ISCKEUVLJXIRBD-OAHLLOKOSA-N 1 1 357.479 4.088 20 5 FIBDMO C[N@H+](CCc1ccccc1F)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000760835403 1115090162 /nfs/dbraw/zinc/09/01/62/1115090162.db2.gz ZRTFRMCCBOQQST-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1ccccc1F)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000760835403 1115090167 /nfs/dbraw/zinc/09/01/67/1115090167.db2.gz ZRTFRMCCBOQQST-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3csc([N+](=O)[O-])c3)cc2)C1 ZINC000046156240 1115193025 /nfs/dbraw/zinc/19/30/25/1115193025.db2.gz ADUNEBXFRGQFGJ-ZDUSSCGKSA-N 1 1 359.451 4.141 20 5 FIBDMO C[C@@H]1CC2(C[N@H+]1Cc1ccc(-c3ccc([N+](=O)[O-])cc3)o1)CCOCC2 ZINC000592529175 1115241084 /nfs/dbraw/zinc/24/10/84/1115241084.db2.gz YLMMOMZSHNPAOT-OAHLLOKOSA-N 1 1 356.422 4.246 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccccc1OC1CCC1 ZINC000595018661 1115503873 /nfs/dbraw/zinc/50/38/73/1115503873.db2.gz CQOBZLZQTKTEHM-AWEZNQCLSA-N 1 1 356.422 4.386 20 5 FIBDMO CC[NH+](CC)Cc1cccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595019471 1115504649 /nfs/dbraw/zinc/50/46/49/1115504649.db2.gz WJJSAXBXYJXQHN-INIZCTEOSA-N 1 1 371.481 4.296 20 5 FIBDMO CC[NH+](CC)Cc1ccccc1CN[C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595004319 1115507437 /nfs/dbraw/zinc/50/74/37/1115507437.db2.gz PAWWHISNNLNEOS-MRXNPFEDSA-N 1 1 371.481 4.296 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCc1ccccc1C[N@H+](C)C(C)C ZINC000595008162 1115508091 /nfs/dbraw/zinc/50/80/91/1115508091.db2.gz RNUUWPGJGDMRBB-MRXNPFEDSA-N 1 1 371.481 4.294 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCc1ccccc1C[N@@H+](C)C(C)C ZINC000595008162 1115508093 /nfs/dbraw/zinc/50/80/93/1115508093.db2.gz RNUUWPGJGDMRBB-MRXNPFEDSA-N 1 1 371.481 4.294 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@@H](COC)c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000595068386 1115509381 /nfs/dbraw/zinc/50/93/81/1115509381.db2.gz OHIYONHTXUMJKP-KSSFIOAISA-N 1 1 374.437 4.040 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(OC(C)(C)C)nc1 ZINC000595032791 1115510685 /nfs/dbraw/zinc/51/06/85/1115510685.db2.gz KNYSELDHSPCEEX-CYBMUJFWSA-N 1 1 359.426 4.027 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000595051654 1115512028 /nfs/dbraw/zinc/51/20/28/1115512028.db2.gz QPWOYPDDMHIKPA-PXAZEXFGSA-N 1 1 364.829 4.031 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cc(F)ccc1OC(F)F ZINC000595094552 1115517539 /nfs/dbraw/zinc/51/75/39/1115517539.db2.gz XTZVPWKHPLQPCP-CQSZACIVSA-N 1 1 352.312 4.112 20 5 FIBDMO CCOc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC(F)F ZINC000046777062 1115528322 /nfs/dbraw/zinc/52/83/22/1115528322.db2.gz ZIOLUMKTVIONLH-UHFFFAOYSA-N 1 1 366.364 4.227 20 5 FIBDMO CCOc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1OC(F)F ZINC000046777062 1115528324 /nfs/dbraw/zinc/52/83/24/1115528324.db2.gz ZIOLUMKTVIONLH-UHFFFAOYSA-N 1 1 366.364 4.227 20 5 FIBDMO Cc1noc(C[N@H+](Cc2ccccc2)[C@H]2CC(C)(C)OC2(C)C)c1[N+](=O)[O-] ZINC000595422267 1115535515 /nfs/dbraw/zinc/53/55/15/1115535515.db2.gz LRDOLRHYGVKQMI-KRWDZBQOSA-N 1 1 373.453 4.240 20 5 FIBDMO Cc1noc(C[N@@H+](Cc2ccccc2)[C@H]2CC(C)(C)OC2(C)C)c1[N+](=O)[O-] ZINC000595422267 1115535518 /nfs/dbraw/zinc/53/55/18/1115535518.db2.gz LRDOLRHYGVKQMI-KRWDZBQOSA-N 1 1 373.453 4.240 20 5 FIBDMO C[C@@H]([NH2+][C@@H](CO)c1cccc(Cl)c1Cl)c1cccc([N+](=O)[O-])c1 ZINC000595827440 1115564808 /nfs/dbraw/zinc/56/48/08/1115564808.db2.gz BXPAMCPWFBUBCQ-BMIGLBTASA-N 1 1 355.221 4.286 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCc2ccccc2-n2ccnc21 ZINC000596118264 1115574687 /nfs/dbraw/zinc/57/46/87/1115574687.db2.gz UZDRKWHCZJVULR-QZTJIDSGSA-N 1 1 360.417 4.045 20 5 FIBDMO Cc1cc([N@H+]2CCCC[C@@H]2C)ccc1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596161182 1115577991 /nfs/dbraw/zinc/57/79/91/1115577991.db2.gz FCIAUPQPUVVRRA-AWEZNQCLSA-N 1 1 368.437 4.125 20 5 FIBDMO Cc1cc([N@@H+]2CCCC[C@@H]2C)ccc1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1 ZINC000596161182 1115577995 /nfs/dbraw/zinc/57/79/95/1115577995.db2.gz FCIAUPQPUVVRRA-AWEZNQCLSA-N 1 1 368.437 4.125 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+](Cc2cccs2)C[C@H]2CCCO2)ccc1Cl ZINC000761243559 1115691313 /nfs/dbraw/zinc/69/13/13/1115691313.db2.gz IRZDDMRNZOWDRD-CQSZACIVSA-N 1 1 366.870 4.491 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+](Cc2cccs2)C[C@H]2CCCO2)ccc1Cl ZINC000761243559 1115691316 /nfs/dbraw/zinc/69/13/16/1115691316.db2.gz IRZDDMRNZOWDRD-CQSZACIVSA-N 1 1 366.870 4.491 20 5 FIBDMO O=[N+]([O-])c1sc(C[NH2+][C@H](c2cccnc2)C2CC2)cc1Br ZINC000602578811 1115713220 /nfs/dbraw/zinc/71/32/20/1115713220.db2.gz HGPOPDZVEWYRKJ-ZDUSSCGKSA-N 1 1 368.256 4.055 20 5 FIBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000060890111 1115725400 /nfs/dbraw/zinc/72/54/00/1115725400.db2.gz SUYLYQGONONOJN-ZDUSSCGKSA-N 1 1 353.850 4.087 20 5 FIBDMO Cc1c(NC(=O)CC[NH2+][C@H](C(F)F)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000598647457 1115742911 /nfs/dbraw/zinc/74/29/11/1115742911.db2.gz BAKGHJHTPQCCBG-KRWDZBQOSA-N 1 1 369.412 4.035 20 5 FIBDMO COc1cc(C[N@@H+](C)CC2CCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000603457166 1115776605 /nfs/dbraw/zinc/77/66/05/1115776605.db2.gz WYJJMGOPUOKCKF-UHFFFAOYSA-N 1 1 358.385 4.217 20 5 FIBDMO C[C@H](Nc1ccc2cnccc2c1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000599066954 1115786569 /nfs/dbraw/zinc/78/65/69/1115786569.db2.gz VJVNNASEMWZBHB-GOEBONIOSA-N 1 1 354.454 4.208 20 5 FIBDMO Cc1c([C@@H](C)[NH2+][C@@H](Cc2ccccc2)c2nccn2C)cccc1[N+](=O)[O-] ZINC000593721879 1115804480 /nfs/dbraw/zinc/80/44/80/1115804480.db2.gz MVFKPKAMQOUXOX-APWZRJJASA-N 1 1 364.449 4.271 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](CCO)c1cc(Cl)cc(Cl)c1 ZINC000599665232 1115834674 /nfs/dbraw/zinc/83/46/74/1115834674.db2.gz HEVFJZFGJZTLPV-HNNXBMFYSA-N 1 1 355.221 4.115 20 5 FIBDMO O=[N+]([O-])c1ccc(OCCC[NH+](Cc2ccco2)Cc2ccco2)cc1 ZINC000604012618 1115840971 /nfs/dbraw/zinc/84/09/71/1115840971.db2.gz WSMYYSDGEXYUOF-UHFFFAOYSA-N 1 1 356.378 4.252 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)c(C)c1 ZINC000604081446 1115846772 /nfs/dbraw/zinc/84/67/72/1115846772.db2.gz UDOHPQIARCJZPW-HNNXBMFYSA-N 1 1 356.422 4.271 20 5 FIBDMO CC(=O)c1ccc(NC[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000604472624 1115866245 /nfs/dbraw/zinc/86/62/45/1115866245.db2.gz KUYSPPCPVYOEKS-SFHVURJKSA-N 1 1 367.449 4.122 20 5 FIBDMO COc1ccc(C[N@@H+](C)C[C@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000604521700 1115867463 /nfs/dbraw/zinc/86/74/63/1115867463.db2.gz UJHYDMFCVYLCPC-NQIIRXRSSA-N 1 1 370.449 4.203 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000608836066 1116131209 /nfs/dbraw/zinc/13/12/09/1116131209.db2.gz JLZZNZJTCXJDMV-DOTOQJQBSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[N@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000608836066 1116131211 /nfs/dbraw/zinc/13/12/11/1116131211.db2.gz JLZZNZJTCXJDMV-DOTOQJQBSA-N 1 1 357.479 4.040 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(OC4CCCC4)CC3)co2)cc1 ZINC000089891499 1116340971 /nfs/dbraw/zinc/34/09/71/1116340971.db2.gz KSBLOKXLOGCNEU-UHFFFAOYSA-N 1 1 371.437 4.173 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCC[C@@H]3C3CCOCC3)cs2)c1 ZINC000539670263 1116363613 /nfs/dbraw/zinc/36/36/13/1116363613.db2.gz SJEYWXCZMDZXJS-GOSISDBHSA-N 1 1 373.478 4.109 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000539830515 1116387809 /nfs/dbraw/zinc/38/78/09/1116387809.db2.gz BKPQQMAWJPHNIZ-INIZCTEOSA-N 1 1 361.467 4.268 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCCc2nc(C)sc21 ZINC000539830515 1116387811 /nfs/dbraw/zinc/38/78/11/1116387811.db2.gz BKPQQMAWJPHNIZ-INIZCTEOSA-N 1 1 361.467 4.268 20 5 FIBDMO CCc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000540146504 1117897977 /nfs/dbraw/zinc/89/79/77/1117897977.db2.gz ZVENMMTYSXQJCB-RYUDHWBXSA-N 1 1 371.466 4.416 20 5 FIBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cncc(C(F)(F)F)c1 ZINC000463072696 1117957313 /nfs/dbraw/zinc/95/73/13/1117957313.db2.gz FCBMEHOWMYCWAL-UHFFFAOYSA-N 1 1 353.344 4.419 20 5 FIBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cncc(C(F)(F)F)c1 ZINC000463072696 1117957317 /nfs/dbraw/zinc/95/73/17/1117957317.db2.gz FCBMEHOWMYCWAL-UHFFFAOYSA-N 1 1 353.344 4.419 20 5 FIBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(Br)s1 ZINC000443308811 1117971094 /nfs/dbraw/zinc/97/10/94/1117971094.db2.gz GBJANJJPPHVWEV-MRVPVSSYSA-N 1 1 359.220 4.409 20 5 FIBDMO Cc1ccccc1[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000540592445 1118137678 /nfs/dbraw/zinc/13/76/78/1118137678.db2.gz SKIGAALDLFPMCS-LJQANCHMSA-N 1 1 364.405 4.194 20 5 FIBDMO COc1cccc(C2CC[NH+](Cc3cc(OC)c(F)cc3[N+](=O)[O-])CC2)c1 ZINC000463508020 1118186513 /nfs/dbraw/zinc/18/65/13/1118186513.db2.gz UCQXWOBMYQUTME-UHFFFAOYSA-N 1 1 374.412 4.131 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000122411367 1118397003 /nfs/dbraw/zinc/39/70/03/1118397003.db2.gz LDSXSMWHDCEBRP-MRXNPFEDSA-N 1 1 362.813 4.260 20 5 FIBDMO CCc1ccc([C@H]([NH2+]CCOCC(F)(F)F)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541545768 1118550534 /nfs/dbraw/zinc/55/05/34/1118550534.db2.gz LRXPZACLCBWNKE-MRXNPFEDSA-N 1 1 372.343 4.008 20 5 FIBDMO CCc1ccc([C@H]([NH2+][C@@H](C)Cc2cc(C)[nH]n2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541564645 1118556578 /nfs/dbraw/zinc/55/65/78/1118556578.db2.gz AONUZFYZJMJYFV-RNODOKPDSA-N 1 1 368.437 4.092 20 5 FIBDMO Cc1ccc(CC[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@H]2CCCO2)cc1 ZINC000464781921 1118692883 /nfs/dbraw/zinc/69/28/83/1118692883.db2.gz WYQBQCFYFPJCFA-GOSISDBHSA-N 1 1 360.479 4.188 20 5 FIBDMO C[C@H](c1ccc(F)c(F)c1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000464783188 1118693694 /nfs/dbraw/zinc/69/36/94/1118693694.db2.gz HLEJNTJWVDULOL-CYBMUJFWSA-N 1 1 362.376 4.477 20 5 FIBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@H+]2CCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000464841713 1118717846 /nfs/dbraw/zinc/71/78/46/1118717846.db2.gz YVLMPMDWSIZGEH-BEFAXECRSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1ccc(NC(=O)[C@H](c2ccccc2)[N@@H+]2CCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000464841713 1118717848 /nfs/dbraw/zinc/71/78/48/1118717848.db2.gz YVLMPMDWSIZGEH-BEFAXECRSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCc2ccccc2-n2ccnc21 ZINC000596095300 1118868968 /nfs/dbraw/zinc/86/89/68/1118868968.db2.gz OSWHROKRPAAPJD-BEFAXECRSA-N 1 1 362.433 4.427 20 5 FIBDMO COc1cc(C[NH2+][C@@H](CC(F)(F)F)c2ccccc2)ccc1[N+](=O)[O-] ZINC000492938397 1119224105 /nfs/dbraw/zinc/22/41/05/1119224105.db2.gz ZOBPFZUIKIHLEC-AWEZNQCLSA-N 1 1 354.328 4.387 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494292842 1119822484 /nfs/dbraw/zinc/82/24/84/1119822484.db2.gz JWUPQYGASIGIEU-AKMXKPQHSA-N 1 1 367.449 4.266 20 5 FIBDMO C/C(=C/c1ccccc1)C[N@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000494292842 1119822492 /nfs/dbraw/zinc/82/24/92/1119822492.db2.gz JWUPQYGASIGIEU-AKMXKPQHSA-N 1 1 367.449 4.266 20 5 FIBDMO Cc1c([C@H](C)N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000495440342 1120824222 /nfs/dbraw/zinc/82/42/22/1120824222.db2.gz RGBQZMXLZXTEOF-HBFSDRIKSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1c([C@H](C)N[C@H](C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000495440342 1120824229 /nfs/dbraw/zinc/82/42/29/1120824229.db2.gz RGBQZMXLZXTEOF-HBFSDRIKSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc(C[NH+]2CCC(C(=O)c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000193421067 1120884108 /nfs/dbraw/zinc/88/41/08/1120884108.db2.gz FMIQYHBAXPBUDN-UHFFFAOYSA-N 1 1 356.397 4.137 20 5 FIBDMO C[C@H](CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[NH+](C)C ZINC000609223249 1120998350 /nfs/dbraw/zinc/99/83/50/1120998350.db2.gz AKLZLVAZCPGVNV-CYBMUJFWSA-N 1 1 363.845 4.080 20 5 FIBDMO CC(=O)c1ccc(NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301430588 1121156114 /nfs/dbraw/zinc/15/61/14/1121156114.db2.gz QIBGGKIAOYWZQY-KXBFYZLASA-N 1 1 373.478 4.354 20 5 FIBDMO CSc1ccccc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000282177805 1121348754 /nfs/dbraw/zinc/34/87/54/1121348754.db2.gz ZEMFYTQQECFBGO-GFCCVEGCSA-N 1 1 360.435 4.034 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(c2c3ccccc3ncc2[N+](=O)[O-])C1 ZINC000488076395 1121409307 /nfs/dbraw/zinc/40/93/07/1121409307.db2.gz MXWSYTOVEQVWRQ-IAGOWNOFSA-N 1 1 368.481 4.234 20 5 FIBDMO C[N@@H+]1CCc2c(NCc3ccc(F)c(Cl)c3F)ccc([N+](=O)[O-])c2C1 ZINC001168513289 1121621238 /nfs/dbraw/zinc/62/12/38/1121621238.db2.gz IDSSYVMYLHACPT-UHFFFAOYSA-N 1 1 367.783 4.126 20 5 FIBDMO C[N@H+]1CCc2c(NCc3ccc(F)c(Cl)c3F)ccc([N+](=O)[O-])c2C1 ZINC001168513289 1121621246 /nfs/dbraw/zinc/62/12/46/1121621246.db2.gz IDSSYVMYLHACPT-UHFFFAOYSA-N 1 1 367.783 4.126 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3CCC(C4CCCCC4)CC3)n2)c1 ZINC000917060021 1122039452 /nfs/dbraw/zinc/03/94/52/1122039452.db2.gz PHBJUNDUAQVCTD-UHFFFAOYSA-N 1 1 370.453 4.437 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000301510029 1122193064 /nfs/dbraw/zinc/19/30/64/1122193064.db2.gz DXNNHVSAUJQYRD-OXQOHEQNSA-N 1 1 369.465 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H](c1ccccc1)C(C)C ZINC000497389452 1122202156 /nfs/dbraw/zinc/20/21/56/1122202156.db2.gz MPSBYZVKXWCCHT-FQEVSTJZSA-N 1 1 355.438 4.171 20 5 FIBDMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000301560062 1122219661 /nfs/dbraw/zinc/21/96/61/1122219661.db2.gz UJOJRTFYPFPQCS-CABZTGNLSA-N 1 1 365.783 4.043 20 5 FIBDMO COc1ccc(C[N@@H+](C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000273411195 1122253782 /nfs/dbraw/zinc/25/37/82/1122253782.db2.gz IIGGXFAZOKPLHQ-FXAWDEMLSA-N 1 1 374.412 4.095 20 5 FIBDMO COc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2C)CC2CC2)c(OC)c1 ZINC000919673836 1123081865 /nfs/dbraw/zinc/08/18/65/1123081865.db2.gz OEPDIKNGEZQZOA-UHFFFAOYSA-N 1 1 370.449 4.333 20 5 FIBDMO COc1ccc(COCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000609385307 1123699093 /nfs/dbraw/zinc/69/90/93/1123699093.db2.gz PQOSWMPDERUOGE-UHFFFAOYSA-N 1 1 358.438 4.031 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000609441811 1123714008 /nfs/dbraw/zinc/71/40/08/1123714008.db2.gz DPGBQHKCHXGQEQ-CQSZACIVSA-N 1 1 371.412 4.361 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]Cc3ccc(F)c(F)c3)cs2)c1 ZINC000609598802 1123764419 /nfs/dbraw/zinc/76/44/19/1123764419.db2.gz RLEWZZPNOXJUMP-UHFFFAOYSA-N 1 1 361.373 4.286 20 5 FIBDMO C[C@H]1C[C@H](N(C)c2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000609964791 1123899133 /nfs/dbraw/zinc/89/91/33/1123899133.db2.gz MDICQIURRBAQBO-MAUKXSAKSA-N 1 1 357.429 4.223 20 5 FIBDMO COc1ccc([C@@H](C)[NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])c(C)c1OC ZINC000553957306 1124237592 /nfs/dbraw/zinc/23/75/92/1124237592.db2.gz MBHYVBMPKWKREL-GFCCVEGCSA-N 1 1 364.829 4.425 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC(C)(C)[C@@H]1c1cccs1 ZINC000554311443 1124326904 /nfs/dbraw/zinc/32/69/04/1124326904.db2.gz ZXRCIOUFDFNNGN-SFHVURJKSA-N 1 1 373.478 4.376 20 5 FIBDMO Cc1c([C@H](C)[NH2+]Cc2cccnc2OC2CCCC2)cccc1[N+](=O)[O-] ZINC000153887388 1124809082 /nfs/dbraw/zinc/80/90/82/1124809082.db2.gz GGRHMVBEWZUVMM-HNNXBMFYSA-N 1 1 355.438 4.470 20 5 FIBDMO O=[N+]([O-])c1cnc(NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c(Cl)c1 ZINC000301250298 1125049220 /nfs/dbraw/zinc/04/92/20/1125049220.db2.gz BDGXPWSHDLDWSQ-LBPRGKRZSA-N 1 1 366.874 4.029 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113314852 1125148921 /nfs/dbraw/zinc/14/89/21/1125148921.db2.gz SHQFQHXPRLFYSU-OAHLLOKOSA-N 1 1 374.510 4.072 20 5 FIBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(Br)c1 ZINC000181920763 1125184802 /nfs/dbraw/zinc/18/48/02/1125184802.db2.gz JAOCONVOAYYWGF-LLVKDONJSA-N 1 1 365.227 4.217 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c(C(F)(F)F)c1 ZINC000301750040 1125186089 /nfs/dbraw/zinc/18/60/89/1125186089.db2.gz ALAZXKDLNQEAJQ-MLGOLLRUSA-N 1 1 369.387 4.067 20 5 FIBDMO Cc1[nH+]ccn1-c1ccc([C@H](C)Nc2ncc(Cl)cc2[N+](=O)[O-])cc1 ZINC000301740408 1125190634 /nfs/dbraw/zinc/19/06/34/1125190634.db2.gz KKLIUKPRBNEQBY-NSHDSACASA-N 1 1 357.801 4.310 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCc2sc(Br)cc21 ZINC000312615794 1125426468 /nfs/dbraw/zinc/42/64/68/1125426468.db2.gz GHGAXTYXBQAQOZ-NSHDSACASA-N 1 1 353.241 4.196 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H](n3cc(Cl)cn3)C2)o1 ZINC000569894947 568434674 /nfs/dbraw/zinc/43/46/74/568434674.db2.gz HJORACAPZZWCJO-CQSZACIVSA-N 1 1 372.812 4.152 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H](n3cc(Cl)cn3)C2)o1 ZINC000569894947 568434676 /nfs/dbraw/zinc/43/46/76/568434676.db2.gz HJORACAPZZWCJO-CQSZACIVSA-N 1 1 372.812 4.152 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCc3cccnc32)cc(C(F)(F)F)c1 ZINC000619611403 1125634013 /nfs/dbraw/zinc/63/40/13/1125634013.db2.gz GQZCLALVISMMKD-HNNXBMFYSA-N 1 1 351.328 4.176 20 5 FIBDMO Cc1cc(C)cc([C@H](C)[NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)c1 ZINC000182920235 1125691542 /nfs/dbraw/zinc/69/15/42/1125691542.db2.gz BHGPWWMRZLXKKV-AWEZNQCLSA-N 1 1 352.394 4.112 20 5 FIBDMO CCc1nc2cc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3F)ccc2n1C1CC1 ZINC000619798673 1125702738 /nfs/dbraw/zinc/70/27/38/1125702738.db2.gz PPUVFLJQJCYRHL-UHFFFAOYSA-N 1 1 368.412 4.271 20 5 FIBDMO C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)Cc1cccc2ccccc21 ZINC001167048302 1079587321 /nfs/dbraw/zinc/58/73/21/1079587321.db2.gz HGWLHGUMXDJUNF-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)Cc1cccc2ccccc21 ZINC001167048302 1079587332 /nfs/dbraw/zinc/58/73/32/1079587332.db2.gz HGWLHGUMXDJUNF-UHFFFAOYSA-N 1 1 374.400 4.430 20 5 FIBDMO C[N@@H+](CC1CC1)C[C@@H]1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000557628540 1079593767 /nfs/dbraw/zinc/59/37/67/1079593767.db2.gz DPOVFHQJYQSAPK-LBPRGKRZSA-N 1 1 358.269 4.070 20 5 FIBDMO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(c3ccsc3)CC2)cccc1[N+](=O)[O-] ZINC000186940549 1079747730 /nfs/dbraw/zinc/74/77/30/1079747730.db2.gz VEDPJWJVMQHJIM-CQSZACIVSA-N 1 1 373.478 4.171 20 5 FIBDMO COc1cc(C[N@H+]2C[C@@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000610215342 1079987375 /nfs/dbraw/zinc/98/73/75/1079987375.db2.gz FAIJURMZSPQUOW-NWDGAFQWSA-N 1 1 358.385 4.215 20 5 FIBDMO COc1cc(C[N@H+]2C[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000610215341 1079987515 /nfs/dbraw/zinc/98/75/15/1079987515.db2.gz FAIJURMZSPQUOW-NEPJUHHUSA-N 1 1 358.385 4.215 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1cccc(N(C)C)c1 ZINC000430218736 1080008625 /nfs/dbraw/zinc/00/86/25/1080008625.db2.gz KWCDFBBJDIMFQN-LJQANCHMSA-N 1 1 355.438 4.007 20 5 FIBDMO Cc1ccc(NC(=O)N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000118787467 1080057184 /nfs/dbraw/zinc/05/71/84/1080057184.db2.gz IGZIFVXKOXZCPJ-IRXDYDNUSA-N 1 1 374.485 4.022 20 5 FIBDMO CC(C)(C)c1ccc2c(c1)CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2 ZINC001167271244 1080936738 /nfs/dbraw/zinc/93/67/38/1080936738.db2.gz XQYRPFNSMCKNMI-UHFFFAOYSA-N 1 1 354.450 4.329 20 5 FIBDMO CC(C)Oc1ncccc1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001648808468 1081113090 /nfs/dbraw/zinc/11/30/90/1081113090.db2.gz QLIRSTKTHGLLBO-UHFFFAOYSA-N 1 1 367.405 4.327 20 5 FIBDMO Cc1oc(-c2cccs2)nc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511134800 1081252867 /nfs/dbraw/zinc/25/28/67/1081252867.db2.gz BXMWYVBWJGWYJJ-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO Cc1oc(-c2cccs2)nc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511134800 1081252874 /nfs/dbraw/zinc/25/28/74/1081252874.db2.gz BXMWYVBWJGWYJJ-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO CC[C@@H](C)[C@H](C)[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC001167356320 1081617413 /nfs/dbraw/zinc/61/74/13/1081617413.db2.gz MCIKWTDSHBZCIQ-NEPJUHHUSA-N 1 1 353.850 4.086 20 5 FIBDMO N=c1cc(C[NH3+])ncn1-c1c2ccccc2cc2c3ccccc3ccc21 ZINC001167360001 1081716683 /nfs/dbraw/zinc/71/66/83/1081716683.db2.gz ZGHCMJRLCLXLRU-UHFFFAOYSA-N 1 1 350.425 4.270 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@]4(CCCOC4)C3)o2)cc1 ZINC000536659201 1081913804 /nfs/dbraw/zinc/91/38/04/1081913804.db2.gz NGBCXJHUSFLPTO-FQEVSTJZSA-N 1 1 356.422 4.247 20 5 FIBDMO C[N@@H+](CCc1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1)C1CC1 ZINC000537132182 1082002445 /nfs/dbraw/zinc/00/24/45/1082002445.db2.gz SGDBHQMIBRCAIX-UHFFFAOYSA-N 1 1 373.840 4.137 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2)C3)s1 ZINC000610469434 1082232063 /nfs/dbraw/zinc/23/20/63/1082232063.db2.gz OXIMRYGIQXLSSF-LJQANCHMSA-N 1 1 357.479 4.149 20 5 FIBDMO COCc1cc([N+](=O)[O-])ccc1NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000610468548 1082238202 /nfs/dbraw/zinc/23/82/02/1082238202.db2.gz XXEPKEGIJZCZIT-GOSISDBHSA-N 1 1 369.465 4.065 20 5 FIBDMO C[C@@H](c1ccccc1)[NH+]1CCC(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000581142667 1082341978 /nfs/dbraw/zinc/34/19/78/1082341978.db2.gz PPIPJEGPZOHRRY-HRAATJIYSA-N 1 1 365.477 4.397 20 5 FIBDMO C[C@@H](c1ccccc1)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC1CCC1 ZINC001167453968 1082447787 /nfs/dbraw/zinc/44/77/87/1082447787.db2.gz PJLCGCBBOILQMS-KKSFZXQISA-N 1 1 354.450 4.492 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC001167464447 1082593763 /nfs/dbraw/zinc/59/37/63/1082593763.db2.gz MAFZDWSPNGDUFQ-IXDOHACOSA-N 1 1 367.449 4.108 20 5 FIBDMO CC(C)n1ccc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)n1 ZINC000561492632 1082641239 /nfs/dbraw/zinc/64/12/39/1082641239.db2.gz LWEUJFLPLOQBAZ-UHFFFAOYSA-N 1 1 356.451 4.391 20 5 FIBDMO C[C@H](N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175910899 1082704388 /nfs/dbraw/zinc/70/43/88/1082704388.db2.gz GGJXWJLSDJASDK-ZWOKBUDYSA-N 1 1 353.466 4.299 20 5 FIBDMO C[C@H](N[C@H]1CC[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000175910899 1082704393 /nfs/dbraw/zinc/70/43/93/1082704393.db2.gz GGJXWJLSDJASDK-ZWOKBUDYSA-N 1 1 353.466 4.299 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@@H+](CCc3ccc(F)cc3)C3CC3)nc2c1 ZINC000610581713 1083214341 /nfs/dbraw/zinc/21/43/41/1083214341.db2.gz FIQAIQAWVWZQSL-UHFFFAOYSA-N 1 1 355.369 4.082 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCc2ccccc2[C@H]1C(C)C ZINC000610788740 1083509978 /nfs/dbraw/zinc/50/99/78/1083509978.db2.gz JVFLQCGIBOQOAP-OAQYLSRUSA-N 1 1 367.449 4.097 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCc2ccccc2[C@H]1C(C)C ZINC000610788740 1083509982 /nfs/dbraw/zinc/50/99/82/1083509982.db2.gz JVFLQCGIBOQOAP-OAQYLSRUSA-N 1 1 367.449 4.097 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCCN(Cc2ccccc2)C1 ZINC000610805873 1083717443 /nfs/dbraw/zinc/71/74/43/1083717443.db2.gz HDNZQVZRVRWYIP-UYAOXDASSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000610805873 1083717453 /nfs/dbraw/zinc/71/74/53/1083717453.db2.gz HDNZQVZRVRWYIP-UYAOXDASSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000610805873 1083717458 /nfs/dbraw/zinc/71/74/58/1083717458.db2.gz HDNZQVZRVRWYIP-UYAOXDASSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c([C@@H](C)[NH2+]C[C@H]2CCCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805893 1083717975 /nfs/dbraw/zinc/71/79/75/1083717975.db2.gz OCXGRIAPPBFCJH-UYAOXDASSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c([C@@H](C)NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805893 1083717978 /nfs/dbraw/zinc/71/79/78/1083717978.db2.gz OCXGRIAPPBFCJH-UYAOXDASSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1c([C@@H](C)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610805893 1083717988 /nfs/dbraw/zinc/71/79/88/1083717988.db2.gz OCXGRIAPPBFCJH-UYAOXDASSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC(C)=C(c2ccco2)C1 ZINC000548926919 1083771170 /nfs/dbraw/zinc/77/11/70/1083771170.db2.gz DTXRMRSEYMOGSA-UHFFFAOYSA-N 1 1 369.421 4.004 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000612578852 1083924689 /nfs/dbraw/zinc/92/46/89/1083924689.db2.gz XATIFXQHMIYBDN-TXEJJXNPSA-N 1 1 356.266 4.076 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000612578852 1083924692 /nfs/dbraw/zinc/92/46/92/1083924692.db2.gz XATIFXQHMIYBDN-TXEJJXNPSA-N 1 1 356.266 4.076 20 5 FIBDMO C[C@H](N[C@@H]1CC[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21)c1ccccc1[N+](=O)[O-] ZINC000380523405 1084044154 /nfs/dbraw/zinc/04/41/54/1084044154.db2.gz CMAKKJQSTIGNCL-XIGKFDRGSA-N 1 1 365.477 4.156 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCCC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000613025626 1084275548 /nfs/dbraw/zinc/27/55/48/1084275548.db2.gz CHAXLMJYZBYHNB-HXUWFJFHSA-N 1 1 367.449 4.459 20 5 FIBDMO Cn1ccnc1[C@H]([NH2+]CC(C)(C)c1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000579983902 1084303155 /nfs/dbraw/zinc/30/31/55/1084303155.db2.gz BJVRKQWJLAGFIR-QGZVFWFLSA-N 1 1 370.478 4.047 20 5 FIBDMO CCc1ccc(C(C)(C)[NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000180096714 1084391324 /nfs/dbraw/zinc/39/13/24/1084391324.db2.gz OEHLJTTYSHQVMI-UHFFFAOYSA-N 1 1 366.421 4.232 20 5 FIBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001167517182 1084433729 /nfs/dbraw/zinc/43/37/29/1084433729.db2.gz OJGKHQGWNZKEOR-GOSISDBHSA-N 1 1 369.465 4.103 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cc(Br)ccc1F ZINC000581558517 1084559718 /nfs/dbraw/zinc/55/97/18/1084559718.db2.gz SLCXAWDPSMTSBY-HNNXBMFYSA-N 1 1 365.202 4.274 20 5 FIBDMO CCC[C@@H](N[C@@H](C[NH+](C)C)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000551556829 1084678613 /nfs/dbraw/zinc/67/86/13/1084678613.db2.gz YATVLCNYOLFIRE-RTWAWAEBSA-N 1 1 371.481 4.337 20 5 FIBDMO Cc1cccc(C(C)C)c1NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511082794 1084693124 /nfs/dbraw/zinc/69/31/24/1084693124.db2.gz UTJJJKFQGCGUKP-UHFFFAOYSA-N 1 1 369.465 4.140 20 5 FIBDMO Cc1cccc(C(C)C)c1NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511082794 1084693130 /nfs/dbraw/zinc/69/31/30/1084693130.db2.gz UTJJJKFQGCGUKP-UHFFFAOYSA-N 1 1 369.465 4.140 20 5 FIBDMO CC(C)(CO)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1cccs1 ZINC000582574511 1084768581 /nfs/dbraw/zinc/76/85/81/1084768581.db2.gz GQMATSNYOJODKP-OAHLLOKOSA-N 1 1 354.859 4.159 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1c(Cl)ccc2cccnc21 ZINC000511106960 1084918239 /nfs/dbraw/zinc/91/82/39/1084918239.db2.gz MUFHGMYBFKTGHX-UHFFFAOYSA-N 1 1 355.825 4.471 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2ccccc2)s1 ZINC000511120593 1084987359 /nfs/dbraw/zinc/98/73/59/1084987359.db2.gz IYNGAFVAKMDPRB-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2ccccc2)s1 ZINC000511120593 1084987361 /nfs/dbraw/zinc/98/73/61/1084987361.db2.gz IYNGAFVAKMDPRB-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC=C(c4ccco4)C3)co2)cc1 ZINC000511138813 1085066608 /nfs/dbraw/zinc/06/66/08/1085066608.db2.gz GNLUTJKCZPQABB-UHFFFAOYSA-N 1 1 351.362 4.132 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CCC=C(c4ccco4)C3)co2)cc1 ZINC000511138813 1085066618 /nfs/dbraw/zinc/06/66/18/1085066618.db2.gz GNLUTJKCZPQABB-UHFFFAOYSA-N 1 1 351.362 4.132 20 5 FIBDMO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000178654956 1085679954 /nfs/dbraw/zinc/67/99/54/1085679954.db2.gz AUWHDDGCRKYSTL-YRBBNYTNSA-N 1 1 365.477 4.441 20 5 FIBDMO C[C@H](c1ccccc1)[NH+]1CCC(N[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000178656940 1085683090 /nfs/dbraw/zinc/68/30/90/1085683090.db2.gz JHGGDSXWLBDKIP-DLBZAZTESA-N 1 1 353.466 4.471 20 5 FIBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000047959731 1085752012 /nfs/dbraw/zinc/75/20/12/1085752012.db2.gz PAZBEJZCPGQDFK-CQSZACIVSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000047959731 1085752017 /nfs/dbraw/zinc/75/20/17/1085752017.db2.gz PAZBEJZCPGQDFK-CQSZACIVSA-N 1 1 352.394 4.146 20 5 FIBDMO CC[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nnc2n1CCCCC2 ZINC000278873793 1086502862 /nfs/dbraw/zinc/50/28/62/1086502862.db2.gz XHZLARAHZYNKNR-ZWKOTPCHSA-N 1 1 369.469 4.031 20 5 FIBDMO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432341340 1086633412 /nfs/dbraw/zinc/63/34/12/1086633412.db2.gz WIFNPWBIYZNRAY-IRXDYDNUSA-N 1 1 368.481 4.234 20 5 FIBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)c1ccccc1 ZINC000585754346 1086687125 /nfs/dbraw/zinc/68/71/25/1086687125.db2.gz IVOOPZFITJCMAI-UHFFFAOYSA-N 1 1 352.394 4.012 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)c1ccccc1 ZINC000585754346 1086687129 /nfs/dbraw/zinc/68/71/29/1086687129.db2.gz IVOOPZFITJCMAI-UHFFFAOYSA-N 1 1 352.394 4.012 20 5 FIBDMO CCc1ccc(C[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000728897312 1086875734 /nfs/dbraw/zinc/87/57/34/1086875734.db2.gz YDCQKGOBRBFNDF-UHFFFAOYSA-N 1 1 350.422 4.110 20 5 FIBDMO CCc1ccc(C[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cc1 ZINC000728897312 1086875744 /nfs/dbraw/zinc/87/57/44/1086875744.db2.gz YDCQKGOBRBFNDF-UHFFFAOYSA-N 1 1 350.422 4.110 20 5 FIBDMO Cc1ccc(NC(=O)N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000246128065 1086898971 /nfs/dbraw/zinc/89/89/71/1086898971.db2.gz IGZIFVXKOXZCPJ-IAGOWNOFSA-N 1 1 374.485 4.022 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000052803850 1087167866 /nfs/dbraw/zinc/16/78/66/1087167866.db2.gz SKGSGPISJUQCPA-QGZVFWFLSA-N 1 1 359.451 4.130 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)Cc1csc2ccccc12 ZINC000052805479 1087178456 /nfs/dbraw/zinc/17/84/56/1087178456.db2.gz SWDWDWKTCZMOMX-UHFFFAOYSA-N 1 1 369.446 4.188 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)Cc1csc2ccccc12 ZINC000052805479 1087178459 /nfs/dbraw/zinc/17/84/59/1087178459.db2.gz SWDWDWKTCZMOMX-UHFFFAOYSA-N 1 1 369.446 4.188 20 5 FIBDMO C[NH+](C)C[C@@H](N[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc(F)cc1 ZINC000584223784 1087223755 /nfs/dbraw/zinc/22/37/55/1087223755.db2.gz ZHRUXUTYDCRNQP-WOJBJXKFSA-N 1 1 371.456 4.349 20 5 FIBDMO Cc1ccc([C@H](C)[N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000052907284 1087230979 /nfs/dbraw/zinc/23/09/79/1087230979.db2.gz ADULLAFMSJAXMQ-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000052907284 1087230986 /nfs/dbraw/zinc/23/09/86/1087230986.db2.gz ADULLAFMSJAXMQ-ZDUSSCGKSA-N 1 1 361.829 4.188 20 5 FIBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ccccc3OC)o2)c([N+](=O)[O-])c1 ZINC000102418839 1087695386 /nfs/dbraw/zinc/69/53/86/1087695386.db2.gz JMZFPKBBPPFYLD-UHFFFAOYSA-N 1 1 368.389 4.162 20 5 FIBDMO COc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000424266802 1087892644 /nfs/dbraw/zinc/89/26/44/1087892644.db2.gz JLZRVVVGTSZXMN-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180421683 1087910087 /nfs/dbraw/zinc/91/00/87/1087910087.db2.gz PDYLLBREKGWBNY-CYBMUJFWSA-N 1 1 359.382 4.141 20 5 FIBDMO CCOc1ccc([C@@H](C)N[C@@H](CC[NH+](C)C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000504929165 1087995833 /nfs/dbraw/zinc/99/58/33/1087995833.db2.gz HBFPOYQAYCHVQN-KDOFPFPSSA-N 1 1 351.491 4.011 20 5 FIBDMO CCCCN1CCC([NH2+][C@H](CC)CSc2ccccc2[N+](=O)[O-])CC1 ZINC000504930345 1087996258 /nfs/dbraw/zinc/99/62/58/1087996258.db2.gz PJLYYLFOFAKMHH-MRXNPFEDSA-N 1 1 365.543 4.320 20 5 FIBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(Cl)cc1 ZINC000434742294 1089014187 /nfs/dbraw/zinc/01/41/87/1089014187.db2.gz AJSLYTCJQMUNGN-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccc(Cl)cc1 ZINC000434742294 1089014205 /nfs/dbraw/zinc/01/42/05/1089014205.db2.gz AJSLYTCJQMUNGN-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000435056114 1089244722 /nfs/dbraw/zinc/24/47/22/1089244722.db2.gz LQFPXQCFBUCPMO-GJZGRUSLSA-N 1 1 351.406 4.422 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425369749 1089610679 /nfs/dbraw/zinc/61/06/79/1089610679.db2.gz HUSIXFFYJMKZGG-GRFAERAESA-N 1 1 356.466 4.279 20 5 FIBDMO COc1ccccc1C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549344003 1089862727 /nfs/dbraw/zinc/86/27/27/1089862727.db2.gz RPFXMSRMTQXKKM-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO COc1ccccc1C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549344003 1089862745 /nfs/dbraw/zinc/86/27/45/1089862745.db2.gz RPFXMSRMTQXKKM-UHFFFAOYSA-N 1 1 354.328 4.254 20 5 FIBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cccs1 ZINC000104662999 1090289010 /nfs/dbraw/zinc/28/90/10/1090289010.db2.gz HURQCYXYCMKGER-UHFFFAOYSA-N 1 1 357.435 4.376 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000104680781 1090299157 /nfs/dbraw/zinc/29/91/57/1090299157.db2.gz UUPCTVZAZBRESS-UHFFFAOYSA-N 1 1 362.470 4.306 20 5 FIBDMO CCCO[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000549426531 1090343131 /nfs/dbraw/zinc/34/31/31/1090343131.db2.gz UWSGKIHAIIZYBG-OAHLLOKOSA-N 1 1 360.376 4.395 20 5 FIBDMO CCN(CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2)C1 ZINC000110267007 1090361751 /nfs/dbraw/zinc/36/17/51/1090361751.db2.gz YBBUMHJIRJZELJ-PGRDOPGGSA-N 1 1 367.493 4.295 20 5 FIBDMO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000110267007 1090361758 /nfs/dbraw/zinc/36/17/58/1090361758.db2.gz YBBUMHJIRJZELJ-PGRDOPGGSA-N 1 1 367.493 4.295 20 5 FIBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000110267007 1090361765 /nfs/dbraw/zinc/36/17/65/1090361765.db2.gz YBBUMHJIRJZELJ-PGRDOPGGSA-N 1 1 367.493 4.295 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572155 1090970589 /nfs/dbraw/zinc/97/05/89/1090970589.db2.gz ZIWWHNYUWCDCKP-UYAOXDASSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572155 1090970594 /nfs/dbraw/zinc/97/05/94/1090970594.db2.gz ZIWWHNYUWCDCKP-UYAOXDASSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572155 1090970596 /nfs/dbraw/zinc/97/05/96/1090970596.db2.gz ZIWWHNYUWCDCKP-UYAOXDASSA-N 1 1 367.493 4.466 20 5 FIBDMO C[C@H](c1ccccc1)[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000512275105 1091997758 /nfs/dbraw/zinc/99/77/58/1091997758.db2.gz DDSOEVPCNRWNRI-CQSZACIVSA-N 1 1 364.405 4.370 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000512275105 1091997764 /nfs/dbraw/zinc/99/77/64/1091997764.db2.gz DDSOEVPCNRWNRI-CQSZACIVSA-N 1 1 364.405 4.370 20 5 FIBDMO C[C@@H](c1ccccc1)[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000512275104 1091998174 /nfs/dbraw/zinc/99/81/74/1091998174.db2.gz DDSOEVPCNRWNRI-AWEZNQCLSA-N 1 1 364.405 4.370 20 5 FIBDMO C[C@@H](c1ccccc1)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000512275104 1091998177 /nfs/dbraw/zinc/99/81/77/1091998177.db2.gz DDSOEVPCNRWNRI-AWEZNQCLSA-N 1 1 364.405 4.370 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000512290791 1092012443 /nfs/dbraw/zinc/01/24/43/1092012443.db2.gz AXKLRTJPKLTETH-MRXNPFEDSA-N 1 1 367.449 4.457 20 5 FIBDMO C[C@@H]1C[C@]1([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(Cl)cc1 ZINC000500463127 1092104222 /nfs/dbraw/zinc/10/42/22/1092104222.db2.gz NWTCPZXFBUMPBK-CWTRNNRKSA-N 1 1 374.824 4.140 20 5 FIBDMO Cc1c([C@H](C)[NH2+]Cc2c(F)cccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000090177319 1092117789 /nfs/dbraw/zinc/11/77/89/1092117789.db2.gz NUMPTOYDTGCIAH-NSHDSACASA-N 1 1 354.328 4.495 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000500749503 1092497423 /nfs/dbraw/zinc/49/74/23/1092497423.db2.gz RTFTYKVUDWGKOH-OAHLLOKOSA-N 1 1 353.422 4.079 20 5 FIBDMO CCOc1ccc(C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C(C)C)cc1 ZINC000521195790 1092573769 /nfs/dbraw/zinc/57/37/69/1092573769.db2.gz UDYYVXMAWINAPL-UHFFFAOYSA-N 1 1 358.438 4.413 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]C[C@@H](O)CC(C)(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544355275 1093180259 /nfs/dbraw/zinc/18/02/59/1093180259.db2.gz MGYREZWSKIYAHY-LPHOPBHVSA-N 1 1 360.454 4.226 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000433072865 1093198663 /nfs/dbraw/zinc/19/86/63/1093198663.db2.gz DJMMHZDMVQVZOM-GOSISDBHSA-N 1 1 367.449 4.111 20 5 FIBDMO Cc1cccc2nc(C[NH2+][C@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)cn21 ZINC000433124442 1093307701 /nfs/dbraw/zinc/30/77/01/1093307701.db2.gz CKMDHMUJBNDLTI-SFHVURJKSA-N 1 1 350.422 4.063 20 5 FIBDMO C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000398194586 1093824596 /nfs/dbraw/zinc/82/45/96/1093824596.db2.gz NMPZRXNXJTUUJK-XGHQBKJUSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H]([NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000398194586 1093824601 /nfs/dbraw/zinc/82/46/01/1093824601.db2.gz NMPZRXNXJTUUJK-XGHQBKJUSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000398194586 1093824606 /nfs/dbraw/zinc/82/46/06/1093824606.db2.gz NMPZRXNXJTUUJK-XGHQBKJUSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@H](N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000398194586 1093824609 /nfs/dbraw/zinc/82/46/09/1093824609.db2.gz NMPZRXNXJTUUJK-XGHQBKJUSA-N 1 1 353.466 4.156 20 5 FIBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](c3nc4ccccc4o3)C2)cc1 ZINC000052611829 1093837215 /nfs/dbraw/zinc/83/72/15/1093837215.db2.gz FTDYMOSEIYEGKB-MRXNPFEDSA-N 1 1 351.406 4.158 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000513272322 1094043053 /nfs/dbraw/zinc/04/30/53/1094043053.db2.gz QNAGCWYQFRODRF-HNAYVOBHSA-N 1 1 353.422 4.007 20 5 FIBDMO CC[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(C)cc1 ZINC000182535279 1094131420 /nfs/dbraw/zinc/13/14/20/1094131420.db2.gz CZIAKZJNADAFCP-QGZVFWFLSA-N 1 1 352.394 4.194 20 5 FIBDMO 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Cc1ccc(-c2n[nH]cc2C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000507169534 1103189956 /nfs/dbraw/zinc/18/99/56/1103189956.db2.gz WGXHCVLHMPIHSO-UHFFFAOYSA-N 1 1 362.433 4.458 20 5 FIBDMO Cc1ccc(-c2n[nH]cc2C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000507169534 1103189963 /nfs/dbraw/zinc/18/99/63/1103189963.db2.gz WGXHCVLHMPIHSO-UHFFFAOYSA-N 1 1 362.433 4.458 20 5 FIBDMO Cc1ccc(C(C)C)c(Oc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2[N+](=O)[O-])c1 ZINC000507461920 1103407926 /nfs/dbraw/zinc/40/79/26/1103407926.db2.gz WAOZVVNCHGJNOA-KRWDZBQOSA-N 1 1 370.449 4.386 20 5 FIBDMO Cc1ccc(C(C)C)c(Oc2ccc(C[N@H+]3CC[C@H](O)C3)cc2[N+](=O)[O-])c1 ZINC000507461920 1103407943 /nfs/dbraw/zinc/40/79/43/1103407943.db2.gz WAOZVVNCHGJNOA-KRWDZBQOSA-N 1 1 370.449 4.386 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC000507616146 1103551249 /nfs/dbraw/zinc/55/12/49/1103551249.db2.gz JWGWSDIWKIYAMX-UHFFFAOYSA-N 1 1 350.422 4.050 20 5 FIBDMO CC[C@@H](C)[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000507675855 1103606372 /nfs/dbraw/zinc/60/63/72/1103606372.db2.gz BKRSTQIIJNWNIG-MRXNPFEDSA-N 1 1 355.438 4.142 20 5 FIBDMO CC(C)C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000519904618 1103948072 /nfs/dbraw/zinc/94/80/72/1103948072.db2.gz UMAWQLYOGBMVSO-UHFFFAOYSA-N 1 1 366.421 4.303 20 5 FIBDMO COc1ccc(OCC[N@H+]2C[C@@H](C)C[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000441338166 1104282356 /nfs/dbraw/zinc/28/23/56/1104282356.db2.gz SHXVDYDTCUTSQQ-KSSFIOAISA-N 1 1 374.412 4.204 20 5 FIBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 ZINC000441403298 1104344719 /nfs/dbraw/zinc/34/47/19/1104344719.db2.gz KQHVLVCEUIXTMV-GOEBONIOSA-N 1 1 356.397 4.390 20 5 FIBDMO Cc1ccc(C)c([C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)[C@@H](C)CO2)c1 ZINC000441448600 1104740629 /nfs/dbraw/zinc/74/06/29/1104740629.db2.gz LEQZFFCOXSUFMX-UWJYYQICSA-N 1 1 354.450 4.216 20 5 FIBDMO COc1cc(C[N@@H+](CC2CC2)C2CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000475671823 1107216372 /nfs/dbraw/zinc/21/63/72/1107216372.db2.gz MLIOELUUCGMUSE-UHFFFAOYSA-N 1 1 370.396 4.012 20 5 FIBDMO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000452084534 1107460986 /nfs/dbraw/zinc/46/09/86/1107460986.db2.gz LCVRRECKRZLTGL-KBPBESRZSA-N 1 1 352.394 4.365 20 5 FIBDMO COC[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccc(F)cc1 ZINC000531206904 1107648618 /nfs/dbraw/zinc/64/86/18/1107648618.db2.gz QCHIIVVOUYCEFR-GOSISDBHSA-N 1 1 370.380 4.471 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](C)C1 ZINC000520204187 1108020503 /nfs/dbraw/zinc/02/05/03/1108020503.db2.gz UCXJLOWSNZYXMP-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC[C@@H](C)C1 ZINC000520204187 1108020516 /nfs/dbraw/zinc/02/05/16/1108020516.db2.gz UCXJLOWSNZYXMP-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO CC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1nnc2n1CCCCC2 ZINC000531707976 1108087053 /nfs/dbraw/zinc/08/70/53/1108087053.db2.gz SFLOPTKGLSMSHR-PBHICJAKSA-N 1 1 357.458 4.023 20 5 FIBDMO Cc1cc(C)cc(C[N@@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000444692934 1108095142 /nfs/dbraw/zinc/09/51/42/1108095142.db2.gz GABDWRDSJBKPDH-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1cc(C)cc(C[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000444692934 1108095157 /nfs/dbraw/zinc/09/51/57/1108095157.db2.gz GABDWRDSJBKPDH-OAHLLOKOSA-N 1 1 366.421 4.455 20 5 FIBDMO CC[C@H]1CCCCC[N@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000523554261 1108318685 /nfs/dbraw/zinc/31/86/85/1108318685.db2.gz IFDQCWAKWSZNQQ-ZDUSSCGKSA-N 1 1 358.385 4.359 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCC[N@@H+]1CCc2ccccc2C1 ZINC000531945371 1108422659 /nfs/dbraw/zinc/42/26/59/1108422659.db2.gz LPZFVNKRRYZWMR-QGZVFWFLSA-N 1 1 353.466 4.002 20 5 FIBDMO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H](O)C(F)(F)F ZINC000428424271 1109059298 /nfs/dbraw/zinc/05/92/98/1109059298.db2.gz XCLVQWIISMYCMP-OAHLLOKOSA-N 1 1 374.384 4.068 20 5 FIBDMO CCCCCOc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000446841281 1109360883 /nfs/dbraw/zinc/36/08/83/1109360883.db2.gz NTTGLWUMKRLPGI-UHFFFAOYSA-N 1 1 368.437 4.330 20 5 FIBDMO COc1ccc(OCC[N@@H+](C)[C@H](C)c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000441216437 1109469044 /nfs/dbraw/zinc/46/90/44/1109469044.db2.gz JAKCHHYXNYEMLA-CYBMUJFWSA-N 1 1 364.829 4.329 20 5 FIBDMO CCC[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nnc2ccccn21 ZINC000447542141 1109574022 /nfs/dbraw/zinc/57/40/22/1109574022.db2.gz IBWINPCFZCWNDU-ROUUACIJSA-N 1 1 365.437 4.146 20 5 FIBDMO CCC[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1nnc2ccccn21 ZINC000447542145 1109574109 /nfs/dbraw/zinc/57/41/09/1109574109.db2.gz IBWINPCFZCWNDU-ZWKOTPCHSA-N 1 1 365.437 4.146 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000527270834 1109729019 /nfs/dbraw/zinc/72/90/19/1109729019.db2.gz LKSJGEIYVKIAAD-GFCCVEGCSA-N 1 1 361.829 4.052 20 5 FIBDMO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449563778 1110111377 /nfs/dbraw/zinc/11/13/77/1110111377.db2.gz YIXHNORMHQJBDN-ZDUSSCGKSA-N 1 1 356.451 4.391 20 5 FIBDMO Cn1cccc1C[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538720614 1111260938 /nfs/dbraw/zinc/26/09/38/1111260938.db2.gz JSGCZNJUAFBFAG-UHFFFAOYSA-N 1 1 359.813 4.479 20 5 FIBDMO Cn1cccc1C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538720614 1111260943 /nfs/dbraw/zinc/26/09/43/1111260943.db2.gz JSGCZNJUAFBFAG-UHFFFAOYSA-N 1 1 359.813 4.479 20 5 FIBDMO COC[C@@H]1CCC[N@@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000538729768 1111267052 /nfs/dbraw/zinc/26/70/52/1111267052.db2.gz SUJHRZMEIXQNBW-GOSISDBHSA-N 1 1 369.465 4.221 20 5 FIBDMO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538726310 1111276396 /nfs/dbraw/zinc/27/63/96/1111276396.db2.gz JVAMTAUTECJELC-NEPJUHHUSA-N 1 1 350.802 4.117 20 5 FIBDMO C[C@@H]1[C@H](C)OCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538726310 1111276398 /nfs/dbraw/zinc/27/63/98/1111276398.db2.gz JVAMTAUTECJELC-NEPJUHHUSA-N 1 1 350.802 4.117 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](C4CCOCC4)C3)o2)cc1 ZINC000538752960 1111283400 /nfs/dbraw/zinc/28/34/00/1111283400.db2.gz YUSCTGQFMQHHKC-QGZVFWFLSA-N 1 1 356.422 4.103 20 5 FIBDMO CCOc1cc(Nc2cccc([C@H](C)[NH+]3CCOCC3)c2)ccc1[N+](=O)[O-] ZINC000538937381 1111351026 /nfs/dbraw/zinc/35/10/26/1111351026.db2.gz UNOWHNBWEQICNK-HNNXBMFYSA-N 1 1 371.437 4.130 20 5 FIBDMO C[C@@H]1CCC[C@H](CC[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552042454 1111555193 /nfs/dbraw/zinc/55/51/93/1111555193.db2.gz GONRTSQOSRRXNL-GPMSIDNRSA-N 1 1 356.470 4.224 20 5 FIBDMO Cn1ccnc1[C@H]([NH2+]CCCC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000552253656 1111645492 /nfs/dbraw/zinc/64/54/92/1111645492.db2.gz NKOQCLMTTZUGBK-LJQANCHMSA-N 1 1 356.470 4.368 20 5 FIBDMO COc1cc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(F)cn1 ZINC000554094677 1112191243 /nfs/dbraw/zinc/19/12/43/1112191243.db2.gz JMBKUUITQKOXPY-SECBINFHSA-N 1 1 373.306 4.007 20 5 FIBDMO Cc1c(C[NH2+]Cc2c(Cl)cccc2N2CCCC2)cccc1[N+](=O)[O-] ZINC000480483216 1112441695 /nfs/dbraw/zinc/44/16/95/1112441695.db2.gz UQPYDQNBJCGZMR-UHFFFAOYSA-N 1 1 359.857 4.447 20 5 FIBDMO CCC(=O)c1ccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000480495406 1112447496 /nfs/dbraw/zinc/44/74/96/1112447496.db2.gz IEJIVJLOBLHKOM-QGZVFWFLSA-N 1 1 367.449 4.122 20 5 FIBDMO CC[C@H]([NH2+]Cc1nc2cccc(Cl)c2n1C)c1cccc([N+](=O)[O-])c1 ZINC000480693461 1112549093 /nfs/dbraw/zinc/54/90/93/1112549093.db2.gz IKSJOEDHYIGELQ-HNNXBMFYSA-N 1 1 358.829 4.376 20 5 FIBDMO C[C@H](NC[C@H](C1CC1)[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481304158 1112877550 /nfs/dbraw/zinc/87/75/50/1112877550.db2.gz DAFXQVZQUYZJQA-SUMWQHHRSA-N 1 1 359.495 4.314 20 5 FIBDMO C[C@@H](NC[C@@H](C1CC1)[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481304152 1112877568 /nfs/dbraw/zinc/87/75/68/1112877568.db2.gz DAFXQVZQUYZJQA-DYVFJYSZSA-N 1 1 359.495 4.314 20 5 FIBDMO CC1(C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]2CCC[C@H]21 ZINC000555721353 1112978609 /nfs/dbraw/zinc/97/86/09/1112978609.db2.gz LNMNNRVKNBLXBB-SJORKVTESA-N 1 1 355.438 4.303 20 5 FIBDMO Cc1cc(C)cc(C[N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000556045008 1113123851 /nfs/dbraw/zinc/12/38/51/1113123851.db2.gz KGMWBHUGEIZANP-UHFFFAOYSA-N 1 1 364.449 4.244 20 5 FIBDMO COc1cc(C[N@H+]2CCCCC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000490545427 1114299009 /nfs/dbraw/zinc/29/90/09/1114299009.db2.gz MKRATCQWBPYJJM-GFCCVEGCSA-N 1 1 358.385 4.012 20 5 FIBDMO CC(C)[N@H+]1CCC[C@@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000491035724 1114364242 /nfs/dbraw/zinc/36/42/42/1114364242.db2.gz JZWOKVIHYALPEA-AVRDEDQJSA-N 1 1 367.493 4.394 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H]2C2CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000491089490 1114372148 /nfs/dbraw/zinc/37/21/48/1114372148.db2.gz GBNRCWMPEIVJLJ-AWEZNQCLSA-N 1 1 370.396 4.012 20 5 FIBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)C1 ZINC000054794173 1114389638 /nfs/dbraw/zinc/38/96/38/1114389638.db2.gz LUFQKLIJWIXFIS-CQSZACIVSA-N 1 1 371.412 4.218 20 5 FIBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1 ZINC000055460369 1114474918 /nfs/dbraw/zinc/47/49/18/1114474918.db2.gz ZHVHXOJKQCNZCQ-AWEZNQCLSA-N 1 1 371.412 4.361 20 5 FIBDMO Cn1c2ccc(Nc3ncnc4sc([N+](=O)[O-])cc43)cc2[nH+]c1C1CC1 ZINC000588008500 1114509958 /nfs/dbraw/zinc/50/99/58/1114509958.db2.gz MFUXYMBBLWTJGZ-UHFFFAOYSA-N 1 1 366.406 4.107 20 5 FIBDMO C[C@@H](CF)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000588930933 1114676938 /nfs/dbraw/zinc/67/69/38/1114676938.db2.gz ZSQYLQFHRVBUOZ-VIFPVBQESA-N 1 1 357.179 4.065 20 5 FIBDMO Cn1cc[nH+]c1C[C@@H](Nc1ccnc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000590082785 1114887969 /nfs/dbraw/zinc/88/79/69/1114887969.db2.gz NPZNLMPADDPSCH-GOSISDBHSA-N 1 1 373.416 4.272 20 5 FIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)c1cccc(OC)c1 ZINC000045806163 1115087418 /nfs/dbraw/zinc/08/74/18/1115087418.db2.gz DUFQUYNANZDSSP-AWEZNQCLSA-N 1 1 372.421 4.053 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)c1cccc(OC)c1 ZINC000045806163 1115087419 /nfs/dbraw/zinc/08/74/19/1115087419.db2.gz DUFQUYNANZDSSP-AWEZNQCLSA-N 1 1 372.421 4.053 20 5 FIBDMO CCc1noc(C)c1C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000573342394 1115092625 /nfs/dbraw/zinc/09/26/25/1115092625.db2.gz KVELJBSTSCMLGR-UHFFFAOYSA-N 1 1 371.393 4.012 20 5 FIBDMO CC[N@H+](CCC(F)(F)F)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000591842790 1115153341 /nfs/dbraw/zinc/15/33/41/1115153341.db2.gz ATBLUGPAHYAMFY-UHFFFAOYSA-N 1 1 355.154 4.132 20 5 FIBDMO CC[N@@H+](CCC(F)(F)F)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000591842790 1115153342 /nfs/dbraw/zinc/15/33/42/1115153342.db2.gz ATBLUGPAHYAMFY-UHFFFAOYSA-N 1 1 355.154 4.132 20 5 FIBDMO CC1(C)CCC[C@@H]1[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000592153476 1115216106 /nfs/dbraw/zinc/21/61/06/1115216106.db2.gz DLFIUUOOFVGEJJ-NVXWUHKLSA-N 1 1 370.453 4.293 20 5 FIBDMO CC[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1csc(C)c1 ZINC000592186224 1115219652 /nfs/dbraw/zinc/21/96/52/1115219652.db2.gz AYEAKYFFFWMWSU-OAHLLOKOSA-N 1 1 358.423 4.256 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC001168404593 1115435180 /nfs/dbraw/zinc/43/51/80/1115435180.db2.gz SUOHCYMFPYJIHW-KCPJHIHWSA-N 1 1 353.260 4.368 20 5 FIBDMO COc1cc(F)c([C@@H](C)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cc1OC ZINC000574703003 1115440624 /nfs/dbraw/zinc/44/06/24/1115440624.db2.gz KFWQZOFYYZMOAX-BZNIZROVSA-N 1 1 360.385 4.089 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1 ZINC000595011241 1115503533 /nfs/dbraw/zinc/50/35/33/1115503533.db2.gz CPUOKVPAXLBDSD-DCPHZVHLSA-N 1 1 356.422 4.174 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccccc1Br ZINC000595016959 1115504013 /nfs/dbraw/zinc/50/40/13/1115504013.db2.gz SNXBYGOWNHXUCR-NSHDSACASA-N 1 1 365.227 4.217 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccccc1Br ZINC000595016958 1115504247 /nfs/dbraw/zinc/50/42/47/1115504247.db2.gz SNXBYGOWNHXUCR-LLVKDONJSA-N 1 1 365.227 4.217 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccccc1OC(F)(F)F ZINC000595004815 1115507084 /nfs/dbraw/zinc/50/70/84/1115507084.db2.gz UCZVSULEBAKYDF-NSHDSACASA-N 1 1 370.327 4.353 20 5 FIBDMO CC[NH+](CC)Cc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595003818 1115507314 /nfs/dbraw/zinc/50/73/14/1115507314.db2.gz KYJRXOKMRHHIHR-INIZCTEOSA-N 1 1 371.481 4.296 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC000595037866 1115511133 /nfs/dbraw/zinc/51/11/33/1115511133.db2.gz IZOAMBGDPOUCBV-JTQLQIEISA-N 1 1 370.327 4.195 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c1 ZINC000595502769 1115539044 /nfs/dbraw/zinc/53/90/44/1115539044.db2.gz NKGBQBCGHZVZBE-CYBMUJFWSA-N 1 1 365.355 4.388 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H](c3ccccn3)C2)c1 ZINC000595502769 1115539047 /nfs/dbraw/zinc/53/90/47/1115539047.db2.gz NKGBQBCGHZVZBE-CYBMUJFWSA-N 1 1 365.355 4.388 20 5 FIBDMO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593021323 1115539443 /nfs/dbraw/zinc/53/94/43/1115539443.db2.gz VGIVUWUUZYDUOO-QGZVFWFLSA-N 1 1 372.421 4.021 20 5 FIBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC([C@@H]3CCCCO3)CC2)c1 ZINC000595783402 1115563514 /nfs/dbraw/zinc/56/35/14/1115563514.db2.gz NZGDNGNCYHYBCA-KRWDZBQOSA-N 1 1 372.387 4.395 20 5 FIBDMO Cc1c(C[NH2+][C@@H](CO)c2cccc(Cl)c2Cl)cccc1[N+](=O)[O-] ZINC000595828861 1115565528 /nfs/dbraw/zinc/56/55/28/1115565528.db2.gz MCBZLUNBXGQKRO-AWEZNQCLSA-N 1 1 355.221 4.033 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCc3ccccc3-n3ccnc31)CCC2 ZINC000596093996 1115574229 /nfs/dbraw/zinc/57/42/29/1115574229.db2.gz FYHJPQVNZHFUKB-VQTJNVASSA-N 1 1 374.444 4.435 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCc3ccccc3-n3ccnc31)CCC2 ZINC000596093995 1115574345 /nfs/dbraw/zinc/57/43/45/1115574345.db2.gz FYHJPQVNZHFUKB-UXHICEINSA-N 1 1 374.444 4.435 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000597218258 1115648772 /nfs/dbraw/zinc/64/87/72/1115648772.db2.gz OHXFQNRJFDDQQS-NAASZUNDSA-N 1 1 354.406 4.055 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC2(CCOCC2)[C@@H]1c1ccco1 ZINC000597218258 1115648773 /nfs/dbraw/zinc/64/87/73/1115648773.db2.gz OHXFQNRJFDDQQS-NAASZUNDSA-N 1 1 354.406 4.055 20 5 FIBDMO CCOc1cc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(F)cc1OC ZINC000598981161 1115775647 /nfs/dbraw/zinc/77/56/47/1115775647.db2.gz STVSAYPTIHDTAM-UHFFFAOYSA-N 1 1 362.401 4.166 20 5 FIBDMO Cc1c(C[NH2+][C@H](C)c2cc(-c3ccccc3)n(C)n2)cccc1[N+](=O)[O-] ZINC000599043864 1115779977 /nfs/dbraw/zinc/77/99/77/1115779977.db2.gz NCJSJIRZBGTELJ-OAHLLOKOSA-N 1 1 350.422 4.155 20 5 FIBDMO CCC(F)(F)C(C)(C)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000599082561 1115787954 /nfs/dbraw/zinc/78/79/54/1115787954.db2.gz ZNZVXBOMAAQQOH-HNNXBMFYSA-N 1 1 366.412 4.079 20 5 FIBDMO CCC(F)(F)C(C)(C)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000599080617 1115788194 /nfs/dbraw/zinc/78/81/94/1115788194.db2.gz PMOLFGUVOUNQND-OAHLLOKOSA-N 1 1 366.412 4.079 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+][C@H](Cc2ccccc2)c2nccn2C)cc1[N+](=O)[O-] ZINC000593718363 1115802387 /nfs/dbraw/zinc/80/23/87/1115802387.db2.gz HLIDLIRFDZIMNU-VQIMIIECSA-N 1 1 364.449 4.271 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]2CCCC[C@H]12 ZINC000603846835 1115820648 /nfs/dbraw/zinc/82/06/48/1115820648.db2.gz CXDPQLUKNNYLJA-KBRIMQKVSA-N 1 1 356.426 4.045 20 5 FIBDMO Cc1cccc([C@@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C(C)C)c1 ZINC000599628636 1115832290 /nfs/dbraw/zinc/83/22/90/1115832290.db2.gz CFVMSSRXQXVLRB-IBGZPJMESA-N 1 1 366.421 4.440 20 5 FIBDMO Cc1c(C[NH+]2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000604276802 1115861565 /nfs/dbraw/zinc/86/15/65/1115861565.db2.gz UVDMOIGQLMMIJS-RYUDHWBXSA-N 1 1 370.293 4.466 20 5 FIBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172903576 1116002615 /nfs/dbraw/zinc/00/26/15/1116002615.db2.gz MKHIOSWPECHRCB-FQEVSTJZSA-N 1 1 365.437 4.140 20 5 FIBDMO O=[N+]([O-])c1sccc1N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000063257333 1116029909 /nfs/dbraw/zinc/02/99/09/1116029909.db2.gz GVOSWTWIKYWODN-UHFFFAOYSA-N 1 1 351.859 4.022 20 5 FIBDMO O=[N+]([O-])c1sccc1N1CCC[N@@H+](Cc2ccc(Cl)cc2)CC1 ZINC000063257333 1116029910 /nfs/dbraw/zinc/02/99/10/1116029910.db2.gz GVOSWTWIKYWODN-UHFFFAOYSA-N 1 1 351.859 4.022 20 5 FIBDMO O=[N+]([O-])c1sccc1NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000063263244 1116030187 /nfs/dbraw/zinc/03/01/87/1116030187.db2.gz JUQPXCFHFYNUOO-UHFFFAOYSA-N 1 1 353.394 4.011 20 5 FIBDMO CC(C)[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCC1 ZINC000608835646 1116130953 /nfs/dbraw/zinc/13/09/53/1116130953.db2.gz GJPILWHAXRJSLV-LJQANCHMSA-N 1 1 357.454 4.065 20 5 FIBDMO C[N@H+](Cc1ccccc1)CC1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000608973211 1116138912 /nfs/dbraw/zinc/13/89/12/1116138912.db2.gz HOJYWXFLLZOWGE-UHFFFAOYSA-N 1 1 357.429 4.082 20 5 FIBDMO Cc1ccc(C[NH2+][C@@H](C)c2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-] ZINC000609006349 1116140215 /nfs/dbraw/zinc/14/02/15/1116140215.db2.gz BCDWDTSYNFPGBE-LBPRGKRZSA-N 1 1 360.364 4.499 20 5 FIBDMO Cc1ccc2[nH]c([C@@H]3CCC[N@@H+](CCc4ccc([N+](=O)[O-])cc4)C3)nc2c1 ZINC000534952030 1116255543 /nfs/dbraw/zinc/25/55/43/1116255543.db2.gz SHCMFTSSVDOAJB-QGZVFWFLSA-N 1 1 364.449 4.202 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@H+](CCc4ccc([N+](=O)[O-])cc4)C3)[nH]c2c1 ZINC000534952030 1116255544 /nfs/dbraw/zinc/25/55/44/1116255544.db2.gz SHCMFTSSVDOAJB-QGZVFWFLSA-N 1 1 364.449 4.202 20 5 FIBDMO Cc1ccc2nc([C@@H]3CCC[N@@H+](CCc4ccc([N+](=O)[O-])cc4)C3)[nH]c2c1 ZINC000534952030 1116255545 /nfs/dbraw/zinc/25/55/45/1116255545.db2.gz SHCMFTSSVDOAJB-QGZVFWFLSA-N 1 1 364.449 4.202 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCC2CCCC2)CC1 ZINC000539862393 1116392164 /nfs/dbraw/zinc/39/21/64/1116392164.db2.gz IRXFQVSWULYZDJ-UHFFFAOYSA-N 1 1 362.470 4.165 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000539884935 1116396781 /nfs/dbraw/zinc/39/67/81/1116396781.db2.gz BWICYNGBBQITLB-MRXNPFEDSA-N 1 1 370.840 4.263 20 5 FIBDMO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000463189547 1118006617 /nfs/dbraw/zinc/00/66/17/1118006617.db2.gz ATIASSCSAWWBQR-YGRLIQCLSA-N 1 1 368.424 4.025 20 5 FIBDMO Cc1cc(C)c(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)c1 ZINC000540476041 1118077291 /nfs/dbraw/zinc/07/72/91/1118077291.db2.gz PURLHJDMDVRAQJ-HOTGVXAUSA-N 1 1 355.438 4.198 20 5 FIBDMO Cc1noc(C[NH2+][C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000595419851 1118228185 /nfs/dbraw/zinc/22/81/85/1118228185.db2.gz MARLESOQHWCNCA-CQSZACIVSA-N 1 1 357.332 4.397 20 5 FIBDMO Cc1nnc(C[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)s1 ZINC000540953446 1118328853 /nfs/dbraw/zinc/32/88/53/1118328853.db2.gz SQQKCDOWBWAVGM-SNVBAGLBSA-N 1 1 360.464 4.334 20 5 FIBDMO Cc1nnc(C[NH2+][C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)s1 ZINC000540953443 1118329242 /nfs/dbraw/zinc/32/92/42/1118329242.db2.gz SQQKCDOWBWAVGM-JTQLQIEISA-N 1 1 360.464 4.334 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000541773008 1118645233 /nfs/dbraw/zinc/64/52/33/1118645233.db2.gz NHNMKYRMYNBZBQ-GOSISDBHSA-N 1 1 354.406 4.012 20 5 FIBDMO CC(C)([NH2+]Cc1cc(O)cc(C(F)(F)F)c1)c1ccccc1[N+](=O)[O-] ZINC000492004115 1119002270 /nfs/dbraw/zinc/00/22/70/1119002270.db2.gz WJGYJQGTKSDQKY-UHFFFAOYSA-N 1 1 354.328 4.344 20 5 FIBDMO CC(C)([NH2+]Cc1cnc(-c2ccccn2)s1)c1ccccc1[N+](=O)[O-] ZINC000492194092 1119043172 /nfs/dbraw/zinc/04/31/72/1119043172.db2.gz QMZTVFUMFYIYMO-UHFFFAOYSA-N 1 1 354.435 4.138 20 5 FIBDMO CCOc1cc(C[NH2+]C2(c3nc(C)cs3)CCCC2)ccc1[N+](=O)[O-] ZINC000492726035 1119173103 /nfs/dbraw/zinc/17/31/03/1119173103.db2.gz YSAHPKDTIDGTIB-UHFFFAOYSA-N 1 1 361.467 4.318 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000492771370 1119189808 /nfs/dbraw/zinc/18/98/08/1119189808.db2.gz MCGFLPLYVNMHMC-IPELMVKDSA-N 1 1 362.470 4.019 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]CCc2cscn2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542475811 1119600426 /nfs/dbraw/zinc/60/04/26/1119600426.db2.gz KBMUDDLFUAFVSZ-SFHVURJKSA-N 1 1 357.435 4.128 20 5 FIBDMO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccc(F)cn1 ZINC000494516612 1119885015 /nfs/dbraw/zinc/88/50/15/1119885015.db2.gz VJCZPIBSJXQWHT-AWEZNQCLSA-N 1 1 357.307 4.389 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000494651439 1120006674 /nfs/dbraw/zinc/00/66/74/1120006674.db2.gz QQMTWYSUBWVZSR-LJQANCHMSA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000494651439 1120006678 /nfs/dbraw/zinc/00/66/78/1120006678.db2.gz QQMTWYSUBWVZSR-LJQANCHMSA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000494651438 1120007034 /nfs/dbraw/zinc/00/70/34/1120007034.db2.gz QQMTWYSUBWVZSR-IBGZPJMESA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000494651438 1120007037 /nfs/dbraw/zinc/00/70/37/1120007037.db2.gz QQMTWYSUBWVZSR-IBGZPJMESA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccc3c(c2)OCO3)C2CCCC2)c1 ZINC000027235935 1120863966 /nfs/dbraw/zinc/86/39/66/1120863966.db2.gz PQZNQBMJLZIXIO-UHFFFAOYSA-N 1 1 354.406 4.268 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)c(F)c1 ZINC000915212246 1120869879 /nfs/dbraw/zinc/86/98/79/1120869879.db2.gz JRORACIPZHZRDM-UHFFFAOYSA-N 1 1 363.820 4.100 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CCC[N@@H+](Cc3ccc(Cl)cc3)CC2)c(F)c1 ZINC000915212246 1120869888 /nfs/dbraw/zinc/86/98/88/1120869888.db2.gz JRORACIPZHZRDM-UHFFFAOYSA-N 1 1 363.820 4.100 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2cccc3c2OCCCO3)cc1[N+](=O)[O-] ZINC000090546661 1120954165 /nfs/dbraw/zinc/95/41/65/1120954165.db2.gz TZQQRELIPSNYBR-AWEZNQCLSA-N 1 1 372.421 4.006 20 5 FIBDMO CCOc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000090585819 1121015477 /nfs/dbraw/zinc/01/54/77/1121015477.db2.gz HDBIYJWYJMLIRX-DLBZAZTESA-N 1 1 363.502 4.012 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccnc1OC1CCCC1 ZINC000153887020 1121431658 /nfs/dbraw/zinc/43/16/58/1121431658.db2.gz PUKVCQVQLJLEMP-OAHLLOKOSA-N 1 1 355.438 4.470 20 5 FIBDMO CC(=O)c1ccc(N[C@@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301542070 1122218250 /nfs/dbraw/zinc/21/82/50/1122218250.db2.gz NTIJRJMAFFYNPZ-DNVCBOLYSA-N 1 1 367.449 4.262 20 5 FIBDMO COc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C[C@@H]2CCCO2)c1 ZINC000542702431 1122302689 /nfs/dbraw/zinc/30/26/89/1122302689.db2.gz WLROQECPARYDJY-NRFANRHFSA-N 1 1 370.449 4.093 20 5 FIBDMO CC[C@H](C)[N@H+](Cc1ccccc1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000917455592 1122320458 /nfs/dbraw/zinc/32/04/58/1122320458.db2.gz YTHHUFJUVPJRPQ-INIZCTEOSA-N 1 1 365.437 4.112 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(OC)c1OC ZINC000194999329 1123067182 /nfs/dbraw/zinc/06/71/82/1123067182.db2.gz CWEBOIRKFSHJOS-UHFFFAOYSA-N 1 1 374.437 4.031 20 5 FIBDMO CC[C@H](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133721 1123160329 /nfs/dbraw/zinc/16/03/29/1123160329.db2.gz UTMQWPPVFSNRLV-RXVVDRJESA-N 1 1 353.466 4.158 20 5 FIBDMO CC[C@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133721 1123160339 /nfs/dbraw/zinc/16/03/39/1123160339.db2.gz UTMQWPPVFSNRLV-RXVVDRJESA-N 1 1 353.466 4.158 20 5 FIBDMO CC[C@H]([NH2+]C[C@@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133721 1123160343 /nfs/dbraw/zinc/16/03/43/1123160343.db2.gz UTMQWPPVFSNRLV-RXVVDRJESA-N 1 1 353.466 4.158 20 5 FIBDMO COCCc1cc[nH+]c(N[C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000556914327 1123223271 /nfs/dbraw/zinc/22/32/71/1123223271.db2.gz ZRQDYBNYWASXAV-FUHWJXTLSA-N 1 1 355.438 4.002 20 5 FIBDMO COCCc1cc[nH+]c(N[C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000556914328 1123223393 /nfs/dbraw/zinc/22/33/93/1123223393.db2.gz ZRQDYBNYWASXAV-SJLPKXTDSA-N 1 1 355.438 4.002 20 5 FIBDMO Cc1ccnc(NCc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)c1[N+](=O)[O-] ZINC000609669651 1123789629 /nfs/dbraw/zinc/78/96/29/1123789629.db2.gz QKGLXJYYLPPNJN-INIZCTEOSA-N 1 1 354.454 4.285 20 5 FIBDMO CC(=O)c1ccc(NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000064550899 1123842651 /nfs/dbraw/zinc/84/26/51/1123842651.db2.gz RZOWSJCCXVWXNM-OAHLLOKOSA-N 1 1 373.478 4.183 20 5 FIBDMO Cn1cc[nH+]c1C[C@@H](Nc1nc2ccccc2cc1[N+](=O)[O-])c1ccccc1 ZINC000616060030 1124214774 /nfs/dbraw/zinc/21/47/74/1124214774.db2.gz OYRRSXHFCGAKDA-GOSISDBHSA-N 1 1 373.416 4.272 20 5 FIBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542853566 1124466861 /nfs/dbraw/zinc/46/68/61/1124466861.db2.gz GCMNJFTXCYWSCT-QRWLVFNGSA-N 1 1 354.454 4.007 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC34CCOCC4)o2)c(Cl)c1 ZINC000618614639 1125222805 /nfs/dbraw/zinc/22/28/05/1125222805.db2.gz GVEIDKPOJXNJRN-UHFFFAOYSA-N 1 1 362.813 4.263 20 5 FIBDMO O=[N+]([O-])c1ccc2nc(N[C@H]3CCC[N@@H+](Cc4ccccc4)C3)ccc2c1 ZINC000312139476 1125273631 /nfs/dbraw/zinc/27/36/31/1125273631.db2.gz LMHDHINARCKCJV-SFHVURJKSA-N 1 1 362.433 4.220 20 5 FIBDMO CC(C)Oc1ncccc1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000618984044 1125411253 /nfs/dbraw/zinc/41/12/53/1125411253.db2.gz UMWMASLJPVIMCK-GOSISDBHSA-N 1 1 355.438 4.289 20 5 FIBDMO CN(C)CCC[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000098081493 222226242 /nfs/dbraw/zinc/22/62/42/222226242.db2.gz RTENKEPVGYEOBW-UHFFFAOYSA-N 1 1 363.845 4.082 20 5 FIBDMO CCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1CCCc2cccnc21 ZINC000481397123 567891010 /nfs/dbraw/zinc/89/10/10/567891010.db2.gz BDVMUHLGCIMJJL-QGZVFWFLSA-N 1 1 355.438 4.288 20 5 FIBDMO CCC[N@@H+]1Cc2cccc(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000568823407 568229898 /nfs/dbraw/zinc/22/98/98/568229898.db2.gz OJHCIFJCQNRLRY-AWEZNQCLSA-N 1 1 353.422 4.063 20 5 FIBDMO CCC[N@H+]1Cc2cccc(NC(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000568823407 568229899 /nfs/dbraw/zinc/22/98/99/568229899.db2.gz OJHCIFJCQNRLRY-AWEZNQCLSA-N 1 1 353.422 4.063 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@]2(CC[C@@H](C)C2)C1 ZINC000541951233 568270845 /nfs/dbraw/zinc/27/08/45/568270845.db2.gz CYQJEKXXKUQJLT-TYILLQQXSA-N 1 1 356.426 4.218 20 5 FIBDMO Cc1nc(N[C@@H]2CC[N@@H+](Cc3ccccc3)CC2(C)C)ccc1[N+](=O)[O-] ZINC000390840092 568312021 /nfs/dbraw/zinc/31/20/21/568312021.db2.gz CPNORRYBYYMDFO-GOSISDBHSA-N 1 1 354.454 4.011 20 5 FIBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000078562239 1125562139 /nfs/dbraw/zinc/56/21/39/1125562139.db2.gz SZTFHDZSFGPRIR-CQSZACIVSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000078562239 1125562146 /nfs/dbraw/zinc/56/21/46/1125562146.db2.gz SZTFHDZSFGPRIR-CQSZACIVSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000078571592 1125564732 /nfs/dbraw/zinc/56/47/32/1125564732.db2.gz UBQRHNQOGUXGCP-INIZCTEOSA-N 1 1 354.454 4.285 20 5 FIBDMO COc1cc(C[NH2+][C@H](C)c2ccsc2)c([N+](=O)[O-])cc1OC(F)F ZINC000619782688 1125695410 /nfs/dbraw/zinc/69/54/10/1125695410.db2.gz JMCXLACNMAVEJM-SECBINFHSA-N 1 1 358.366 4.117 20 5 FIBDMO CCC[C@@H](N[C@H](C[NH+](C)C)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000558252905 1079675549 /nfs/dbraw/zinc/67/55/49/1079675549.db2.gz AUAWORGWLGDAOO-WOJBJXKFSA-N 1 1 359.445 4.468 20 5 FIBDMO CCC[C@H](N[C@@H](C[NH+](C)C)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000558252900 1079675782 /nfs/dbraw/zinc/67/57/82/1079675782.db2.gz AUAWORGWLGDAOO-PMACEKPBSA-N 1 1 359.445 4.468 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CCC2(C1)CCCCC2 ZINC000610216050 1079983651 /nfs/dbraw/zinc/98/36/51/1079983651.db2.gz HEMVQIXBMQLIII-AWEZNQCLSA-N 1 1 356.426 4.362 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccc(OC(C)C)c(OC)c1 ZINC000430229480 1080035165 /nfs/dbraw/zinc/03/51/65/1080035165.db2.gz VTIMHJRURRPGAH-CQSZACIVSA-N 1 1 374.437 4.250 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2C2CCCCC2)cccc1[N+](=O)[O-] ZINC001167077126 1080052066 /nfs/dbraw/zinc/05/20/66/1080052066.db2.gz JQDNIRSRYLBLQO-IBGZPJMESA-N 1 1 359.470 4.277 20 5 FIBDMO Cn1cc[nH+]c1C[C@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1ccccc1 ZINC000610282363 1081204160 /nfs/dbraw/zinc/20/41/60/1081204160.db2.gz OMGRJMSOOHHELX-IBGZPJMESA-N 1 1 373.416 4.272 20 5 FIBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000177553560 1081225053 /nfs/dbraw/zinc/22/50/53/1081225053.db2.gz WEYBDJZPNIWVDQ-KBXCAEBGSA-N 1 1 364.405 4.023 20 5 FIBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000177533143 1081226881 /nfs/dbraw/zinc/22/68/81/1081226881.db2.gz IBJIODAFLRSHSQ-KDOFPFPSSA-N 1 1 364.405 4.023 20 5 FIBDMO COc1cc(Cl)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC001648832787 1081272687 /nfs/dbraw/zinc/27/26/87/1081272687.db2.gz MMTQDRVNIACJBM-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO COc1ccccc1[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000610004318 1081372199 /nfs/dbraw/zinc/37/21/99/1081372199.db2.gz WEDMIPIDHVPQEE-MRXNPFEDSA-N 1 1 370.449 4.380 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083199346 1081547454 /nfs/dbraw/zinc/54/74/54/1081547454.db2.gz JVORSEZERNLEFY-TZMCWYRMSA-N 1 1 355.369 4.253 20 5 FIBDMO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(OCC2CCCCC2)CC1 ZINC000610370079 1081554239 /nfs/dbraw/zinc/55/42/39/1081554239.db2.gz XIDZZCUTMJICCD-UHFFFAOYSA-N 1 1 350.434 4.295 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000610370762 1081554626 /nfs/dbraw/zinc/55/46/26/1081554626.db2.gz FNFAUHGFXBNSBL-DJJJIMSYSA-N 1 1 372.396 4.184 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2F)[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000610370762 1081554627 /nfs/dbraw/zinc/55/46/27/1081554627.db2.gz FNFAUHGFXBNSBL-DJJJIMSYSA-N 1 1 372.396 4.184 20 5 FIBDMO CC[C@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC001167356321 1081616634 /nfs/dbraw/zinc/61/66/34/1081616634.db2.gz MCIKWTDSHBZCIQ-NWDGAFQWSA-N 1 1 353.850 4.086 20 5 FIBDMO O=C(c1cc2ccccc2c2cccnc12)N1CCC[N@@H+](CC2CCC2)CC1 ZINC000580470148 1081960485 /nfs/dbraw/zinc/96/04/85/1081960485.db2.gz ZNLXQYJGXQGFBK-UHFFFAOYSA-N 1 1 373.500 4.336 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c2c(c1)COCO2 ZINC000580866198 1082197656 /nfs/dbraw/zinc/19/76/56/1082197656.db2.gz GWCDHYRXZHYGKT-LJQANCHMSA-N 1 1 354.406 4.189 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2c2ccccc2)c2c(c1)COCO2 ZINC000580866198 1082197661 /nfs/dbraw/zinc/19/76/61/1082197661.db2.gz GWCDHYRXZHYGKT-LJQANCHMSA-N 1 1 354.406 4.189 20 5 FIBDMO C[C@H](c1ccccc1)[NH+]1CCC(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000581142669 1082342047 /nfs/dbraw/zinc/34/20/47/1082342047.db2.gz PPIPJEGPZOHRRY-IIBYNOLFSA-N 1 1 365.477 4.397 20 5 FIBDMO C[C@@H](c1ccccc1)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC1CCC1 ZINC001167453963 1082447662 /nfs/dbraw/zinc/44/76/62/1082447662.db2.gz PJLCGCBBOILQMS-HRAATJIYSA-N 1 1 354.450 4.492 20 5 FIBDMO CC[C@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1c(C)noc1C ZINC000121305684 1082515808 /nfs/dbraw/zinc/51/58/08/1082515808.db2.gz YPTLQZBILQASIM-ZDUSSCGKSA-N 1 1 368.231 4.203 20 5 FIBDMO CC[C@@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1c(C)noc1C ZINC000121305812 1082515931 /nfs/dbraw/zinc/51/59/31/1082515931.db2.gz YPTLQZBILQASIM-CYBMUJFWSA-N 1 1 368.231 4.203 20 5 FIBDMO O=C(CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)Nc1ccccc1Cl ZINC000135226533 1082580433 /nfs/dbraw/zinc/58/04/33/1082580433.db2.gz SPKZATWHSBKPOA-UHFFFAOYSA-N 1 1 373.840 4.241 20 5 FIBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000055909424 1082927036 /nfs/dbraw/zinc/92/70/36/1082927036.db2.gz INZZQVWQBFEPHC-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1ccc(C[NH+]2CCC(C(=O)c3cc(F)ccc3F)CC2)cc1[N+](=O)[O-] ZINC000510492658 1083030795 /nfs/dbraw/zinc/03/07/95/1083030795.db2.gz SAMWGPJDDHTUQQ-UHFFFAOYSA-N 1 1 374.387 4.276 20 5 FIBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1cccc(C(F)(F)F)c1 ZINC000510580937 1083179746 /nfs/dbraw/zinc/17/97/46/1083179746.db2.gz VMVPZAGXHGRXMB-SNVBAGLBSA-N 1 1 364.327 4.341 20 5 FIBDMO C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1c2ccccc2-c2ccccc21 ZINC000477739843 1083201593 /nfs/dbraw/zinc/20/15/93/1083201593.db2.gz BQXKHKOMUOCFIZ-UHFFFAOYSA-N 1 1 373.412 4.235 20 5 FIBDMO C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1c2ccccc2-c2ccccc21 ZINC000477739843 1083201598 /nfs/dbraw/zinc/20/15/98/1083201598.db2.gz BQXKHKOMUOCFIZ-UHFFFAOYSA-N 1 1 373.412 4.235 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)s1 ZINC000610808012 1083717714 /nfs/dbraw/zinc/71/77/14/1083717714.db2.gz PRJKUWMPGDURGZ-DLBZAZTESA-N 1 1 357.479 4.147 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000610805872 1083718231 /nfs/dbraw/zinc/71/82/31/1083718231.db2.gz HDNZQVZRVRWYIP-QUCCMNQESA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000610805872 1083718235 /nfs/dbraw/zinc/71/82/35/1083718235.db2.gz HDNZQVZRVRWYIP-QUCCMNQESA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000610805872 1083718241 /nfs/dbraw/zinc/71/82/41/1083718241.db2.gz HDNZQVZRVRWYIP-QUCCMNQESA-N 1 1 367.493 4.466 20 5 FIBDMO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H](CCC[N@H+]3Cc3ccccc3)C2)s1 ZINC000610808017 1083718370 /nfs/dbraw/zinc/71/83/70/1083718370.db2.gz PRJKUWMPGDURGZ-IRXDYDNUSA-N 1 1 357.479 4.147 20 5 FIBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000588982847 1083765988 /nfs/dbraw/zinc/76/59/88/1083765988.db2.gz BEKKEHHJTPETHQ-OKILXGFUSA-N 1 1 360.376 4.417 20 5 FIBDMO CCOC(=O)CC[C@@H]1CCC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000615834548 1083886450 /nfs/dbraw/zinc/88/64/50/1083886450.db2.gz ODFUOJQMOZWTMX-MOKGIYGOSA-N 1 1 360.454 4.053 20 5 FIBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000612540004 1083901759 /nfs/dbraw/zinc/90/17/59/1083901759.db2.gz QGBCHCRTJYXEBB-DNVCBOLYSA-N 1 1 362.376 4.225 20 5 FIBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCCC[C@@H]1C[C@H](O)c1ccco1 ZINC000177451385 1083970827 /nfs/dbraw/zinc/97/08/27/1083970827.db2.gz PDBHFLMGZDKSQM-AEFFLSMTSA-N 1 1 362.401 4.195 20 5 FIBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180004034 1083989496 /nfs/dbraw/zinc/98/94/96/1083989496.db2.gz DDMSTIAELJUUQV-MRXNPFEDSA-N 1 1 357.454 4.019 20 5 FIBDMO Cc1ccc(C[NH2+][C@H]2CCCc3cn(C4CCCC4)nc32)cc1[N+](=O)[O-] ZINC000611560921 1084085908 /nfs/dbraw/zinc/08/59/08/1084085908.db2.gz KZUOFJLDHNOJSM-SFHVURJKSA-N 1 1 354.454 4.382 20 5 FIBDMO Cc1cnc(CC[N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 ZINC000180058862 1084208183 /nfs/dbraw/zinc/20/81/83/1084208183.db2.gz XRCRLJADMOBNOO-UHFFFAOYSA-N 1 1 357.435 4.294 20 5 FIBDMO Cc1cc([C@@H](C)[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])c(C)o1 ZINC000162160474 1084478616 /nfs/dbraw/zinc/47/86/16/1084478616.db2.gz SOEKVAUFJSTLRR-SNVBAGLBSA-N 1 1 353.216 4.418 20 5 FIBDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)C2)c1 ZINC000581975686 1084648026 /nfs/dbraw/zinc/64/80/26/1084648026.db2.gz QSORBLDVZMWORS-QGZVFWFLSA-N 1 1 368.462 4.275 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]([C@H]4CCOC4)C3)s2)cc1 ZINC000539849989 1084682734 /nfs/dbraw/zinc/68/27/34/1084682734.db2.gz AWDIYZBPQKVYGP-HOTGVXAUSA-N 1 1 358.463 4.182 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2cccc(F)c2)o1 ZINC000511104129 1084916984 /nfs/dbraw/zinc/91/69/84/1084916984.db2.gz GPXMWDANOPHNIT-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2cccc(F)c2)o1 ZINC000511104129 1084916992 /nfs/dbraw/zinc/91/69/92/1084916992.db2.gz GPXMWDANOPHNIT-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[C@H](c1ccc2ccccc2c1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000478432589 1084950644 /nfs/dbraw/zinc/95/06/44/1084950644.db2.gz UVDDHSGUGDMSLU-OAHLLOKOSA-N 1 1 350.422 4.170 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cccc2c1C[N@@H+](CC(C)C)C2 ZINC000158348744 1085042929 /nfs/dbraw/zinc/04/29/29/1085042929.db2.gz HFMDROUCZOPVJH-UHFFFAOYSA-N 1 1 353.422 4.127 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2ccccc2)n1 ZINC000511143803 1085081329 /nfs/dbraw/zinc/08/13/29/1085081329.db2.gz QMGFQHVYPKMNIT-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2ccccc2)n1 ZINC000511143803 1085081337 /nfs/dbraw/zinc/08/13/37/1085081337.db2.gz QMGFQHVYPKMNIT-UHFFFAOYSA-N 1 1 353.447 4.393 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@](C)(CCc2ccccc2)C1 ZINC001167598740 1085378392 /nfs/dbraw/zinc/37/83/92/1085378392.db2.gz JSZYHRDYEBDEEZ-OAQYLSRUSA-N 1 1 354.450 4.448 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@H](c3nc4ccccc4o3)C2)ccc1[N+](=O)[O-] ZINC000611516561 1085459108 /nfs/dbraw/zinc/45/91/08/1085459108.db2.gz KCSVNUOBWFJTOX-HNNXBMFYSA-N 1 1 367.405 4.124 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1cccc(F)c1)C1CC1 ZINC000109103024 1085588803 /nfs/dbraw/zinc/58/88/03/1085588803.db2.gz CIUNZNFBJFCQCF-UHFFFAOYSA-N 1 1 371.412 4.036 20 5 FIBDMO O=[N+]([O-])c1ccc(NCCc2[nH+]ccn2Cc2ccccc2)c2ncccc12 ZINC000024203687 1085664453 /nfs/dbraw/zinc/66/44/53/1085664453.db2.gz CPZXFXQJZZRWAU-UHFFFAOYSA-N 1 1 373.416 4.042 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC000178729578 1085966067 /nfs/dbraw/zinc/96/60/67/1085966067.db2.gz DTBRDWGKWYGRQB-NSHDSACASA-N 1 1 354.328 4.473 20 5 FIBDMO Cc1noc(C[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2)n1 ZINC000759929068 1086141740 /nfs/dbraw/zinc/14/17/40/1086141740.db2.gz KQBMEWKLNAJDSI-INIZCTEOSA-N 1 1 372.812 4.013 20 5 FIBDMO O=[N+]([O-])c1cccc2c(NCCc3[nH+]ccn3Cc3ccccc3)ccnc21 ZINC000432335217 1086623465 /nfs/dbraw/zinc/62/34/65/1086623465.db2.gz LXVXUAMVZWNGTC-UHFFFAOYSA-N 1 1 373.416 4.042 20 5 FIBDMO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(c2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432341338 1086633490 /nfs/dbraw/zinc/63/34/90/1086633490.db2.gz WIFNPWBIYZNRAY-DLBZAZTESA-N 1 1 368.481 4.234 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765563 1086692725 /nfs/dbraw/zinc/69/27/25/1086692725.db2.gz RNNWBZBGSAJIKR-VQIMIIECSA-N 1 1 364.449 4.015 20 5 FIBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc2cn[nH]c2c1 ZINC000585765593 1086692878 /nfs/dbraw/zinc/69/28/78/1086692878.db2.gz YABLKJRBYTVFDY-MRXNPFEDSA-N 1 1 370.478 4.174 20 5 FIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1Br)c1ccc([N+](=O)[O-])cc1 ZINC000038039063 1086784438 /nfs/dbraw/zinc/78/44/38/1086784438.db2.gz PCCZKJTWQAWIAI-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO Cc1[nH+]ccn1CCCCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000090095089 1086800174 /nfs/dbraw/zinc/80/01/74/1086800174.db2.gz GFILXVVTQJLJIE-UHFFFAOYSA-N 1 1 351.410 4.054 20 5 FIBDMO Cc1ccc2nc(C[NH2+][C@H]3CC(C)(C)c4ccc([N+](=O)[O-])cc43)cn2c1 ZINC000573029495 1087143245 /nfs/dbraw/zinc/14/32/45/1087143245.db2.gz GCIJETQHSSCZAE-SFHVURJKSA-N 1 1 350.422 4.063 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2CCOc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000188050447 1087693219 /nfs/dbraw/zinc/69/32/19/1087693219.db2.gz VTIKELMSDGVWLZ-LRDDRELGSA-N 1 1 360.385 4.307 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3c2c(Br)ccc3F)cc1 ZINC000180417520 1087898513 /nfs/dbraw/zinc/89/85/13/1087898513.db2.gz POJNVXDLCVXBHS-HNNXBMFYSA-N 1 1 365.202 4.274 20 5 FIBDMO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc(C(C)C)s1 ZINC000504899654 1087971769 /nfs/dbraw/zinc/97/17/69/1087971769.db2.gz JSGVYORGGXKOQW-GFCCVEGCSA-N 1 1 366.512 4.230 20 5 FIBDMO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)CCO2 ZINC000181281834 1088293347 /nfs/dbraw/zinc/29/33/47/1088293347.db2.gz IKNVHNYLXIEAMZ-KRWDZBQOSA-N 1 1 362.813 4.260 20 5 FIBDMO COc1cnccc1[C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000189567066 1088493141 /nfs/dbraw/zinc/49/31/41/1088493141.db2.gz UDCOOVYWOMWUSV-CYBMUJFWSA-N 1 1 353.378 4.109 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2ccccc2F)o1 ZINC000549171688 1089112892 /nfs/dbraw/zinc/11/28/92/1089112892.db2.gz IPADPHUSXPNBNL-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2ccccc2F)o1 ZINC000549171688 1089112896 /nfs/dbraw/zinc/11/28/96/1089112896.db2.gz IPADPHUSXPNBNL-UHFFFAOYSA-N 1 1 355.369 4.063 20 5 FIBDMO Cc1cc(NCc2c[nH+]c3n2CCCC3)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549174047 1089121879 /nfs/dbraw/zinc/12/18/79/1089121879.db2.gz VZVIAKCHYVQAEL-UHFFFAOYSA-N 1 1 354.332 4.067 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC001167717643 1089459352 /nfs/dbraw/zinc/45/93/52/1089459352.db2.gz ZLRVLKISGKVGOA-LJQANCHMSA-N 1 1 356.422 4.425 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC001167717643 1089459354 /nfs/dbraw/zinc/45/93/54/1089459354.db2.gz ZLRVLKISGKVGOA-LJQANCHMSA-N 1 1 356.422 4.425 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c(Cl)c1 ZINC000425367217 1089599594 /nfs/dbraw/zinc/59/95/94/1089599594.db2.gz BQEARCRHZCHXGF-QGZVFWFLSA-N 1 1 350.846 4.029 20 5 FIBDMO COc1cc(C[N@H+](C)Cc2ccc(C)s2)c([N+](=O)[O-])cc1OC(F)F ZINC000102773824 1089959165 /nfs/dbraw/zinc/95/91/65/1089959165.db2.gz ALBNWCCZNDZXTJ-UHFFFAOYSA-N 1 1 372.393 4.207 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2ccc(C)s2)c([N+](=O)[O-])cc1OC(F)F ZINC000102773824 1089959167 /nfs/dbraw/zinc/95/91/67/1089959167.db2.gz ALBNWCCZNDZXTJ-UHFFFAOYSA-N 1 1 372.393 4.207 20 5 FIBDMO CC(C)[N@@H+](C)Cc1cccc(CNCc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000236665675 1089971554 /nfs/dbraw/zinc/97/15/54/1089971554.db2.gz VFGICJCOOUUBPQ-UHFFFAOYSA-N 1 1 361.873 4.378 20 5 FIBDMO C[N@H+](CCCc1cc(-c2ccccc2)no1)Cc1csc([N+](=O)[O-])c1 ZINC000110297914 1091030143 /nfs/dbraw/zinc/03/01/43/1091030143.db2.gz PFOIKEMNLJPOFX-UHFFFAOYSA-N 1 1 357.435 4.376 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)no1)Cc1csc([N+](=O)[O-])c1 ZINC000110297914 1091030149 /nfs/dbraw/zinc/03/01/49/1091030149.db2.gz PFOIKEMNLJPOFX-UHFFFAOYSA-N 1 1 357.435 4.376 20 5 FIBDMO CC[C@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000105503889 1091031316 /nfs/dbraw/zinc/03/13/16/1091031316.db2.gz HYANGQPHWHKSCN-LBPRGKRZSA-N 1 1 370.272 4.363 20 5 FIBDMO Cc1ccc(C)c([C@@H](C)[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000500124998 1091050770 /nfs/dbraw/zinc/05/07/70/1091050770.db2.gz PDGXOHPSFSCAEV-MRXNPFEDSA-N 1 1 355.438 4.233 20 5 FIBDMO C[C@@H]1C[C@@H](c2ccccc2F)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500130061 1091055927 /nfs/dbraw/zinc/05/59/27/1091055927.db2.gz CMLYENKFXLYARU-KUHUBIRLSA-N 1 1 371.412 4.146 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC3(CC2)OCc2ccccc23)c1 ZINC000759787064 1091092565 /nfs/dbraw/zinc/09/25/65/1091092565.db2.gz ODMIHIVOKWVYIN-UHFFFAOYSA-N 1 1 358.825 4.270 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1N1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000432133718 1091716182 /nfs/dbraw/zinc/71/61/82/1091716182.db2.gz OVLAWYMHUCPSRR-UHFFFAOYSA-N 1 1 360.845 4.165 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512263469 1091981765 /nfs/dbraw/zinc/98/17/65/1091981765.db2.gz WAMBNZUGNRCPTB-HNNXBMFYSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512263469 1091981769 /nfs/dbraw/zinc/98/17/69/1091981769.db2.gz WAMBNZUGNRCPTB-HNNXBMFYSA-N 1 1 353.422 4.067 20 5 FIBDMO C[C@H](c1ccccc1)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000512292721 1092014092 /nfs/dbraw/zinc/01/40/92/1092014092.db2.gz JCSMQRMULKMUGN-CYBMUJFWSA-N 1 1 373.840 4.412 20 5 FIBDMO C[C@H](c1ccccc1)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000512292721 1092014100 /nfs/dbraw/zinc/01/41/00/1092014100.db2.gz JCSMQRMULKMUGN-CYBMUJFWSA-N 1 1 373.840 4.412 20 5 FIBDMO Cc1c(CN(Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cccc1[N+](=O)[O-] ZINC000432676148 1092071504 /nfs/dbraw/zinc/07/15/04/1092071504.db2.gz NJAULTFBLSDPNT-IBGZPJMESA-N 1 1 371.506 4.109 20 5 FIBDMO C[NH+](C)Cc1cc(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c32)ccc1Cl ZINC000500781578 1092563919 /nfs/dbraw/zinc/56/39/19/1092563919.db2.gz SMEJJMMVOIMWGE-UHFFFAOYSA-N 1 1 372.812 4.043 20 5 FIBDMO CC(C)[N@@H+](CCc1nccs1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000121037369 1092709703 /nfs/dbraw/zinc/70/97/03/1092709703.db2.gz GTBADDWFESQKMK-UHFFFAOYSA-N 1 1 372.450 4.159 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC4(CCC4)[C@@H]3[C@@H]3CCCO3)o2)cc1 ZINC000572807655 1092907676 /nfs/dbraw/zinc/90/76/76/1092907676.db2.gz CIOACHDBUFQVCA-PMACEKPBSA-N 1 1 368.433 4.388 20 5 FIBDMO Cc1ccc(C[NH2+]Cc2ccncc2OCc2ccccc2)cc1[N+](=O)[O-] ZINC000512577808 1092956368 /nfs/dbraw/zinc/95/63/68/1092956368.db2.gz LCWAVZGKVBQTSC-UHFFFAOYSA-N 1 1 363.417 4.167 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CCC(F)(F)[C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000522044760 1093053374 /nfs/dbraw/zinc/05/33/74/1093053374.db2.gz KUXFXTZKNJGGIY-GFCCVEGCSA-N 1 1 366.364 4.341 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](c4ccccc4)C3)o2)cc1 ZINC000433049559 1093159705 /nfs/dbraw/zinc/15/97/05/1093159705.db2.gz VUTUMCFQSKEUOC-QGZVFWFLSA-N 1 1 364.405 4.024 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H](c1ccccc1)C1(CO)CCC1 ZINC000433323855 1093585706 /nfs/dbraw/zinc/58/57/06/1093585706.db2.gz ZODOCYJQTVWQLI-GOSISDBHSA-N 1 1 360.841 4.242 20 5 FIBDMO CC(C)(C)[N@@H+](Cc1ccc(F)cc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000513101608 1093847712 /nfs/dbraw/zinc/84/77/12/1093847712.db2.gz SNGXDGXBCMMDGR-UHFFFAOYSA-N 1 1 374.412 4.401 20 5 FIBDMO COc1ccc(C)cc1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001648950940 1093913157 /nfs/dbraw/zinc/91/31/57/1093913157.db2.gz KDFCZYWATHSHHC-UHFFFAOYSA-N 1 1 352.390 4.462 20 5 FIBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000513242608 1094033500 /nfs/dbraw/zinc/03/35/00/1094033500.db2.gz VBFNSVOJMDSKPQ-KSSFIOAISA-N 1 1 364.405 4.228 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000513246816 1094034100 /nfs/dbraw/zinc/03/41/00/1094034100.db2.gz DDEDYOHJOWZZQY-MGPUTAFESA-N 1 1 367.449 4.315 20 5 FIBDMO COc1ccccc1O[C@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000513406683 1094105452 /nfs/dbraw/zinc/10/54/52/1094105452.db2.gz WERYKRTZLKSINB-CVEARBPZSA-N 1 1 356.422 4.208 20 5 FIBDMO COc1ccccc1O[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000513406686 1094105631 /nfs/dbraw/zinc/10/56/31/1094105631.db2.gz WERYKRTZLKSINB-JKSUJKDBSA-N 1 1 356.422 4.208 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000513440871 1094127612 /nfs/dbraw/zinc/12/76/12/1094127612.db2.gz YLELTWYYFXKICZ-ZNNBYXKUSA-N 1 1 352.390 4.174 20 5 FIBDMO C[C@H]1CC[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000501122638 1094518743 /nfs/dbraw/zinc/51/87/43/1094518743.db2.gz RWUIPGYWXPYEGR-HNNXBMFYSA-N 1 1 354.454 4.007 20 5 FIBDMO C[C@H](Nc1nccc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000413252034 1094801746 /nfs/dbraw/zinc/80/17/46/1094801746.db2.gz YLGPJRSFTJMAFD-GOEBONIOSA-N 1 1 354.454 4.208 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421003301 1095237765 /nfs/dbraw/zinc/23/77/65/1095237765.db2.gz HAHQQWSPPODFPH-AWEZNQCLSA-N 1 1 361.467 4.375 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C(C)C)[C@@H](C)c1ccsc1 ZINC000421003301 1095237779 /nfs/dbraw/zinc/23/77/79/1095237779.db2.gz HAHQQWSPPODFPH-AWEZNQCLSA-N 1 1 361.467 4.375 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421008297 1095242106 /nfs/dbraw/zinc/24/21/06/1095242106.db2.gz LWXXNZMXHIUJBN-CQSZACIVSA-N 1 1 361.467 4.375 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C(C)C)[C@H](C)c1ccsc1 ZINC000421008297 1095242118 /nfs/dbraw/zinc/24/21/18/1095242118.db2.gz LWXXNZMXHIUJBN-CQSZACIVSA-N 1 1 361.467 4.375 20 5 FIBDMO CC(C)[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(F)cc1 ZINC000502545013 1095571098 /nfs/dbraw/zinc/57/10/98/1095571098.db2.gz VZMCALLTYHIQNG-SFHVURJKSA-N 1 1 370.384 4.271 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCCC[C@@H]3c3ccco3)n2)cc1 ZINC000121218445 1095603302 /nfs/dbraw/zinc/60/33/02/1095603302.db2.gz ATOBFPOJDNMYME-MRXNPFEDSA-N 1 1 368.393 4.355 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCCC[C@@H]3c3ccco3)n2)cc1 ZINC000121218445 1095603312 /nfs/dbraw/zinc/60/33/12/1095603312.db2.gz ATOBFPOJDNMYME-MRXNPFEDSA-N 1 1 368.393 4.355 20 5 FIBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)CC(=O)Nc1ccccc1 ZINC000502890694 1095924870 /nfs/dbraw/zinc/92/48/70/1095924870.db2.gz CIXVOEUBPPYCIA-INIZCTEOSA-N 1 1 355.438 4.224 20 5 FIBDMO Cn1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c(C2CCCCC2)n1 ZINC000183799313 1096195227 /nfs/dbraw/zinc/19/52/27/1096195227.db2.gz ZCKLLKIMDCXVQP-UHFFFAOYSA-N 1 1 362.861 4.319 20 5 FIBDMO COc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)CC2CC2)c(OC)c1 ZINC000503246042 1096325879 /nfs/dbraw/zinc/32/58/79/1096325879.db2.gz YJHHGOVUJBMZMK-UHFFFAOYSA-N 1 1 356.422 4.024 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2c2nc3ccccc3s2)c1 ZINC000532904089 1098580646 /nfs/dbraw/zinc/58/06/46/1098580646.db2.gz QCSWVFXNXSMCFX-KRWDZBQOSA-N 1 1 369.446 4.420 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCCCC[C@@H]1c1ccccc1 ZINC000532929777 1098599928 /nfs/dbraw/zinc/59/99/28/1098599928.db2.gz YKAUAWVCMJGEFO-GOSISDBHSA-N 1 1 367.449 4.459 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCCC[C@@H]1c1ccccc1 ZINC000532929777 1098599933 /nfs/dbraw/zinc/59/99/33/1098599933.db2.gz YKAUAWVCMJGEFO-GOSISDBHSA-N 1 1 367.449 4.459 20 5 FIBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccccc2CNc2ncccc2[N+](=O)[O-])C1 ZINC000515480496 1098626024 /nfs/dbraw/zinc/62/60/24/1098626024.db2.gz MVTRJSYNEGKHEW-IYBDPMFKSA-N 1 1 354.454 4.080 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532977192 1098647580 /nfs/dbraw/zinc/64/75/80/1098647580.db2.gz TZIIQEASTHKTPE-ZFWWWQNUSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000532977192 1098647584 /nfs/dbraw/zinc/64/75/84/1098647584.db2.gz TZIIQEASTHKTPE-ZFWWWQNUSA-N 1 1 373.840 4.065 20 5 FIBDMO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000533434868 1099054518 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AABKOYHTVRUPOJ-CQSZACIVSA-N 1 1 365.227 4.304 20 5 FIBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H](CCO)c1ccccc1 ZINC000536669659 1100153524 /nfs/dbraw/zinc/15/35/24/1100153524.db2.gz XOPFRXHPIUIWFL-HXUWFJFHSA-N 1 1 366.417 4.410 20 5 FIBDMO CN(C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536673570 1100158719 /nfs/dbraw/zinc/15/87/19/1100158719.db2.gz MECBUBCCKIBXKE-OEMHODTASA-N 1 1 365.477 4.062 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH+]2CC3(C2)CCOCC3)ccc1Oc1ccc(F)cc1 ZINC000459624582 1100355874 /nfs/dbraw/zinc/35/58/74/1100355874.db2.gz TXAITDMEACJSBB-UHFFFAOYSA-N 1 1 372.396 4.139 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000536848545 1100360635 /nfs/dbraw/zinc/36/06/35/1100360635.db2.gz YOOSFXWGMHWYRL-ABAIWWIYSA-N 1 1 362.813 4.431 20 5 FIBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3cc4c(cccc4F)[nH]3)CC2)cc1 ZINC000438118942 1100426652 /nfs/dbraw/zinc/42/66/52/1100426652.db2.gz RLKFFRSRKQQHGV-UHFFFAOYSA-N 1 1 369.396 4.259 20 5 FIBDMO 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CC(C)(C)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)Cc1ccc(F)cc1 ZINC000444655530 1108051962 /nfs/dbraw/zinc/05/19/62/1108051962.db2.gz WCKJJBIQZNFYNS-UHFFFAOYSA-N 1 1 356.401 4.411 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3(c4ccc(F)cc4F)CCCC3)nc2c1 ZINC000444690154 1108092354 /nfs/dbraw/zinc/09/23/54/1108092354.db2.gz RCBAWRUETZBRJI-UHFFFAOYSA-N 1 1 372.375 4.308 20 5 FIBDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 ZINC000523441379 1108225293 /nfs/dbraw/zinc/22/52/93/1108225293.db2.gz PQRNOKOLCDOHCY-HNNXBMFYSA-N 1 1 366.421 4.016 20 5 FIBDMO O=[N+]([O-])c1ccccc1CN1CC[C@@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000532244183 1108734285 /nfs/dbraw/zinc/73/42/85/1108734285.db2.gz XIRHIXTVWMNIEQ-PZJWPPBQSA-N 1 1 365.477 4.081 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](Cc1cccc(OCC(F)(F)F)c1)CC2 ZINC000532293373 1108747344 /nfs/dbraw/zinc/74/73/44/1108747344.db2.gz BQCBUNCUAZGTMA-UHFFFAOYSA-N 1 1 366.339 4.094 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](Cc1cccc(OCC(F)(F)F)c1)CC2 ZINC000532293373 1108747352 /nfs/dbraw/zinc/74/73/52/1108747352.db2.gz BQCBUNCUAZGTMA-UHFFFAOYSA-N 1 1 366.339 4.094 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@@H](O)[C@@H](C)C3)cc2[N+](=O)[O-])cc1 ZINC000428449202 1109292421 /nfs/dbraw/zinc/29/24/21/1109292421.db2.gz SIIPYNXDKUZYHA-HNAYVOBHSA-N 1 1 372.490 4.257 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@H+]3CC[C@@H](O)[C@@H](C)C3)cc2[N+](=O)[O-])cc1 ZINC000428449202 1109292424 /nfs/dbraw/zinc/29/24/24/1109292424.db2.gz SIIPYNXDKUZYHA-HNAYVOBHSA-N 1 1 372.490 4.257 20 5 FIBDMO COc1ccc(OCC[N@@H+](C)[C@@H](C)c2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC000441215911 1109475586 /nfs/dbraw/zinc/47/55/86/1109475586.db2.gz BHSDGVCSDCIHFF-ZDUSSCGKSA-N 1 1 364.829 4.329 20 5 FIBDMO CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000428481142 1109533934 /nfs/dbraw/zinc/53/39/34/1109533934.db2.gz DPQQVPMRNRVARE-LJQANCHMSA-N 1 1 360.479 4.308 20 5 FIBDMO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000449227627 1110002331 /nfs/dbraw/zinc/00/23/31/1110002331.db2.gz PUSNKFVVKWAZFU-LVCYWYKZSA-N 1 1 367.493 4.026 20 5 FIBDMO CC(C)CCn1nc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000449488729 1110090344 /nfs/dbraw/zinc/09/03/44/1110090344.db2.gz KPWOUMQZVFEVMO-UHFFFAOYSA-N 1 1 352.438 4.280 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](C[C@@H]3CCOC3)C3CC3)s2)cc1 ZINC000129919602 1110213227 /nfs/dbraw/zinc/21/32/27/1110213227.db2.gz GSCGSSRBPHEFRG-AWEZNQCLSA-N 1 1 358.463 4.324 20 5 FIBDMO CC[C@H]([NH2+]Cc1ccn(CCc2ccccc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000450677874 1110332412 /nfs/dbraw/zinc/33/24/12/1110332412.db2.gz HBNADMSLACAIEL-NRFANRHFSA-N 1 1 364.449 4.275 20 5 FIBDMO C[C@H]1CC[N@@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538739506 1111272660 /nfs/dbraw/zinc/27/26/60/1111272660.db2.gz QQJIBJCHWANVTE-ZDUSSCGKSA-N 1 1 363.845 4.034 20 5 FIBDMO C[C@H]1CCN(C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538739506 1111272661 /nfs/dbraw/zinc/27/26/61/1111272661.db2.gz QQJIBJCHWANVTE-ZDUSSCGKSA-N 1 1 363.845 4.034 20 5 FIBDMO C[C@H]1CCN(C)CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538739506 1111272665 /nfs/dbraw/zinc/27/26/65/1111272665.db2.gz QQJIBJCHWANVTE-ZDUSSCGKSA-N 1 1 363.845 4.034 20 5 FIBDMO COc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)cc1[N+](=O)[O-] ZINC000539070522 1111418218 /nfs/dbraw/zinc/41/82/18/1111418218.db2.gz GXFSQPRFSQVDSA-SNVBAGLBSA-N 1 1 370.327 4.195 20 5 FIBDMO COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000539094673 1111430196 /nfs/dbraw/zinc/43/01/96/1111430196.db2.gz ZOKALOUHVAEVCS-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO COc1cccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1OC(C)C ZINC000554873121 1112539756 /nfs/dbraw/zinc/53/97/56/1112539756.db2.gz RQVWQEDLBGGDOH-UHFFFAOYSA-N 1 1 358.438 4.065 20 5 FIBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)CC1(O)CCC1 ZINC001142619411 1112670600 /nfs/dbraw/zinc/67/06/00/1112670600.db2.gz RTLJCDVGPDPXNO-UHFFFAOYSA-N 1 1 363.461 4.006 20 5 FIBDMO C[C@H](c1cc2ccccc2o1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482684373 1113330694 /nfs/dbraw/zinc/33/06/94/1113330694.db2.gz OIWVQHZIAFJXIT-GFCCVEGCSA-N 1 1 350.378 4.410 20 5 FIBDMO C[C@H](c1cc2ccccc2o1)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482684373 1113330701 /nfs/dbraw/zinc/33/07/01/1113330701.db2.gz OIWVQHZIAFJXIT-GFCCVEGCSA-N 1 1 350.378 4.410 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c2ccncc21 ZINC000192954292 1113579885 /nfs/dbraw/zinc/57/98/85/1113579885.db2.gz VESKBPSMYAQYAL-QGZVFWFLSA-N 1 1 362.433 4.077 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000486933057 1113679880 /nfs/dbraw/zinc/67/98/80/1113679880.db2.gz HUOWVCYMHQBFLU-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1csc(-c3ccco3)n1)CCC2 ZINC000192965118 1113986902 /nfs/dbraw/zinc/98/69/02/1113986902.db2.gz HPTOGYLHGDYXGX-MRXNPFEDSA-N 1 1 355.419 4.479 20 5 FIBDMO CC(C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000028842937 1114078620 /nfs/dbraw/zinc/07/86/20/1114078620.db2.gz WXSJSXLOLUAEHT-UHFFFAOYSA-N 1 1 361.829 4.097 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N(C)C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000490029413 1114204940 /nfs/dbraw/zinc/20/49/40/1114204940.db2.gz JWNJZOWXUYFNEI-ICSRJNTNSA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490029413 1114204954 /nfs/dbraw/zinc/20/49/54/1114204954.db2.gz JWNJZOWXUYFNEI-ICSRJNTNSA-N 1 1 367.493 4.418 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@@H]1CCN(Cc2ccccc2)C1 ZINC000490029413 1114204956 /nfs/dbraw/zinc/20/49/56/1114204956.db2.gz JWNJZOWXUYFNEI-ICSRJNTNSA-N 1 1 367.493 4.418 20 5 FIBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)C(=O)Nc1ccccc1C ZINC000490082819 1114216480 /nfs/dbraw/zinc/21/64/80/1114216480.db2.gz SZKFQDOAIUZMLB-QGZVFWFLSA-N 1 1 369.465 4.185 20 5 FIBDMO COc1cc(C[N@H+]2CC[C@@H](CSc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490090409 1114217340 /nfs/dbraw/zinc/21/73/40/1114217340.db2.gz UPTTYKHASFTVKT-MRXNPFEDSA-N 1 1 358.463 4.218 20 5 FIBDMO O=[N+]([O-])c1cccnc1NC[C@H](c1c(F)cccc1Cl)[NH+]1CCCC1 ZINC000029622147 1114339906 /nfs/dbraw/zinc/33/99/06/1114339906.db2.gz YLFNGSFMUGDEEL-OAHLLOKOSA-N 1 1 364.808 4.031 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 ZINC000586778941 1114391939 /nfs/dbraw/zinc/39/19/39/1114391939.db2.gz GPNLULMFTSPMPN-GUDVDZBRSA-N 1 1 372.852 4.253 20 5 FIBDMO CC(=O)c1cc(NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000587528789 1114446900 /nfs/dbraw/zinc/44/69/00/1114446900.db2.gz TWGMJWOZJXSHAS-GOSISDBHSA-N 1 1 367.449 4.122 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000164377838 1114475755 /nfs/dbraw/zinc/47/57/55/1114475755.db2.gz SQJQHGNIZUSWJF-IBGZPJMESA-N 1 1 353.422 4.069 20 5 FIBDMO Cc1ccccc1C1([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CCC1 ZINC000593040418 1115281473 /nfs/dbraw/zinc/28/14/73/1115281473.db2.gz RYAMZODVFDCGIE-UHFFFAOYSA-N 1 1 364.405 4.122 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(CN(C3CC3)C3CC[NH2+]CC3)s2)cc1 ZINC000592424287 1115306341 /nfs/dbraw/zinc/30/63/41/1115306341.db2.gz BDISGAMSZIKUNS-UHFFFAOYSA-N 1 1 357.479 4.040 20 5 FIBDMO Cc1c(Br)cncc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000594942930 1115501831 /nfs/dbraw/zinc/50/18/31/1115501831.db2.gz DTRAPLSDPKTXQB-UHFFFAOYSA-N 1 1 364.243 4.086 20 5 FIBDMO COc1cc(C[NH2+]Cc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])cc1OC ZINC000594965153 1115502991 /nfs/dbraw/zinc/50/29/91/1115502991.db2.gz QPBZHIMKOGXGOS-UHFFFAOYSA-N 1 1 371.220 4.209 20 5 FIBDMO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595014422 1115503983 /nfs/dbraw/zinc/50/39/83/1115503983.db2.gz PIYLDONDXDWIMQ-SCLBCKFNSA-N 1 1 356.422 4.340 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCOc2c(Cl)cccc21 ZINC000595008670 1115508051 /nfs/dbraw/zinc/50/80/51/1115508051.db2.gz QNINEJLPUMONRZ-BDJLRTHQSA-N 1 1 362.813 4.431 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@H](COC)c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000595068387 1115509232 /nfs/dbraw/zinc/50/92/32/1115509232.db2.gz OHIYONHTXUMJKP-RDTXWAMCSA-N 1 1 374.437 4.040 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H](COC)c2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000595068085 1115509386 /nfs/dbraw/zinc/50/93/86/1115509386.db2.gz OHIYONHTXUMJKP-KDOFPFPSSA-N 1 1 374.437 4.040 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000595052172 1115512619 /nfs/dbraw/zinc/51/26/19/1115512619.db2.gz QPWOYPDDMHIKPA-SJCJKPOMSA-N 1 1 364.829 4.031 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1nccn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000595107576 1115516421 /nfs/dbraw/zinc/51/64/21/1115516421.db2.gz NKZBMGDCIWBYNM-CHWSQXEVSA-N 1 1 356.451 4.469 20 5 FIBDMO COc1ccccc1-c1cc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])on1 ZINC000595105846 1115516475 /nfs/dbraw/zinc/51/64/75/1115516475.db2.gz ZMJYJLQZILDJCH-KRWDZBQOSA-N 1 1 365.389 4.036 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000595107577 1115516537 /nfs/dbraw/zinc/51/65/37/1115516537.db2.gz NKZBMGDCIWBYNM-OLZOCXBDSA-N 1 1 356.451 4.469 20 5 FIBDMO COc1ccc(-c2cc(C[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])on2)cc1 ZINC000595076265 1115516907 /nfs/dbraw/zinc/51/69/07/1115516907.db2.gz GOJVLIYXDKJHFB-SFHVURJKSA-N 1 1 365.389 4.036 20 5 FIBDMO COC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000595416738 1115534731 /nfs/dbraw/zinc/53/47/31/1115534731.db2.gz JYIAQQJYADKAMY-OAHLLOKOSA-N 1 1 372.318 4.230 20 5 FIBDMO Cc1noc(C[NH+]2CCC(F)(c3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000595477797 1115538387 /nfs/dbraw/zinc/53/83/87/1115538387.db2.gz YETADTOSCTWAIQ-UHFFFAOYSA-N 1 1 353.781 4.005 20 5 FIBDMO CC[C@H](CC(F)F)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000595562760 1115540611 /nfs/dbraw/zinc/54/06/11/1115540611.db2.gz LOMCIDZBGFMZBH-DJIMGWMZSA-N 1 1 370.440 4.382 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H]1CC[C@@H]2C[C@@H]2C1)[C@H]1CC[C@H](O)CC1 ZINC000595561265 1115540660 /nfs/dbraw/zinc/54/06/60/1115540660.db2.gz DNFRTCFSRSEPFW-SCQOQHIRSA-N 1 1 358.482 4.137 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCc2ccccc2-n2ccnc21 ZINC000596118265 1115574925 /nfs/dbraw/zinc/57/49/25/1115574925.db2.gz UZDRKWHCZJVULR-ROUUACIJSA-N 1 1 360.417 4.045 20 5 FIBDMO O=C(c1ccc(Cl)cc1)C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000060483302 1115645655 /nfs/dbraw/zinc/64/56/55/1115645655.db2.gz BKLJTACAEFSLNB-UHFFFAOYSA-N 1 1 358.825 4.343 20 5 FIBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000602664643 1115717775 /nfs/dbraw/zinc/71/77/75/1115717775.db2.gz OMVFQVDDYHASJN-PHIMTYICSA-N 1 1 357.332 4.289 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1cc(-c2ccccc2)n(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000599024796 1115777869 /nfs/dbraw/zinc/77/78/69/1115777869.db2.gz WDPPDISUHJVAFJ-CABCVRRESA-N 1 1 350.422 4.407 20 5 FIBDMO CCOc1ccc([C@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603838728 1115818149 /nfs/dbraw/zinc/81/81/49/1115818149.db2.gz FFKYTYKGZRDUPX-GOSISDBHSA-N 1 1 356.422 4.209 20 5 FIBDMO COc1ccc(C[N@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000603837398 1115820121 /nfs/dbraw/zinc/82/01/21/1115820121.db2.gz FRNJIAIGFBQKTB-SUMWQHHRSA-N 1 1 356.422 4.484 20 5 FIBDMO COc1ccc(C[N@@H+](Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)cc1[N+](=O)[O-] ZINC000603837398 1115820126 /nfs/dbraw/zinc/82/01/26/1115820126.db2.gz FRNJIAIGFBQKTB-SUMWQHHRSA-N 1 1 356.422 4.484 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000603909370 1115829278 /nfs/dbraw/zinc/82/92/78/1115829278.db2.gz TXOVBJYJLPVNRG-CYBMUJFWSA-N 1 1 359.451 4.283 20 5 FIBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000603909371 1115829414 /nfs/dbraw/zinc/82/94/14/1115829414.db2.gz TXOVBJYJLPVNRG-ZDUSSCGKSA-N 1 1 359.451 4.283 20 5 FIBDMO C/C=C/C[C@@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599689599 1115836273 /nfs/dbraw/zinc/83/62/73/1115836273.db2.gz JZYKUYLKBPCGIW-LRPXVYOUSA-N 1 1 356.426 4.384 20 5 FIBDMO Cc1ccc([C@H]2CCC[N@H+]2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000604435116 1115865294 /nfs/dbraw/zinc/86/52/94/1115865294.db2.gz XYFLPJHOLFICDB-HXUWFJFHSA-N 1 1 367.449 4.377 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000604520783 1115867382 /nfs/dbraw/zinc/86/73/82/1115867382.db2.gz PTIRUKPDJCIWLV-UTKZUKDTSA-N 1 1 370.449 4.203 20 5 FIBDMO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccc(Cl)cc1 ZINC000604492762 1115867528 /nfs/dbraw/zinc/86/75/28/1115867528.db2.gz SIORREAPWUWIKQ-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccc(Cl)cc1 ZINC000604492762 1115867530 /nfs/dbraw/zinc/86/75/30/1115867530.db2.gz SIORREAPWUWIKQ-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccc4cccnc4n3)CC2)c(F)c1 ZINC000594019709 1115962201 /nfs/dbraw/zinc/96/22/01/1115962201.db2.gz QYPGSHICKNLEFD-UHFFFAOYSA-N 1 1 366.396 4.057 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000063505282 1116075128 /nfs/dbraw/zinc/07/51/28/1116075128.db2.gz HIFJHUCKMAZZSE-MRXNPFEDSA-N 1 1 355.438 4.233 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@@H+]1CCC[C@H](C)C1 ZINC000608836419 1116131186 /nfs/dbraw/zinc/13/11/86/1116131186.db2.gz WCGZRJZXIXSHGS-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[N@H+]1CCC[C@H](C)C1 ZINC000608836419 1116131188 /nfs/dbraw/zinc/13/11/88/1116131188.db2.gz WCGZRJZXIXSHGS-JKSUJKDBSA-N 1 1 357.454 4.065 20 5 FIBDMO COc1ccc(-c2ccc(C[NH2+]Cc3ccc(F)cc3F)o2)c([N+](=O)[O-])c1 ZINC000608836999 1116131548 /nfs/dbraw/zinc/13/15/48/1116131548.db2.gz IJSVZOUKOYBKNW-UHFFFAOYSA-N 1 1 374.343 4.431 20 5 FIBDMO C[C@H](C[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1 ZINC000534855285 1116243022 /nfs/dbraw/zinc/24/30/22/1116243022.db2.gz NYMPPWJZGDXOFN-OAHLLOKOSA-N 1 1 351.406 4.485 20 5 FIBDMO CCS[C@@H]1CCCC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089897593 1116338943 /nfs/dbraw/zinc/33/89/43/1116338943.db2.gz VCPMTOHRKWSATD-QGZVFWFLSA-N 1 1 361.467 4.357 20 5 FIBDMO Cc1cnc(NCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000463052838 1117942181 /nfs/dbraw/zinc/94/21/81/1117942181.db2.gz IWEOHNLJZQITNB-INIZCTEOSA-N 1 1 354.454 4.285 20 5 FIBDMO C[C@@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1 ZINC000463224980 1118035859 /nfs/dbraw/zinc/03/58/59/1118035859.db2.gz YWCFKSUKNKQXIB-KRWDZBQOSA-N 1 1 350.422 4.055 20 5 FIBDMO C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](c2ccco2)C1 ZINC000076184679 1118201731 /nfs/dbraw/zinc/20/17/31/1118201731.db2.gz WMQMTBMUYOPGPN-DYVFJYSZSA-N 1 1 358.394 4.028 20 5 FIBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](c2ccco2)C1 ZINC000076184679 1118201735 /nfs/dbraw/zinc/20/17/35/1118201735.db2.gz WMQMTBMUYOPGPN-DYVFJYSZSA-N 1 1 358.394 4.028 20 5 FIBDMO C[C@H](Nc1cccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1)c1cccc([N+](=O)[O-])c1 ZINC000540789389 1118248196 /nfs/dbraw/zinc/24/81/96/1118248196.db2.gz PMIJMPCSZBSSJT-BBWFWOEESA-N 1 1 369.465 4.377 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](Cc1ccc(F)cc1)C1CCOCC1 ZINC000595456107 1118278566 /nfs/dbraw/zinc/27/85/66/1118278566.db2.gz WBQVYEKLBRFCNS-UHFFFAOYSA-N 1 1 362.376 4.054 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000540866507 1118285463 /nfs/dbraw/zinc/28/54/63/1118285463.db2.gz VSLSOSTXJNULTG-KRWDZBQOSA-N 1 1 369.469 4.140 20 5 FIBDMO CC[C@H]([NH2+][C@H](C(=O)N(CC)CC)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000090068654 1118323550 /nfs/dbraw/zinc/32/35/50/1118323550.db2.gz RCHDVLAWAFCTCW-PMACEKPBSA-N 1 1 369.465 4.245 20 5 FIBDMO C[C@H](N[C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356482 1118384064 /nfs/dbraw/zinc/38/40/64/1118384064.db2.gz OHKBNDGTILCCCR-RQXXJAGISA-N 1 1 367.493 4.402 20 5 FIBDMO C[C@H](N[C@H]1[C@H](C)C[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356482 1118384068 /nfs/dbraw/zinc/38/40/68/1118384068.db2.gz OHKBNDGTILCCCR-RQXXJAGISA-N 1 1 367.493 4.402 20 5 FIBDMO C[C@H]([NH2+][C@H]1[C@H](C)CN(Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000460356482 1118384070 /nfs/dbraw/zinc/38/40/70/1118384070.db2.gz OHKBNDGTILCCCR-RQXXJAGISA-N 1 1 367.493 4.402 20 5 FIBDMO Cc1cc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2cccnc2)ccc1F ZINC000541545689 1118550621 /nfs/dbraw/zinc/55/06/21/1118550621.db2.gz JDFIPGNEZXPKHR-HXUWFJFHSA-N 1 1 351.381 4.317 20 5 FIBDMO CCC[N@H+](CC(=O)Nc1ccccc1C)Cc1ccc([N+](=O)[O-])cc1C ZINC000541772388 1118644692 /nfs/dbraw/zinc/64/46/92/1118644692.db2.gz YSEOHWPDIACUGX-UHFFFAOYSA-N 1 1 355.438 4.062 20 5 FIBDMO CCC[N@@H+](CC(=O)Nc1ccccc1C)Cc1ccc([N+](=O)[O-])cc1C ZINC000541772388 1118644696 /nfs/dbraw/zinc/64/46/96/1118644696.db2.gz YSEOHWPDIACUGX-UHFFFAOYSA-N 1 1 355.438 4.062 20 5 FIBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@H+]2CCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000464841714 1118717904 /nfs/dbraw/zinc/71/79/04/1118717904.db2.gz YVLMPMDWSIZGEH-DNVCBOLYSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[N@@H+]2CCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000464841714 1118717907 /nfs/dbraw/zinc/71/79/07/1118717907.db2.gz YVLMPMDWSIZGEH-DNVCBOLYSA-N 1 1 353.422 4.067 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000464857596 1118726075 /nfs/dbraw/zinc/72/60/75/1118726075.db2.gz KRAXZGGXAPBMOK-KDOFPFPSSA-N 1 1 371.437 4.298 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000491841762 1118986558 /nfs/dbraw/zinc/98/65/58/1118986558.db2.gz CAXYKABYTZPEBP-CQSZACIVSA-N 1 1 370.840 4.263 20 5 FIBDMO CCOc1cc(C[N@@H+]2CCC[C@@H]2CC(=O)c2cccs2)ccc1[N+](=O)[O-] ZINC000492721291 1119176033 /nfs/dbraw/zinc/17/60/33/1119176033.db2.gz JWHDOFVZMVRFOK-OAHLLOKOSA-N 1 1 374.462 4.292 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2CC(=O)c2cccs2)ccc1[N+](=O)[O-] ZINC000492721291 1119176038 /nfs/dbraw/zinc/17/60/38/1119176038.db2.gz JWHDOFVZMVRFOK-OAHLLOKOSA-N 1 1 374.462 4.292 20 5 FIBDMO O=[N+]([O-])c1ccc(CNC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1Cl ZINC000761524174 1119407270 /nfs/dbraw/zinc/40/72/70/1119407270.db2.gz WUYIQIZZAJZJCF-GOSISDBHSA-N 1 1 373.884 4.250 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCN(Cc3ccccc3)C2)cc1Cl ZINC000761524174 1119407273 /nfs/dbraw/zinc/40/72/73/1119407273.db2.gz WUYIQIZZAJZJCF-GOSISDBHSA-N 1 1 373.884 4.250 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccccc2OC(F)(F)F)cc1Cl ZINC000761522238 1119409270 /nfs/dbraw/zinc/40/92/70/1119409270.db2.gz NDMNPNXCFYNDHW-UHFFFAOYSA-N 1 1 360.719 4.437 20 5 FIBDMO CCC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000493240668 1119431680 /nfs/dbraw/zinc/43/16/80/1119431680.db2.gz WLXFCBWRYBZCJN-JCURWCKSSA-N 1 1 352.862 4.274 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000494294354 1119822635 /nfs/dbraw/zinc/82/26/35/1119822635.db2.gz YQZRLWOHZGEFGK-RVDMUPIBSA-N 1 1 364.405 4.180 20 5 FIBDMO C/C(=C\c1ccccc1)C[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000494294354 1119822639 /nfs/dbraw/zinc/82/26/39/1119822639.db2.gz YQZRLWOHZGEFGK-RVDMUPIBSA-N 1 1 364.405 4.180 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000192356497 1120057442 /nfs/dbraw/zinc/05/74/42/1120057442.db2.gz KMVORQFVAHOIJW-SFHVURJKSA-N 1 1 356.422 4.255 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Br)c(F)c1 ZINC000089512391 1120898576 /nfs/dbraw/zinc/89/85/76/1120898576.db2.gz SWYRPFOVFOHMOJ-SNVBAGLBSA-N 1 1 353.191 4.347 20 5 FIBDMO COC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000089511996 1120898615 /nfs/dbraw/zinc/89/86/15/1120898615.db2.gz YSSLGYBPWUQDDA-OAHLLOKOSA-N 1 1 354.328 4.091 20 5 FIBDMO Cc1ccc(Sc2ccc(CNC[C@H](C)[NH+](C)C)cc2[N+](=O)[O-])cc1 ZINC000609223282 1121013370 /nfs/dbraw/zinc/01/33/70/1121013370.db2.gz FCSJNNXISWVNQM-HNNXBMFYSA-N 1 1 359.495 4.094 20 5 FIBDMO Cc1c(C[NH2+]Cc2cc(Cl)ccc2OC(F)F)cccc1[N+](=O)[O-] ZINC000326358244 1121095133 /nfs/dbraw/zinc/09/51/33/1121095133.db2.gz GQBVNZVLQZUEBS-UHFFFAOYSA-N 1 1 356.756 4.448 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccn(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-] ZINC000090943875 1121162250 /nfs/dbraw/zinc/16/22/50/1121162250.db2.gz CMJHNTROKPMVLH-AWEZNQCLSA-N 1 1 354.385 4.079 20 5 FIBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000130653076 1121564723 /nfs/dbraw/zinc/56/47/23/1121564723.db2.gz GBUMIEQOIKCNRX-KRWDZBQOSA-N 1 1 358.442 4.059 20 5 FIBDMO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000130653076 1121564733 /nfs/dbraw/zinc/56/47/33/1121564733.db2.gz GBUMIEQOIKCNRX-KRWDZBQOSA-N 1 1 358.442 4.059 20 5 FIBDMO COc1cc(NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301450349 1122027757 /nfs/dbraw/zinc/02/77/57/1122027757.db2.gz XDUICTQNRPQRJF-UGSOOPFHSA-N 1 1 361.467 4.160 20 5 FIBDMO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000917082345 1122082261 /nfs/dbraw/zinc/08/22/61/1122082261.db2.gz QGLPCCVKSHJELP-VHSXEESVSA-N 1 1 363.767 4.306 20 5 FIBDMO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)cc1[N+](=O)[O-] ZINC000765818929 1122148471 /nfs/dbraw/zinc/14/84/71/1122148471.db2.gz GVSPZXFJJQHWMZ-RHSMWYFYSA-N 1 1 372.469 4.499 20 5 FIBDMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000301560064 1122219963 /nfs/dbraw/zinc/21/99/63/1122219963.db2.gz UJOJRTFYPFPQCS-SKDRFNHKSA-N 1 1 365.783 4.043 20 5 FIBDMO COc1ccc(-c2ccc(C[N@@H+](C)CCC3CCOCC3)o2)c([N+](=O)[O-])c1 ZINC000129661053 1122660060 /nfs/dbraw/zinc/66/00/60/1122660060.db2.gz PNHJPWMLLNDNOV-UHFFFAOYSA-N 1 1 374.437 4.112 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000556119091 1122669719 /nfs/dbraw/zinc/66/97/19/1122669719.db2.gz ORJUNGUSBAPFCH-LDQXTDLNSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000556119091 1122669727 /nfs/dbraw/zinc/66/97/27/1122669727.db2.gz ORJUNGUSBAPFCH-LDQXTDLNSA-N 1 1 353.466 4.389 20 5 FIBDMO CO[C@H]1CC[NH2+][C@H](c2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001212240822 1123006375 /nfs/dbraw/zinc/00/63/75/1123006375.db2.gz CRRUKGLOATWNSG-YWZLYKJASA-N 1 1 359.429 4.483 20 5 FIBDMO CCC[C@@]1(COC)CCC[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000194923928 1123011789 /nfs/dbraw/zinc/01/17/89/1123011789.db2.gz UVMAJMMISOCUQX-FQEVSTJZSA-N 1 1 373.453 4.073 20 5 FIBDMO CC[NH+](CC)[C@@H](C(=O)OCc1ccc([N+](=O)[O-])c(C)c1)c1ccccc1 ZINC001127500891 1123022974 /nfs/dbraw/zinc/02/29/74/1123022974.db2.gz PNXNCFSPOIVQKB-LJQANCHMSA-N 1 1 356.422 4.030 20 5 FIBDMO CC[C@@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133748 1123160462 /nfs/dbraw/zinc/16/04/62/1123160462.db2.gz UTMQWPPVFSNRLV-WIYYLYMNSA-N 1 1 353.466 4.158 20 5 FIBDMO CC[C@@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133748 1123160467 /nfs/dbraw/zinc/16/04/67/1123160467.db2.gz UTMQWPPVFSNRLV-WIYYLYMNSA-N 1 1 353.466 4.158 20 5 FIBDMO CC[C@@H]([NH2+]C[C@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195133748 1123160483 /nfs/dbraw/zinc/16/04/83/1123160483.db2.gz UTMQWPPVFSNRLV-WIYYLYMNSA-N 1 1 353.466 4.158 20 5 FIBDMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)Nc1ccc(C2CCC2)c[nH+]1 ZINC000556958535 1123271922 /nfs/dbraw/zinc/27/19/22/1123271922.db2.gz GVGXCESUBLQXFV-CYBMUJFWSA-N 1 1 354.410 4.087 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1)C(C)C ZINC000195272091 1123404248 /nfs/dbraw/zinc/40/42/48/1123404248.db2.gz QYXNOMCKFAKFDN-UHFFFAOYSA-N 1 1 369.465 4.097 20 5 FIBDMO CC[C@H]1c2ccccc2CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000609625731 1123773475 /nfs/dbraw/zinc/77/34/75/1123773475.db2.gz VDYNMAWRLJEVDV-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO CC[C@H]1c2ccccc2CC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000609625731 1123773478 /nfs/dbraw/zinc/77/34/78/1123773478.db2.gz VDYNMAWRLJEVDV-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO COc1ccc(C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C2CC2)cc1 ZINC000064641733 1123889716 /nfs/dbraw/zinc/88/97/16/1123889716.db2.gz ZDGIHOAVURZMCI-INIZCTEOSA-N 1 1 370.449 4.283 20 5 FIBDMO Cn1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c(-c2cccs2)n1 ZINC000179695553 1124031843 /nfs/dbraw/zinc/03/18/43/1124031843.db2.gz FAIYWMUTLFHTNO-UHFFFAOYSA-N 1 1 368.462 4.221 20 5 FIBDMO Cn1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c(-c2cccs2)n1 ZINC000179695553 1124031847 /nfs/dbraw/zinc/03/18/47/1124031847.db2.gz FAIYWMUTLFHTNO-UHFFFAOYSA-N 1 1 368.462 4.221 20 5 FIBDMO COC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 ZINC000091413649 1124385258 /nfs/dbraw/zinc/38/52/58/1124385258.db2.gz LJCURUCQAWBVRP-SJKOYZFVSA-N 1 1 350.365 4.220 20 5 FIBDMO CC(C)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1 ZINC000428839618 1124526798 /nfs/dbraw/zinc/52/67/98/1124526798.db2.gz KPKYQHQYAJPBLK-MRXNPFEDSA-N 1 1 355.438 4.029 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000301647946 1124805954 /nfs/dbraw/zinc/80/59/54/1124805954.db2.gz FDMCAGMRANHKHA-CQSZACIVSA-N 1 1 366.893 4.124 20 5 FIBDMO O=[N+]([O-])c1cc(CNC[C@H]2CCCC[N@@H+](Cc3ccccc3)C2)cs1 ZINC000311135138 1125111723 /nfs/dbraw/zinc/11/17/23/1125111723.db2.gz KFWHQUWOZGQWJV-QGZVFWFLSA-N 1 1 359.495 4.048 20 5 FIBDMO COc1cccc2cc([C@H](C)[NH2+]Cc3cc([N+](=O)[O-])ccc3OC)oc21 ZINC000181695577 1125113203 /nfs/dbraw/zinc/11/32/03/1125113203.db2.gz PYCMOSKNMMNEGT-LBPRGKRZSA-N 1 1 356.378 4.209 20 5 FIBDMO C[C@H](c1ccc([S@](C)=O)cc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255197749 1125221469 /nfs/dbraw/zinc/22/14/69/1125221469.db2.gz ASYUBDWHJKSHSX-HRJOPBDGSA-N 1 1 358.463 4.038 20 5 FIBDMO C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311820349 1125228581 /nfs/dbraw/zinc/22/85/81/1125228581.db2.gz NDAOMRMOJOKZFD-SQGPQFPESA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311820349 1125228586 /nfs/dbraw/zinc/22/85/86/1125228586.db2.gz NDAOMRMOJOKZFD-SQGPQFPESA-N 1 1 353.466 4.156 20 5 FIBDMO O=[N+]([O-])c1ccc2nc(N[C@@H]3CCC[N@@H+](Cc4ccccc4)C3)ccc2c1 ZINC000312139475 1125273772 /nfs/dbraw/zinc/27/37/72/1125273772.db2.gz LMHDHINARCKCJV-GOSISDBHSA-N 1 1 362.433 4.220 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312531589 1125399799 /nfs/dbraw/zinc/39/97/99/1125399799.db2.gz PSLQFZKLHDONTL-BBTUJRGHSA-N 1 1 367.493 4.464 20 5 FIBDMO Cc1ccc([C@H](C)N[C@@H](C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312531589 1125399806 /nfs/dbraw/zinc/39/98/06/1125399806.db2.gz PSLQFZKLHDONTL-BBTUJRGHSA-N 1 1 367.493 4.464 20 5 FIBDMO C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(F)F)c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000302035183 568119788 /nfs/dbraw/zinc/11/97/88/568119788.db2.gz FGEZMSAMLZOEJO-OLZOCXBDSA-N 1 1 369.412 4.261 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ncc(-c2ccccc2)n1C ZINC000453080014 568391791 /nfs/dbraw/zinc/39/17/91/568391791.db2.gz YONLSXPMWVPLPZ-LSDHHAIUSA-N 1 1 350.422 4.407 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3(c4ccc(Cl)cc4)CCC3)nc2c1 ZINC000570871864 568577067 /nfs/dbraw/zinc/57/70/67/568577067.db2.gz OPCXWIIUUHWDEB-UHFFFAOYSA-N 1 1 356.813 4.294 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000619531347 1125609030 /nfs/dbraw/zinc/60/90/30/1125609030.db2.gz QXDJHPDPOREKCC-GHTZIAJQSA-N 1 1 370.449 4.203 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2nc3ccccc3o2)C1 ZINC000619531693 1125609105 /nfs/dbraw/zinc/60/91/05/1125609105.db2.gz YCDREHZXFAZCGT-OAHLLOKOSA-N 1 1 367.405 4.124 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000163111647 1125650007 /nfs/dbraw/zinc/65/00/07/1125650007.db2.gz KVYSZXQHQITBEX-IRXDYDNUSA-N 1 1 374.485 4.022 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000619722885 1125669955 /nfs/dbraw/zinc/66/99/55/1125669955.db2.gz PYWJBCZYFFEFIG-RDJZCZTQSA-N 1 1 354.454 4.068 20 5 FIBDMO COc1cc(C[NH2+][C@H](C)c2ccsc2)c([N+](=O)[O-])cc1OCC(F)F ZINC000619782559 1125696074 /nfs/dbraw/zinc/69/60/74/1125696074.db2.gz CUGXCONWVHMQFK-SNVBAGLBSA-N 1 1 372.393 4.160 20 5 FIBDMO CC1(C)C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1c(F)cccc1[N+](=O)[O-] ZINC000619783844 1125696399 /nfs/dbraw/zinc/69/63/99/1125696399.db2.gz LVKJPVGRODWGHU-FQEVSTJZSA-N 1 1 371.456 4.124 20 5 FIBDMO CC(C)c1ccc(OC2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)cc1 ZINC001167049535 1079621924 /nfs/dbraw/zinc/62/19/24/1079621924.db2.gz OXLWTWIIRPZIKC-UHFFFAOYSA-N 1 1 355.438 4.157 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)o2)cc1 ZINC000535809810 1079809697 /nfs/dbraw/zinc/80/96/97/1079809697.db2.gz JUXGRVNFKIFBJB-DLBZAZTESA-N 1 1 356.422 4.103 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](Cc3ccco3)C3CCCC3)o2)cc1 ZINC000097475736 1080022264 /nfs/dbraw/zinc/02/22/64/1080022264.db2.gz DXSWJPQSPSFQSP-UHFFFAOYSA-N 1 1 368.393 4.183 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](Cc3ccco3)C3CCCC3)o2)cc1 ZINC000097475736 1080022273 /nfs/dbraw/zinc/02/22/73/1080022273.db2.gz DXSWJPQSPSFQSP-UHFFFAOYSA-N 1 1 368.393 4.183 20 5 FIBDMO Cc1c(C(=O)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cccc1[N+](=O)[O-] ZINC000157646606 1080051053 /nfs/dbraw/zinc/05/10/53/1080051053.db2.gz NXPABBGTCVAUAU-MRXNPFEDSA-N 1 1 373.497 4.020 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000118787571 1080056091 /nfs/dbraw/zinc/05/60/91/1080056091.db2.gz YKEIOUDSYVNRMJ-IRXDYDNUSA-N 1 1 374.485 4.022 20 5 FIBDMO Cc1c(C[NH+]2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cccc1[N+](=O)[O-] ZINC000076182404 1080425908 /nfs/dbraw/zinc/42/59/08/1080425908.db2.gz POTIQIJRCWANEA-QWRGUYRKSA-N 1 1 356.266 4.076 20 5 FIBDMO CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000109407174 1080438683 /nfs/dbraw/zinc/43/86/83/1080438683.db2.gz BVZQDYOXHUBILL-KRWDZBQOSA-N 1 1 361.489 4.238 20 5 FIBDMO CCN1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000247090580 1080778342 /nfs/dbraw/zinc/77/83/42/1080778342.db2.gz PJGSUIDEKXGAAP-CABCVRRESA-N 1 1 359.495 4.316 20 5 FIBDMO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000247090580 1080778349 /nfs/dbraw/zinc/77/83/49/1080778349.db2.gz PJGSUIDEKXGAAP-CABCVRRESA-N 1 1 359.495 4.316 20 5 FIBDMO CC[N@H+]1CC[C@@H](CN[C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000247090580 1080778358 /nfs/dbraw/zinc/77/83/58/1080778358.db2.gz PJGSUIDEKXGAAP-CABCVRRESA-N 1 1 359.495 4.316 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(CNCCCCC[NH+]3CCCC3)cs2)c1 ZINC000559326934 1080793142 /nfs/dbraw/zinc/79/31/42/1080793142.db2.gz SNNVLKYPCRIYNC-UHFFFAOYSA-N 1 1 374.510 4.074 20 5 FIBDMO COc1ccccc1C[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC001167233156 1080881346 /nfs/dbraw/zinc/88/13/46/1080881346.db2.gz CTKFIKCVPPVWRB-INIZCTEOSA-N 1 1 360.841 4.464 20 5 FIBDMO O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H]3Cc3ccc(F)cc3)nc2c1 ZINC000083169073 1081267590 /nfs/dbraw/zinc/26/75/90/1081267590.db2.gz BJFRFINUERWDOP-OAHLLOKOSA-N 1 1 355.369 4.082 20 5 FIBDMO Cn1cncc1C[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000578940175 1081345968 /nfs/dbraw/zinc/34/59/68/1081345968.db2.gz IQHZYUPBMOBXAR-UHFFFAOYSA-N 1 1 372.812 4.064 20 5 FIBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001167331820 1081451480 /nfs/dbraw/zinc/45/14/80/1081451480.db2.gz ATXLVVNPLRXNLZ-IBGZPJMESA-N 1 1 356.422 4.209 20 5 FIBDMO CN(C)c1cccc([C@@H]2CCC[N@@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000083198690 1081547065 /nfs/dbraw/zinc/54/70/65/1081547065.db2.gz KAGMLDJAOVNRDI-SFHVURJKSA-N 1 1 366.421 4.139 20 5 FIBDMO CN(C)c1cccc([C@@H]2CCC[N@H+]2Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000083198690 1081547067 /nfs/dbraw/zinc/54/70/67/1081547067.db2.gz KAGMLDJAOVNRDI-SFHVURJKSA-N 1 1 366.421 4.139 20 5 FIBDMO CC[C@@H](C)[C@@H](C)[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC001167356323 1081617576 /nfs/dbraw/zinc/61/75/76/1081617576.db2.gz MCIKWTDSHBZCIQ-VXGBXAGGSA-N 1 1 353.850 4.086 20 5 FIBDMO Cc1c(CN[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000379652730 1081842245 /nfs/dbraw/zinc/84/22/45/1081842245.db2.gz XUNUPXPIQXZDGJ-UZLBHIALSA-N 1 1 353.466 4.046 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cnn(Cc3ccccc3)c2)C2CC2)c1 ZINC000536637825 1081909634 /nfs/dbraw/zinc/90/96/34/1081909634.db2.gz PNKGGNZXPLFSFW-UHFFFAOYSA-N 1 1 362.433 4.004 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cnn(Cc3ccccc3)c2)C2CC2)c1 ZINC000536637825 1081909640 /nfs/dbraw/zinc/90/96/40/1081909640.db2.gz PNKGGNZXPLFSFW-UHFFFAOYSA-N 1 1 362.433 4.004 20 5 FIBDMO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)c2ncccc12 ZINC000380205117 1082100462 /nfs/dbraw/zinc/10/04/62/1082100462.db2.gz GRVXJIWNJWRBNH-QGZVFWFLSA-N 1 1 362.433 4.077 20 5 FIBDMO CN(C)c1nc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cs1 ZINC000610468015 1082219966 /nfs/dbraw/zinc/21/99/66/1082219966.db2.gz CMFAYEWVKGLMLJ-UHFFFAOYSA-N 1 1 374.491 4.136 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510418537 1082544655 /nfs/dbraw/zinc/54/46/55/1082544655.db2.gz XIWNBPLKAFEADA-MRXNPFEDSA-N 1 1 356.813 4.045 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510418537 1082544658 /nfs/dbraw/zinc/54/46/58/1082544658.db2.gz XIWNBPLKAFEADA-MRXNPFEDSA-N 1 1 356.813 4.045 20 5 FIBDMO Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC001167464448 1082593663 /nfs/dbraw/zinc/59/36/63/1082593663.db2.gz MAFZDWSPNGDUFQ-YESZJQIVSA-N 1 1 367.449 4.108 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000477389167 1082833427 /nfs/dbraw/zinc/83/34/27/1082833427.db2.gz DYZYQCHOVHCAIJ-UHFFFAOYSA-N 1 1 366.339 4.401 20 5 FIBDMO COc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cc1OC ZINC000051283940 1082992311 /nfs/dbraw/zinc/99/23/11/1082992311.db2.gz QILSZZDIKOHGBD-MRXNPFEDSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1ccc([C@H]2CCC[N@H+]2Cc2cc(F)ccc2[N+](=O)[O-])cc1OC ZINC000051283940 1082992314 /nfs/dbraw/zinc/99/23/14/1082992314.db2.gz QILSZZDIKOHGBD-MRXNPFEDSA-N 1 1 360.385 4.088 20 5 FIBDMO COc1ccc2c(c1)CCC[C@H]2[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610581560 1083206991 /nfs/dbraw/zinc/20/69/91/1083206991.db2.gz SRXLOHBYTYSRCO-GOSISDBHSA-N 1 1 367.405 4.254 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000610604867 1083260508 /nfs/dbraw/zinc/26/05/08/1083260508.db2.gz QEPXNZDZEVIXHO-FBIMIBRVSA-N 1 1 356.266 4.328 20 5 FIBDMO Cc1ccc2[nH]c([C@H]3CCC[N@@H+](Cc4ccccc4[N+](=O)[O-])C3)nc2c1 ZINC000535666916 1083503820 /nfs/dbraw/zinc/50/38/20/1083503820.db2.gz VFRLVTXUSVMWDU-INIZCTEOSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@H]3CCC[N@H+](Cc4ccccc4[N+](=O)[O-])C3)[nH]c2c1 ZINC000535666916 1083503825 /nfs/dbraw/zinc/50/38/25/1083503825.db2.gz VFRLVTXUSVMWDU-INIZCTEOSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@H]3CCC[N@@H+](Cc4ccccc4[N+](=O)[O-])C3)[nH]c2c1 ZINC000535666916 1083503830 /nfs/dbraw/zinc/50/38/30/1083503830.db2.gz VFRLVTXUSVMWDU-INIZCTEOSA-N 1 1 350.422 4.159 20 5 FIBDMO CC(C)[C@@H]1c2ccccc2CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610788003 1083517907 /nfs/dbraw/zinc/51/79/07/1083517907.db2.gz DKPRPWRDHNKCNW-HXUWFJFHSA-N 1 1 368.433 4.217 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CCOCC4(CCCC4)C3)cs2)c1 ZINC000614253600 1083580665 /nfs/dbraw/zinc/58/06/65/1083580665.db2.gz RVDFINNNUAXOPR-UHFFFAOYSA-N 1 1 373.478 4.111 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3CCOCC4(CCCC4)C3)cs2)c1 ZINC000614253600 1083580676 /nfs/dbraw/zinc/58/06/76/1083580676.db2.gz RVDFINNNUAXOPR-UHFFFAOYSA-N 1 1 373.478 4.111 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH+]1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 ZINC000612578853 1083924353 /nfs/dbraw/zinc/92/43/53/1083924353.db2.gz XATIFXQHMIYBDN-VXGBXAGGSA-N 1 1 356.266 4.076 20 5 FIBDMO CC(C)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000071956741 1084366300 /nfs/dbraw/zinc/36/63/00/1084366300.db2.gz HXXWPMFVZBEEPE-UHFFFAOYSA-N 1 1 361.829 4.097 20 5 FIBDMO CC(C)[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000071956741 1084366309 /nfs/dbraw/zinc/36/63/09/1084366309.db2.gz HXXWPMFVZBEEPE-UHFFFAOYSA-N 1 1 361.829 4.097 20 5 FIBDMO COc1cccc([C@H](C)[NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c1 ZINC000539229266 1084419319 /nfs/dbraw/zinc/41/93/19/1084419319.db2.gz LIMFPOYTUWDKAK-ZDUSSCGKSA-N 1 1 353.378 4.109 20 5 FIBDMO Cc1cc([C@H](C)[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])c(C)o1 ZINC000162160630 1084484159 /nfs/dbraw/zinc/48/41/59/1084484159.db2.gz SOEKVAUFJSTLRR-JTQLQIEISA-N 1 1 353.216 4.418 20 5 FIBDMO COc1ccc([C@H](CN(C)C)[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000551226112 1084577663 /nfs/dbraw/zinc/57/76/63/1084577663.db2.gz DXIYZBWFRWELQZ-FQEVSTJZSA-N 1 1 371.481 4.119 20 5 FIBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2ccsc2)n1 ZINC000511068300 1084584410 /nfs/dbraw/zinc/58/44/10/1084584410.db2.gz ZHHLEDLEMLILEA-UHFFFAOYSA-N 1 1 359.476 4.454 20 5 FIBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1csc(-c2ccsc2)n1 ZINC000511068300 1084584417 /nfs/dbraw/zinc/58/44/17/1084584417.db2.gz ZHHLEDLEMLILEA-UHFFFAOYSA-N 1 1 359.476 4.454 20 5 FIBDMO COc1cc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1F ZINC000551422314 1084648704 /nfs/dbraw/zinc/64/87/04/1084648704.db2.gz AGABLUKRODUMFO-UHFFFAOYSA-N 1 1 352.793 4.421 20 5 FIBDMO C[C@H](c1cccs1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1 ZINC000478426344 1084950818 /nfs/dbraw/zinc/95/08/18/1084950818.db2.gz JQLOXPMYAXWKAA-OAHLLOKOSA-N 1 1 356.451 4.116 20 5 FIBDMO Cc1c(C[NH2+][C@H](c2ccc(F)cc2)c2cccnc2)cccc1[N+](=O)[O-] ZINC000478491904 1084953607 /nfs/dbraw/zinc/95/36/07/1084953607.db2.gz PPPLQAJONIRTQL-HXUWFJFHSA-N 1 1 351.381 4.317 20 5 FIBDMO C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCc2ccccc21 ZINC000170908230 1084979374 /nfs/dbraw/zinc/97/93/74/1084979374.db2.gz NXSHGZKZUVRAKO-LJQANCHMSA-N 1 1 363.417 4.412 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+][C@H]2c3ccc(F)cc3O[C@H]2C)cc1[N+](=O)[O-] ZINC000562059936 1085054298 /nfs/dbraw/zinc/05/42/98/1085054298.db2.gz RMVDYYWYPZLKDD-SYTFOFBDSA-N 1 1 360.385 4.305 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC=C(c4ccco4)C3)o2)c1 ZINC000511142410 1085079754 /nfs/dbraw/zinc/07/97/54/1085079754.db2.gz OFHXOVVWJLNRGT-UHFFFAOYSA-N 1 1 365.389 4.175 20 5 FIBDMO COc1cc(C[N@H+](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000053781445 1085286985 /nfs/dbraw/zinc/28/69/85/1085286985.db2.gz NFNKALPCNHBDQL-GFCCVEGCSA-N 1 1 366.364 4.398 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F ZINC000053781445 1085286992 /nfs/dbraw/zinc/28/69/92/1085286992.db2.gz NFNKALPCNHBDQL-GFCCVEGCSA-N 1 1 366.364 4.398 20 5 FIBDMO C[C@@H](NC1CC[NH+]([C@@H](C)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000178656927 1085682735 /nfs/dbraw/zinc/68/27/35/1085682735.db2.gz JHGGDSXWLBDKIP-SJORKVTESA-N 1 1 353.466 4.471 20 5 FIBDMO COc1cc(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000078338370 1085712539 /nfs/dbraw/zinc/71/25/39/1085712539.db2.gz XDUICTQNRPQRJF-SCLBCKFNSA-N 1 1 361.467 4.160 20 5 FIBDMO C[C@@H](c1cccc(O)c1)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000112599078 1085943223 /nfs/dbraw/zinc/94/32/23/1085943223.db2.gz DZYLXLOCNXDPGS-AWEZNQCLSA-N 1 1 367.405 4.191 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccccc1OC(F)(F)F ZINC000178728449 1085966290 /nfs/dbraw/zinc/96/62/90/1085966290.db2.gz VZLBELPTTWAMSA-NSHDSACASA-N 1 1 370.327 4.353 20 5 FIBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC001167799442 1086430736 /nfs/dbraw/zinc/43/07/36/1086430736.db2.gz ZNUXSCVFMIAPKH-IUODEOHRSA-N 1 1 353.850 4.087 20 5 FIBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052212656 1086451352 /nfs/dbraw/zinc/45/13/52/1086451352.db2.gz CNDAKQILZNSJCK-LJQANCHMSA-N 1 1 354.406 4.107 20 5 FIBDMO CC[N@@H+](Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2NC)cc1)C(C)C ZINC000583323905 1086560851 /nfs/dbraw/zinc/56/08/51/1086560851.db2.gz GEAQOEAWZCSNCA-UHFFFAOYSA-N 1 1 370.453 4.119 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@]4(C3)CCCOC4)s2)cc1 ZINC000585767996 1086694363 /nfs/dbraw/zinc/69/43/63/1086694363.db2.gz QEYDGPOESNMCMC-IBGZPJMESA-N 1 1 358.463 4.326 20 5 FIBDMO CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000583757470 1086949220 /nfs/dbraw/zinc/94/92/20/1086949220.db2.gz RXJPZRXVTMTXAV-OAHLLOKOSA-N 1 1 371.485 4.106 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000708576779 1087594865 /nfs/dbraw/zinc/59/48/65/1087594865.db2.gz INBGQUZVWCOONE-GDBMZVCRSA-N 1 1 359.857 4.428 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc([C@@H]3CCC[N@@H+](Cc4ccccc4)C3)n2)c1 ZINC000504969838 1088014934 /nfs/dbraw/zinc/01/49/34/1088014934.db2.gz SKIBHDPTFZUNGD-QGZVFWFLSA-N 1 1 364.405 4.024 20 5 FIBDMO COc1cnccc1[C@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000189566984 1088492675 /nfs/dbraw/zinc/49/26/75/1088492675.db2.gz JKVNSFYVVWVRCQ-ZDUSSCGKSA-N 1 1 353.378 4.109 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCO[C@H](CF)C3)o2)c(Cl)c1 ZINC000414475616 1088690625 /nfs/dbraw/zinc/69/06/25/1088690625.db2.gz HJTVOHKWECDARF-CQSZACIVSA-N 1 1 368.792 4.069 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3nnc(C4CC4)s3)s2)cc1 ZINC000414556184 1088824656 /nfs/dbraw/zinc/82/46/56/1088824656.db2.gz NXJDIPXDUVXAGG-UHFFFAOYSA-N 1 1 372.475 4.342 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H](c1ccc(F)cc1)C(C)C ZINC000434623076 1088844491 /nfs/dbraw/zinc/84/44/91/1088844491.db2.gz JMNZWKWZLNCIEB-FQEVSTJZSA-N 1 1 373.428 4.310 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000434660295 1088923772 /nfs/dbraw/zinc/92/37/72/1088923772.db2.gz BXNQUZITAQYBTM-UHFFFAOYSA-N 1 1 373.840 4.160 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccc(Cl)cc1)C1CC1 ZINC000434660295 1088923773 /nfs/dbraw/zinc/92/37/73/1088923773.db2.gz BXNQUZITAQYBTM-UHFFFAOYSA-N 1 1 373.840 4.160 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccccc1C(C)(C)C ZINC000549157855 1089059250 /nfs/dbraw/zinc/05/92/50/1089059250.db2.gz QXGGQDWDWDMCGN-UHFFFAOYSA-N 1 1 369.465 4.005 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccccc1C(C)(C)C ZINC000549157855 1089059265 /nfs/dbraw/zinc/05/92/65/1089059265.db2.gz QXGGQDWDWDMCGN-UHFFFAOYSA-N 1 1 369.465 4.005 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](c3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000434901353 1089118999 /nfs/dbraw/zinc/11/89/99/1089118999.db2.gz VDGKKKVSTCGSAF-SJLPKXTDSA-N 1 1 367.449 4.110 20 5 FIBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1sccc1Br ZINC000549174345 1089129593 /nfs/dbraw/zinc/12/95/93/1089129593.db2.gz XLUQGZSLPQMMHU-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1sccc1Br ZINC000549174345 1089129597 /nfs/dbraw/zinc/12/95/97/1089129597.db2.gz XLUQGZSLPQMMHU-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2Cn2cnc3ccccc32)c(Cl)c1 ZINC000541118846 1089245205 /nfs/dbraw/zinc/24/52/05/1089245205.db2.gz XZPJIRSYLJDJLB-INIZCTEOSA-N 1 1 370.840 4.263 20 5 FIBDMO C[C@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000514894151 1089568509 /nfs/dbraw/zinc/56/85/09/1089568509.db2.gz OVNRPDPMSIRTQU-QWHCGFSZSA-N 1 1 368.462 4.255 20 5 FIBDMO Cc1c([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 ZINC000101595789 1089806703 /nfs/dbraw/zinc/80/67/03/1089806703.db2.gz JFZSCVNQFPTDLS-CYBMUJFWSA-N 1 1 354.385 4.079 20 5 FIBDMO C[NH+](C)Cc1cc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000412317909 1090052059 /nfs/dbraw/zinc/05/20/59/1090052059.db2.gz PFELIERHOPWTAS-DLBZAZTESA-N 1 1 373.840 4.052 20 5 FIBDMO Cn1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C2CCCCC2)n1 ZINC000549411114 1090269750 /nfs/dbraw/zinc/26/97/50/1090269750.db2.gz WIIZQUTZRQZPIR-UHFFFAOYSA-N 1 1 356.470 4.051 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccn(-c3ccccc3)n1)CCCC2 ZINC000417340017 1090820321 /nfs/dbraw/zinc/82/03/21/1090820321.db2.gz LRQSTLAAHITFOE-NRFANRHFSA-N 1 1 362.433 4.338 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000511628228 1090890921 /nfs/dbraw/zinc/89/09/21/1090890921.db2.gz XZGFHJUSPVYLNN-SFHVURJKSA-N 1 1 373.840 4.332 20 5 FIBDMO O=C(CC[N@H+]1CCCC[C@H]1c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000500070173 1091019198 /nfs/dbraw/zinc/01/91/98/1091019198.db2.gz OAUDOWWDACGLPQ-SFHVURJKSA-N 1 1 371.412 4.290 20 5 FIBDMO Cc1ccccc1[C@H]1C[C@H](C)[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000500119715 1091051773 /nfs/dbraw/zinc/05/17/73/1091051773.db2.gz AHNOCBSTDMBEJI-IRXDYDNUSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000584569562 1091286783 /nfs/dbraw/zinc/28/67/83/1091286783.db2.gz MYUKYPXHNGDJSU-INIZCTEOSA-N 1 1 369.465 4.103 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)c(Cl)c1 ZINC000511764956 1091649632 /nfs/dbraw/zinc/64/96/32/1091649632.db2.gz KGZYDFJGWBDDSD-QWFCFKBJSA-N 1 1 372.852 4.253 20 5 FIBDMO Cc1ccc(C[NH2+][C@H](C)c2nc(-c3ccncc3)cs2)cc1[N+](=O)[O-] ZINC000124044312 1091663000 /nfs/dbraw/zinc/66/30/00/1091663000.db2.gz HHBCLOACTQBEPK-CYBMUJFWSA-N 1 1 354.435 4.273 20 5 FIBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000508315654 1092240540 /nfs/dbraw/zinc/24/05/40/1092240540.db2.gz VQKVQPRSJJVXQY-SJORKVTESA-N 1 1 361.489 4.238 20 5 FIBDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)C1 ZINC000500771237 1092547444 /nfs/dbraw/zinc/54/74/44/1092547444.db2.gz VDUAATCTZVVGPV-HNNXBMFYSA-N 1 1 353.422 4.079 20 5 FIBDMO CCc1ccc(C[N@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000015442607 1092620097 /nfs/dbraw/zinc/62/00/97/1092620097.db2.gz MDXKPQSDFNFVEH-CQSZACIVSA-N 1 1 366.421 4.400 20 5 FIBDMO CCc1ccc(C[N@@H+](C)[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000015442607 1092620104 /nfs/dbraw/zinc/62/01/04/1092620104.db2.gz MDXKPQSDFNFVEH-CQSZACIVSA-N 1 1 366.421 4.400 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1ccccc1[N+](=O)[O-] ZINC000279949712 1092656718 /nfs/dbraw/zinc/65/67/18/1092656718.db2.gz BPIFAOBRUHQVPN-MNOVXSKESA-N 1 1 350.216 4.164 20 5 FIBDMO CCOC(=O)C1CCC([N@@H+](CC)C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000549825583 1092858597 /nfs/dbraw/zinc/85/85/97/1092858597.db2.gz SRSNHSHHFVBUQO-DTQAZKPQSA-N 1 1 374.481 4.442 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Br)s1 ZINC000442992416 1092901012 /nfs/dbraw/zinc/90/10/12/1092901012.db2.gz NHNVXCLMIMUCIF-MRVPVSSYSA-N 1 1 359.220 4.409 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(-c2ccncc2)cc1F ZINC000521889420 1092966903 /nfs/dbraw/zinc/96/69/03/1092966903.db2.gz SRSKLBVRVMCFQG-UHFFFAOYSA-N 1 1 365.408 4.470 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(OCC(C)C)c1 ZINC000509624139 1093304066 /nfs/dbraw/zinc/30/40/66/1093304066.db2.gz ZUVCSBJZYXHBBZ-UHFFFAOYSA-N 1 1 358.438 4.318 20 5 FIBDMO Cc1cnc(C2CC[NH+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2)s1 ZINC000433170715 1093361836 /nfs/dbraw/zinc/36/18/36/1093361836.db2.gz YXEIAJBDBUIJTD-UHFFFAOYSA-N 1 1 351.859 4.393 20 5 FIBDMO O=[N+]([O-])c1ccccc1N1CCN(c2cc[nH+]c3cc(Cl)ccc32)CC1 ZINC000015167943 1093893991 /nfs/dbraw/zinc/89/39/91/1093893991.db2.gz WJMZBZGLWFVJSY-UHFFFAOYSA-N 1 1 368.824 4.123 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000513247246 1094029170 /nfs/dbraw/zinc/02/91/70/1094029170.db2.gz LWMQJUNXRNVZTQ-SCLBCKFNSA-N 1 1 373.840 4.270 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000513247246 1094029177 /nfs/dbraw/zinc/02/91/77/1094029177.db2.gz LWMQJUNXRNVZTQ-SCLBCKFNSA-N 1 1 373.840 4.270 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000513256246 1094039326 /nfs/dbraw/zinc/03/93/26/1094039326.db2.gz KQNPVTOAACKDIR-KBXCAEBGSA-N 1 1 364.405 4.228 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000513440869 1094127326 /nfs/dbraw/zinc/12/73/26/1094127326.db2.gz YLELTWYYFXKICZ-GPCFVJJQSA-N 1 1 352.390 4.174 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1c(F)cc(F)c(F)c1F ZINC000430016056 1094188383 /nfs/dbraw/zinc/18/83/83/1094188383.db2.gz DHMQSTNDLYWYCO-YHYXMXQVSA-N 1 1 354.303 4.344 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000115895727 1094289868 /nfs/dbraw/zinc/28/98/68/1094289868.db2.gz PYVRQAQIIFRFTG-QGZVFWFLSA-N 1 1 361.489 4.382 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000280187057 1094300974 /nfs/dbraw/zinc/30/09/74/1094300974.db2.gz SAOOCJATJXHQGI-MNOVXSKESA-N 1 1 350.216 4.164 20 5 FIBDMO CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC000501114063 1094514600 /nfs/dbraw/zinc/51/46/00/1094514600.db2.gz VKRYDEJHTPQTBP-UHFFFAOYSA-N 1 1 361.829 4.099 20 5 FIBDMO C[C@@H](Nc1nccc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000413252036 1094802838 /nfs/dbraw/zinc/80/28/38/1094802838.db2.gz YLGPJRSFTJMAFD-ZBFHGGJFSA-N 1 1 354.454 4.208 20 5 FIBDMO C[C@H]1C[C@H](c2ccccc2)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501845378 1094959659 /nfs/dbraw/zinc/95/96/59/1094959659.db2.gz WXJZFNOCGLKQDG-FUHWJXTLSA-N 1 1 367.449 4.192 20 5 FIBDMO CC(C)[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccsc1 ZINC000421016779 1095254072 /nfs/dbraw/zinc/25/40/72/1095254072.db2.gz VAEHPQIWJJKDAT-CQSZACIVSA-N 1 1 361.467 4.091 20 5 FIBDMO CC(C)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccsc1 ZINC000421016779 1095254091 /nfs/dbraw/zinc/25/40/91/1095254091.db2.gz VAEHPQIWJJKDAT-CQSZACIVSA-N 1 1 361.467 4.091 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCCC[C@H]3c3ccco3)n2)cc1 ZINC000121218289 1095604408 /nfs/dbraw/zinc/60/44/08/1095604408.db2.gz ATOBFPOJDNMYME-INIZCTEOSA-N 1 1 368.393 4.355 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCCC[C@H]3c3ccco3)n2)cc1 ZINC000121218289 1095604417 /nfs/dbraw/zinc/60/44/17/1095604417.db2.gz ATOBFPOJDNMYME-INIZCTEOSA-N 1 1 368.393 4.355 20 5 FIBDMO COc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2OC)cc1[N+](=O)[O-] ZINC000421826276 1095938970 /nfs/dbraw/zinc/93/89/70/1095938970.db2.gz RSBRHGLRWUCIJD-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO Cn1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c(-c2cccs2)n1 ZINC000183801191 1096197243 /nfs/dbraw/zinc/19/72/43/1096197243.db2.gz FCUWUUOOLOWRLE-UHFFFAOYSA-N 1 1 362.842 4.000 20 5 FIBDMO Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000183805387 1096204959 /nfs/dbraw/zinc/20/49/59/1096204959.db2.gz VNFPJZNTOGGYTG-UHFFFAOYSA-N 1 1 356.813 4.237 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](Cc1ccccc1)C(C)C ZINC000532915189 1098605708 /nfs/dbraw/zinc/60/57/08/1098605708.db2.gz SHLLKJHUYTTWTJ-UHFFFAOYSA-N 1 1 355.438 4.142 20 5 FIBDMO CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccc1 ZINC000533223273 1098888478 /nfs/dbraw/zinc/88/84/78/1098888478.db2.gz WSMYDGSZDDUZMM-UHFFFAOYSA-N 1 1 351.406 4.314 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3CCC[C@H]3C3CCCC3)o2)c1 ZINC000533251898 1098913971 /nfs/dbraw/zinc/91/39/71/1098913971.db2.gz APVSIEQTALSROH-SFHVURJKSA-N 1 1 355.438 4.447 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1C ZINC000533431980 1099051039 /nfs/dbraw/zinc/05/10/39/1099051039.db2.gz WQSZSDQDERGLNE-GOSISDBHSA-N 1 1 367.449 4.296 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@H+]2CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1C ZINC000533431980 1099051050 /nfs/dbraw/zinc/05/10/50/1099051050.db2.gz WQSZSDQDERGLNE-GOSISDBHSA-N 1 1 367.449 4.296 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)c2c(c1)COCO2 ZINC000505880411 1099308678 /nfs/dbraw/zinc/30/86/78/1099308678.db2.gz TYBTXSCPYSUKED-OLHLWXQYSA-N 1 1 366.417 4.139 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2/C=C\c2ccccc2)c2c(c1)COCO2 ZINC000505880411 1099308693 /nfs/dbraw/zinc/30/86/93/1099308693.db2.gz TYBTXSCPYSUKED-OLHLWXQYSA-N 1 1 366.417 4.139 20 5 FIBDMO CC(C)[N@@H+](C)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000505891710 1099371640 /nfs/dbraw/zinc/37/16/40/1099371640.db2.gz NUYNFVNARMXFET-UHFFFAOYSA-N 1 1 350.422 4.288 20 5 FIBDMO Cc1ccccc1C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000016585952 1099737645 /nfs/dbraw/zinc/73/76/45/1099737645.db2.gz WBTNFLNSDFABKR-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1ccccc1C[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000016585952 1099737651 /nfs/dbraw/zinc/73/76/51/1099737651.db2.gz WBTNFLNSDFABKR-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO COc1cc(C)c(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1OC ZINC000506045224 1099895195 /nfs/dbraw/zinc/89/51/95/1099895195.db2.gz AKLDEKKMANYFHS-VQHVLOKHSA-N 1 1 356.422 4.066 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2c[nH]nc2-c2ccsc2)C2CC2)cc1 ZINC000437577331 1099997631 /nfs/dbraw/zinc/99/76/31/1099997631.db2.gz LZENNQHGNWZFLM-UHFFFAOYSA-N 1 1 354.435 4.211 20 5 FIBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000536663262 1100136510 /nfs/dbraw/zinc/13/65/10/1100136510.db2.gz FHRYEUXOICMHFT-MRXNPFEDSA-N 1 1 373.522 4.487 20 5 FIBDMO CCC[N@@H+](C)C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000536664642 1100141286 /nfs/dbraw/zinc/14/12/86/1100141286.db2.gz RTOISPFQBNQYRK-MRXNPFEDSA-N 1 1 373.522 4.487 20 5 FIBDMO CCOc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc(Cl)c1O ZINC000459486704 1100219694 /nfs/dbraw/zinc/21/96/94/1100219694.db2.gz WNIABAJHCDIYGF-UHFFFAOYSA-N 1 1 371.220 4.296 20 5 FIBDMO COCC[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000517876852 1100752291 /nfs/dbraw/zinc/75/22/91/1100752291.db2.gz LDZWIMPTNAMYPH-UHFFFAOYSA-N 1 1 358.438 4.031 20 5 FIBDMO COCC[N@@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000517876852 1100752297 /nfs/dbraw/zinc/75/22/97/1100752297.db2.gz LDZWIMPTNAMYPH-UHFFFAOYSA-N 1 1 358.438 4.031 20 5 FIBDMO Cc1ccc(Sc2ccc(C[NH+]3CCC(CO)CC3)cc2[N+](=O)[O-])cc1 ZINC000506338080 1100879986 /nfs/dbraw/zinc/87/99/86/1100879986.db2.gz ABVXBHGLUVAVCZ-UHFFFAOYSA-N 1 1 372.490 4.259 20 5 FIBDMO C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518263604 1101048491 /nfs/dbraw/zinc/04/84/91/1101048491.db2.gz YWQMYBDFNYSNFW-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@@H](CN1CCC[C@@H](C)C1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518263604 1101048496 /nfs/dbraw/zinc/04/84/96/1101048496.db2.gz YWQMYBDFNYSNFW-CVEARBPZSA-N 1 1 357.454 4.065 20 5 FIBDMO CC(C)(C)c1nnc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]1 ZINC000459692608 1101329024 /nfs/dbraw/zinc/32/90/24/1101329024.db2.gz FDVXBODZIXRZCG-UHFFFAOYSA-N 1 1 371.466 4.029 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000439329200 1101351891 /nfs/dbraw/zinc/35/18/91/1101351891.db2.gz WYZXJRUBZHUELM-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000439329200 1101351902 /nfs/dbraw/zinc/35/19/02/1101351902.db2.gz WYZXJRUBZHUELM-WMZOPIPTSA-N 1 1 367.449 4.110 20 5 FIBDMO CC[NH+](CC)[C@@H](CNCc1ccc(C)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000518771758 1101534565 /nfs/dbraw/zinc/53/45/65/1101534565.db2.gz YDSNRVNBIJFUKY-NRFANRHFSA-N 1 1 371.481 4.085 20 5 FIBDMO CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000426512876 1101830855 /nfs/dbraw/zinc/83/08/55/1101830855.db2.gz DDHNJNNPHGVMSJ-KRWDZBQOSA-N 1 1 369.465 4.451 20 5 FIBDMO CCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1C ZINC000426512876 1101830873 /nfs/dbraw/zinc/83/08/73/1101830873.db2.gz DDHNJNNPHGVMSJ-KRWDZBQOSA-N 1 1 369.465 4.451 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+](Cc1cccs1)C[C@@H]1CCCO1 ZINC000506710823 1101863160 /nfs/dbraw/zinc/86/31/60/1101863160.db2.gz JZSFURWFVKYOFY-KNYPUDEUSA-N 1 1 358.463 4.351 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+](C)Cc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000026224953 1101944042 /nfs/dbraw/zinc/94/40/42/1101944042.db2.gz VBLYCYFZEQELCA-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)Cc1cccc(Cl)c1 ZINC000026226312 1101948361 /nfs/dbraw/zinc/94/83/61/1101948361.db2.gz XDHRLUJGQFOXSY-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO CCC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC(=O)Nc1ccccc1C ZINC000506773458 1102063805 /nfs/dbraw/zinc/06/38/05/1102063805.db2.gz DTCBSHGKJWNETH-FLIBITNWSA-N 1 1 367.449 4.267 20 5 FIBDMO CCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC(=O)Nc1ccccc1C ZINC000506773458 1102063820 /nfs/dbraw/zinc/06/38/20/1102063820.db2.gz DTCBSHGKJWNETH-FLIBITNWSA-N 1 1 367.449 4.267 20 5 FIBDMO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2c2ccsc2)cccc1[N+](=O)[O-] ZINC000052803856 1102330440 /nfs/dbraw/zinc/33/04/40/1102330440.db2.gz NHIYLNBAGXNDRT-QGZVFWFLSA-N 1 1 359.451 4.130 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](CN1CCCC1)c1ccccc1 ZINC000532451992 1102343767 /nfs/dbraw/zinc/34/37/67/1102343767.db2.gz CLBIYIMFMTUSSP-DYESRHJHSA-N 1 1 353.466 4.391 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]3C3CCCCC3)n2)cc1 ZINC000532474499 1102398919 /nfs/dbraw/zinc/39/89/19/1102398919.db2.gz RVCTVITYNVQSCT-QGZVFWFLSA-N 1 1 356.426 4.190 20 5 FIBDMO CC[C@@H](Cc1ccccc1)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000532586867 1102507075 /nfs/dbraw/zinc/50/70/75/1102507075.db2.gz YENBFVMFWNIRRQ-KRWDZBQOSA-N 1 1 366.421 4.098 20 5 FIBDMO Cc1cc(C[C@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)n[nH]1 ZINC000532627388 1102603726 /nfs/dbraw/zinc/60/37/26/1102603726.db2.gz NSKAENGSYXNNOG-LBPRGKRZSA-N 1 1 356.451 4.076 20 5 FIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000053279681 1102658346 /nfs/dbraw/zinc/65/83/46/1102658346.db2.gz MDXLNRKFZXZAGJ-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000507008468 1103031413 /nfs/dbraw/zinc/03/14/13/1103031413.db2.gz UCPXSOKTUMSEHW-RDJZCZTQSA-N 1 1 362.433 4.390 20 5 FIBDMO Cc1ccccc1[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000507166438 1103167869 /nfs/dbraw/zinc/16/78/69/1103167869.db2.gz WRHXDNYMBFVNAB-IAGOWNOFSA-N 1 1 367.449 4.028 20 5 FIBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000532768236 1103178485 /nfs/dbraw/zinc/17/84/85/1103178485.db2.gz HJRZPSLQHKOAAN-HNNXBMFYSA-N 1 1 373.840 4.099 20 5 FIBDMO O=C(Nc1ccccc1)[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000532768236 1103178494 /nfs/dbraw/zinc/17/84/94/1103178494.db2.gz HJRZPSLQHKOAAN-HNNXBMFYSA-N 1 1 373.840 4.099 20 5 FIBDMO CCOCc1cc(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1OC ZINC000507168979 1103187175 /nfs/dbraw/zinc/18/71/75/1103187175.db2.gz TZHDMLMSUINTNK-UHFFFAOYSA-N 1 1 370.449 4.305 20 5 FIBDMO CCOCc1cc(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1OC ZINC000507168979 1103187178 /nfs/dbraw/zinc/18/71/78/1103187178.db2.gz TZHDMLMSUINTNK-UHFFFAOYSA-N 1 1 370.449 4.305 20 5 FIBDMO Cc1cccc(-c2n[nH]cc2C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000507169945 1103189868 /nfs/dbraw/zinc/18/98/68/1103189868.db2.gz LGTMCGCEDDPWSD-UHFFFAOYSA-N 1 1 362.433 4.458 20 5 FIBDMO Cc1c([C@@H](C)[NH2+][C@H](CN2CCCC2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000120833369 1103373061 /nfs/dbraw/zinc/37/30/61/1103373061.db2.gz MFYDKJLCEHGJAB-YLJYHZDGSA-N 1 1 353.466 4.391 20 5 FIBDMO CCc1ccc(C[NH+]2CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)s1 ZINC000441409223 1104337077 /nfs/dbraw/zinc/33/70/77/1104337077.db2.gz ZKMJCRLGTNBUNG-OAHLLOKOSA-N 1 1 359.495 4.098 20 5 FIBDMO COc1ccc(C[N@@H+](C[C@H]2CCCO2)C2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000441457697 1104755298 /nfs/dbraw/zinc/75/52/98/1104755298.db2.gz ONZMUOXQFLLTHJ-VMWRSERWSA-N 1 1 362.470 4.163 20 5 FIBDMO C[N@@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCc2ccccc2C1 ZINC000536365865 1104819731 /nfs/dbraw/zinc/81/97/31/1104819731.db2.gz QNTPNSVDBSKCTJ-FQEVSTJZSA-N 1 1 363.417 4.239 20 5 FIBDMO CCc1ccc([C@H]([NH2+]C[C@H]2CCC(C)(C)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427957724 1105327715 /nfs/dbraw/zinc/32/77/15/1105327715.db2.gz LAQXVCIISQQLCG-IEBWSBKVSA-N 1 1 358.438 4.387 20 5 FIBDMO CCOc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1OC(F)F ZINC000168628253 1106749880 /nfs/dbraw/zinc/74/98/80/1106749880.db2.gz ZXNGXDRDCGCQTE-GFCCVEGCSA-N 1 1 366.364 4.446 20 5 FIBDMO COC(=O)c1cccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1Cl ZINC000451059900 1106912040 /nfs/dbraw/zinc/91/20/40/1106912040.db2.gz XNZWDDIMLFZJIL-UHFFFAOYSA-N 1 1 362.813 4.060 20 5 FIBDMO Cc1ccccc1CC[N@H+](C)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000451169901 1106957295 /nfs/dbraw/zinc/95/72/95/1106957295.db2.gz NHINZDJOANRWBK-HNNXBMFYSA-N 1 1 366.421 4.189 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3nc4cc(F)ccc4o3)C2)cc1 ZINC000451551727 1107171567 /nfs/dbraw/zinc/17/15/67/1107171567.db2.gz UWRIKKPQESXTTP-AWEZNQCLSA-N 1 1 355.369 4.255 20 5 FIBDMO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H](c1cccs1)C1(CO)CCC1 ZINC000452059459 1107454322 /nfs/dbraw/zinc/45/43/22/1107454322.db2.gz KMXCDAUJKQQLHQ-MRXNPFEDSA-N 1 1 366.870 4.303 20 5 FIBDMO CCOc1ccc(C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C(C)C)cc1 ZINC000444608106 1108017018 /nfs/dbraw/zinc/01/70/18/1108017018.db2.gz KMSRAEQUGNEKFB-UHFFFAOYSA-N 1 1 368.437 4.280 20 5 FIBDMO CCOc1ccc(C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C(C)C)cc1 ZINC000444608106 1108017030 /nfs/dbraw/zinc/01/70/30/1108017030.db2.gz KMSRAEQUGNEKFB-UHFFFAOYSA-N 1 1 368.437 4.280 20 5 FIBDMO CCOc1ccccc1[C@@H](CC)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444680885 1108082195 /nfs/dbraw/zinc/08/21/95/1108082195.db2.gz RJEYNRXFGBLPST-OAHLLOKOSA-N 1 1 354.410 4.111 20 5 FIBDMO CC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1nnc2n1CCCCC2 ZINC000531707977 1108087968 /nfs/dbraw/zinc/08/79/68/1108087968.db2.gz SFLOPTKGLSMSHR-RHSMWYFYSA-N 1 1 357.458 4.023 20 5 FIBDMO Cc1cc(C)cc(C[N@@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000444692932 1108094274 /nfs/dbraw/zinc/09/42/74/1108094274.db2.gz GABDWRDSJBKPDH-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO Cc1cc(C)cc(C[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC000444692932 1108094289 /nfs/dbraw/zinc/09/42/89/1108094289.db2.gz GABDWRDSJBKPDH-HNNXBMFYSA-N 1 1 366.421 4.455 20 5 FIBDMO CCC[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CC(C)(C)C(N)=O)C1 ZINC000453282836 1108360003 /nfs/dbraw/zinc/36/00/03/1108360003.db2.gz OIRVTEFUUOPZHJ-MAUKXSAKSA-N 1 1 361.486 4.050 20 5 FIBDMO O=[N+]([O-])c1ccccc1CN1CC[C@H]2[C@@H](CCC[N@H+]2Cc2ccccc2)C1 ZINC000532244182 1108733453 /nfs/dbraw/zinc/73/34/53/1108733453.db2.gz XIRHIXTVWMNIEQ-FPOVZHCZSA-N 1 1 365.477 4.081 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCCC2(CCCC2)C1 ZINC000445840154 1109009031 /nfs/dbraw/zinc/00/90/31/1109009031.db2.gz HMXAPAYVSMQIBO-ZDUSSCGKSA-N 1 1 365.861 4.231 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCCC2(CCCC2)C1 ZINC000445840154 1109009037 /nfs/dbraw/zinc/00/90/37/1109009037.db2.gz HMXAPAYVSMQIBO-ZDUSSCGKSA-N 1 1 365.861 4.231 20 5 FIBDMO CCc1cc(C[NH2+]Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)on1 ZINC000524948465 1109217979 /nfs/dbraw/zinc/21/79/79/1109217979.db2.gz JQWAGIMYRPEQKE-UHFFFAOYSA-N 1 1 366.421 4.203 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc(Cl)c(Cl)c3)nc2c1 ZINC000446850061 1109357900 /nfs/dbraw/zinc/35/79/00/1109357900.db2.gz VATITWQPGPJFRP-UHFFFAOYSA-N 1 1 351.193 4.068 20 5 FIBDMO C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@@H]1c1ccccc1 ZINC000525639667 1109465290 /nfs/dbraw/zinc/46/52/90/1109465290.db2.gz VWXGQLQMRITJBT-YWZLYKJASA-N 1 1 368.433 4.087 20 5 FIBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000447402687 1109534687 /nfs/dbraw/zinc/53/46/87/1109534687.db2.gz ADLCOLMDZAAQDR-OAHLLOKOSA-N 1 1 366.421 4.016 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H](CN1CCCC1)c1ccccc1)CCC2 ZINC000447534034 1109570221 /nfs/dbraw/zinc/57/02/21/1109570221.db2.gz ZJVOOHDAIKQWEB-FGZHOGPDSA-N 1 1 365.477 4.399 20 5 FIBDMO CCOc1ccc([C@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)cc1[N+](=O)[O-] ZINC000447557629 1109580468 /nfs/dbraw/zinc/58/04/68/1109580468.db2.gz MUNWMPUMPGKHKR-AWEZNQCLSA-N 1 1 355.438 4.118 20 5 FIBDMO C[C@H](C(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000527270835 1109728758 /nfs/dbraw/zinc/72/87/58/1109728758.db2.gz LKSJGEIYVKIAAD-LBPRGKRZSA-N 1 1 361.829 4.052 20 5 FIBDMO C[C@H](c1cccc(N[C@@H](C)Cc2ccccc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000449053669 1109969389 /nfs/dbraw/zinc/96/93/89/1109969389.db2.gz LLVBZYZKPMVNPS-DLBZAZTESA-N 1 1 369.465 4.031 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cnc(C(F)(F)F)s3)C2)cc1 ZINC000449504790 1110094654 /nfs/dbraw/zinc/09/46/54/1110094654.db2.gz WBFBRJRXMNRFNV-LBPRGKRZSA-N 1 1 371.384 4.450 20 5 FIBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3cnc(C(F)(F)F)s3)C2)cc1 ZINC000449504790 1110094658 /nfs/dbraw/zinc/09/46/58/1110094658.db2.gz WBFBRJRXMNRFNV-LBPRGKRZSA-N 1 1 371.384 4.450 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[N@H+]3C[C@@H](C4CC4)[C@H]3C3CC3)cs2)c1 ZINC000449536465 1110103388 /nfs/dbraw/zinc/10/33/88/1110103388.db2.gz IOFDSMRBSCGGIP-ZWKOTPCHSA-N 1 1 355.463 4.339 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccn(CCc3ccccc3)n2)cc1[N+](=O)[O-] ZINC000450690259 1110330857 /nfs/dbraw/zinc/33/08/57/1110330857.db2.gz YPSZXZRBQKLMBC-KRWDZBQOSA-N 1 1 364.449 4.193 20 5 FIBDMO C[C@@H]1C[N@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCCO1 ZINC000538740384 1111273563 /nfs/dbraw/zinc/27/35/63/1111273563.db2.gz KPZORINNOFEZIX-CQSZACIVSA-N 1 1 360.385 4.137 20 5 FIBDMO C[C@@H]1C[N@@H+](Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCCO1 ZINC000538740384 1111273568 /nfs/dbraw/zinc/27/35/68/1111273568.db2.gz KPZORINNOFEZIX-CQSZACIVSA-N 1 1 360.385 4.137 20 5 FIBDMO Cc1c[nH+]cn1C1CCN(c2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000461961159 1111441776 /nfs/dbraw/zinc/44/17/76/1111441776.db2.gz WSJHZBFPERVFOV-UHFFFAOYSA-N 1 1 368.359 4.268 20 5 FIBDMO C[C@H](CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000552048926 1111557481 /nfs/dbraw/zinc/55/74/81/1111557481.db2.gz DCOUHQISXOOXMT-OXQOHEQNSA-N 1 1 364.449 4.201 20 5 FIBDMO CC(C)n1cc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)cn1 ZINC000555424574 1112833937 /nfs/dbraw/zinc/83/39/37/1112833937.db2.gz LDOYTHHCHTZCQO-LLVKDONJSA-N 1 1 356.348 4.242 20 5 FIBDMO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@@H]1CCCO1 ZINC000482301913 1113220135 /nfs/dbraw/zinc/22/01/35/1113220135.db2.gz ADDMYTIANZLOHH-KRWDZBQOSA-N 1 1 360.385 4.137 20 5 FIBDMO Cn1cc(C[N@H+]2Cc3ccccc3C3(CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000482506899 1113279993 /nfs/dbraw/zinc/27/99/93/1113279993.db2.gz ITVWGMXUZSPDNU-UHFFFAOYSA-N 1 1 374.444 4.043 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CCC[C@H](c4ccccc4)CC3)nc2c1 ZINC000482699599 1113335566 /nfs/dbraw/zinc/33/55/66/1113335566.db2.gz YFEDQMMXPPHJCD-INIZCTEOSA-N 1 1 350.422 4.241 20 5 FIBDMO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1cccc(OC)c1 ZINC000482701259 1113336123 /nfs/dbraw/zinc/33/61/23/1113336123.db2.gz WCUUDIXHYHMERJ-ZDUSSCGKSA-N 1 1 354.410 4.063 20 5 FIBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)c1cccc(OC)c1 ZINC000482701259 1113336130 /nfs/dbraw/zinc/33/61/30/1113336130.db2.gz WCUUDIXHYHMERJ-ZDUSSCGKSA-N 1 1 354.410 4.063 20 5 FIBDMO CC(C)c1ccc([C@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC000490670474 1114315508 /nfs/dbraw/zinc/31/55/08/1114315508.db2.gz FXUZBAFBZPSSMR-HXUWFJFHSA-N 1 1 369.465 4.107 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000164404970 1114494149 /nfs/dbraw/zinc/49/41/49/1114494149.db2.gz NZVJSDOJPGOINU-LJQANCHMSA-N 1 1 371.412 4.208 20 5 FIBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccc(F)c(Br)c1 ZINC000590193306 1114905511 /nfs/dbraw/zinc/90/55/11/1114905511.db2.gz LILACAAMXNEDJX-SECBINFHSA-N 1 1 371.181 4.486 20 5 FIBDMO CCOc1cc(C[N@H+](Cc2ccc(C)nc2)CC2CC2)ccc1[N+](=O)[O-] ZINC000592146485 1115208778 /nfs/dbraw/zinc/20/87/78/1115208778.db2.gz RENHSXJZQWEQSS-UHFFFAOYSA-N 1 1 355.438 4.109 20 5 FIBDMO CC(=O)Nc1ccc(-c2cccc(C[N@@H+]3CCC[C@@H]3C)c2)cc1[N+](=O)[O-] ZINC000592986411 1115278512 /nfs/dbraw/zinc/27/85/12/1115278512.db2.gz NFGRHCCEOGFIIJ-AWEZNQCLSA-N 1 1 353.422 4.205 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(OC2CCCC2)nc1 ZINC000595013708 1115504281 /nfs/dbraw/zinc/50/42/81/1115504281.db2.gz RMQDMLKSEBBNLN-AWEZNQCLSA-N 1 1 371.437 4.171 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1cn(C(C)(C)C)nc1C ZINC000595033941 1115510670 /nfs/dbraw/zinc/51/06/70/1115510670.db2.gz UBMVQABMZGXZNC-STQMWFEESA-N 1 1 360.458 4.275 20 5 FIBDMO COc1cc(C[N@H+]2C[C@@H](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000575026890 1115530147 /nfs/dbraw/zinc/53/01/47/1115530147.db2.gz FCZCDGDHHFVNIU-YOEHRIQHSA-N 1 1 356.422 4.195 20 5 FIBDMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2ccccc2OC(C)C)c1 ZINC000593021849 1115539322 /nfs/dbraw/zinc/53/93/22/1115539322.db2.gz YWAHBAKLNZQKCG-AWEZNQCLSA-N 1 1 372.421 4.019 20 5 FIBDMO C[C@@](CO)([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cc(Cl)cc(Cl)c1 ZINC000595520058 1115540084 /nfs/dbraw/zinc/54/00/84/1115540084.db2.gz MGUVYVNKKDMOMA-INIZCTEOSA-N 1 1 373.211 4.038 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000593123085 1115563044 /nfs/dbraw/zinc/56/30/44/1115563044.db2.gz KASUUSLEKMSONU-JBACZVJFSA-N 1 1 368.433 4.098 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 ZINC000593123085 1115563047 /nfs/dbraw/zinc/56/30/47/1115563047.db2.gz KASUUSLEKMSONU-JBACZVJFSA-N 1 1 368.433 4.098 20 5 FIBDMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](CCC1CC1)CC1CC1 ZINC000595871427 1115566630 /nfs/dbraw/zinc/56/66/30/1115566630.db2.gz NNFINPSYZLRJGD-ZDUSSCGKSA-N 1 1 356.426 4.218 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3ccccc3-n3ccnc32)cc1[N+](=O)[O-] ZINC000596095894 1115571962 /nfs/dbraw/zinc/57/19/62/1115571962.db2.gz QVXJSSCTMDVPNZ-MAUKXSAKSA-N 1 1 362.433 4.427 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@H]1c1ccco1 ZINC000597217313 1115648642 /nfs/dbraw/zinc/64/86/42/1115648642.db2.gz CCNUMFMZKYYEOH-VMTBQTDASA-N 1 1 368.433 4.445 20 5 FIBDMO CCc1ccc([C@@H](NC[C@@H]2CCCC[N@@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599072036 1115787212 /nfs/dbraw/zinc/78/72/12/1115787212.db2.gz WZELYUUUCZYSPF-KKSFZXQISA-N 1 1 371.481 4.161 20 5 FIBDMO CC(C)(C)OC(=O)[C@H]1C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000593687017 1115794922 /nfs/dbraw/zinc/79/49/22/1115794922.db2.gz FTWVLBWLMAHCSC-ZWKOTPCHSA-N 1 1 368.433 4.255 20 5 FIBDMO Cc1c([C@H](C)[NH2+][C@@H](Cc2ccccc2)c2nccn2C)cccc1[N+](=O)[O-] ZINC000593722280 1115805095 /nfs/dbraw/zinc/80/50/95/1115805095.db2.gz MVFKPKAMQOUXOX-LPHOPBHVSA-N 1 1 364.449 4.271 20 5 FIBDMO COc1ccc2cc(C[N@@H+](C)Cc3ccc(OC)c([N+](=O)[O-])c3)ccc2c1 ZINC000603844683 1115820479 /nfs/dbraw/zinc/82/04/79/1115820479.db2.gz MYOLAQIRJRAKOC-UHFFFAOYSA-N 1 1 366.417 4.397 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576662 1115828048 /nfs/dbraw/zinc/82/80/48/1115828048.db2.gz QAANANBAUBIKND-QVKFZJNVSA-N 1 1 366.417 4.156 20 5 FIBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 ZINC000599576662 1115828050 /nfs/dbraw/zinc/82/80/50/1115828050.db2.gz QAANANBAUBIKND-QVKFZJNVSA-N 1 1 366.417 4.156 20 5 FIBDMO C[N@H+](Cc1ccc(F)c(Br)c1)Cc1ccccc1[N+](=O)[O-] ZINC000603934217 1115834104 /nfs/dbraw/zinc/83/41/04/1115834104.db2.gz SMKYYPQBMRZEMC-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO C[N@@H+](Cc1ccc(F)c(Br)c1)Cc1ccccc1[N+](=O)[O-] ZINC000603934217 1115834106 /nfs/dbraw/zinc/83/41/06/1115834106.db2.gz SMKYYPQBMRZEMC-UHFFFAOYSA-N 1 1 353.191 4.128 20 5 FIBDMO C/C=C\C[C@@H]1CCC[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599689598 1115836048 /nfs/dbraw/zinc/83/60/48/1115836048.db2.gz JZYKUYLKBPCGIW-LPUOJRKPSA-N 1 1 356.426 4.384 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000604470423 1115865880 /nfs/dbraw/zinc/86/58/80/1115865880.db2.gz XATBDZFSXHBVHS-HNNXBMFYSA-N 1 1 367.449 4.387 20 5 FIBDMO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCc2ccccc21 ZINC000608868672 1116132769 /nfs/dbraw/zinc/13/27/69/1116132769.db2.gz RARPPZVCEOUANZ-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCc2ccccc21 ZINC000608868672 1116132770 /nfs/dbraw/zinc/13/27/70/1116132770.db2.gz RARPPZVCEOUANZ-SFHVURJKSA-N 1 1 364.405 4.154 20 5 FIBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](c3ccccc3)CC2)c2c(c1)COCO2 ZINC000608977463 1116139463 /nfs/dbraw/zinc/13/94/63/1116139463.db2.gz LJIHJLWSZVFSSJ-QGZVFWFLSA-N 1 1 368.433 4.231 20 5 FIBDMO Cc1ccc(OCC[N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000535523810 1116316351 /nfs/dbraw/zinc/31/63/51/1116316351.db2.gz HGTPJYXUIITJRZ-UHFFFAOYSA-N 1 1 367.405 4.069 20 5 FIBDMO Cc1ccc(OCC[N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000535523810 1116316353 /nfs/dbraw/zinc/31/63/53/1116316353.db2.gz HGTPJYXUIITJRZ-UHFFFAOYSA-N 1 1 367.405 4.069 20 5 FIBDMO C[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311576627 1116369497 /nfs/dbraw/zinc/36/94/97/1116369497.db2.gz VYLIKVJGSGTKSO-NVXWUHKLSA-N 1 1 373.884 4.248 20 5 FIBDMO CCC[C@H](Nc1ccc(N2CCOCC2)[nH+]c1C)c1cccc([N+](=O)[O-])c1 ZINC000539740814 1116374050 /nfs/dbraw/zinc/37/40/50/1116374050.db2.gz OVPAJOZGDNPNMD-IBGZPJMESA-N 1 1 370.453 4.088 20 5 FIBDMO COc1cc(C[N@H+](Cc2ccc(F)cc2)CC2CC2)c([N+](=O)[O-])cc1OC ZINC000539827609 1116387342 /nfs/dbraw/zinc/38/73/42/1116387342.db2.gz MBPQKEMVTSFMOX-UHFFFAOYSA-N 1 1 374.412 4.163 20 5 FIBDMO CC(C)c1ccc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1[N+](=O)[O-] ZINC000539899597 1117740918 /nfs/dbraw/zinc/74/09/18/1117740918.db2.gz GXFLGOZHHPMGPQ-XLIONFOSSA-N 1 1 357.498 4.167 20 5 FIBDMO COc1cc(NCc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)ccc1[N+](=O)[O-] ZINC000462790566 1117773984 /nfs/dbraw/zinc/77/39/84/1117773984.db2.gz OJKRJVDEUBUTLW-INIZCTEOSA-N 1 1 369.465 4.447 20 5 FIBDMO C[N@@H+](CCc1cccc(Br)c1)Cc1csc([N+](=O)[O-])c1 ZINC000462825567 1117798895 /nfs/dbraw/zinc/79/88/95/1117798895.db2.gz LKSDVESNRRVRAP-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO Cc1cnc(NCc2ccccc2C[N@@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000463052839 1117942037 /nfs/dbraw/zinc/94/20/37/1117942037.db2.gz IWEOHNLJZQITNB-MRXNPFEDSA-N 1 1 354.454 4.285 20 5 FIBDMO Cc1cnc(NCc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c([N+](=O)[O-])c1 ZINC000463054818 1117949636 /nfs/dbraw/zinc/94/96/36/1117949636.db2.gz HRNDULJJYHTJID-OAHLLOKOSA-N 1 1 354.454 4.142 20 5 FIBDMO CC[C@@H](NC1CC[NH+](CCc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000463207310 1118021754 /nfs/dbraw/zinc/02/17/54/1118021754.db2.gz RVNYADMCUFYBOD-JOCHJYFZSA-N 1 1 367.493 4.343 20 5 FIBDMO C[C@H]1CC[C@@]2(CC[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C2)C1 ZINC000541019601 1118356363 /nfs/dbraw/zinc/35/63/63/1118356363.db2.gz FJXIPSFLPBLOTB-MGPUTAFESA-N 1 1 355.438 4.304 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@H+](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000541765009 1118636552 /nfs/dbraw/zinc/63/65/52/1118636552.db2.gz PDEFSMUHDJJBPU-UHFFFAOYSA-N 1 1 362.433 4.390 20 5 FIBDMO CN(c1ccccc1)c1ccc(C[N@@H+](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000541765009 1118636553 /nfs/dbraw/zinc/63/65/53/1118636553.db2.gz PDEFSMUHDJJBPU-UHFFFAOYSA-N 1 1 362.433 4.390 20 5 FIBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000464706297 1118659132 /nfs/dbraw/zinc/65/91/32/1118659132.db2.gz DCJJRPYXHVBMFD-GOSISDBHSA-N 1 1 367.449 4.008 20 5 FIBDMO CCc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000464706299 1118666722 /nfs/dbraw/zinc/66/67/22/1118666722.db2.gz DCJJRPYXHVBMFD-SFHVURJKSA-N 1 1 367.449 4.008 20 5 FIBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3ccc(F)cc3Cl)CC2)cc1 ZINC000464777676 1118690808 /nfs/dbraw/zinc/69/08/08/1118690808.db2.gz MXXCGGYJLYBSPO-UHFFFAOYSA-N 1 1 364.804 4.431 20 5 FIBDMO Cc1ccc(CC[N@H+](Cc2ccccc2[N+](=O)[O-])C[C@@H]2CCCO2)cc1 ZINC000464782558 1118693486 /nfs/dbraw/zinc/69/34/86/1118693486.db2.gz XYKIDDNGFYGLBH-FQEVSTJZSA-N 1 1 354.450 4.127 20 5 FIBDMO CCc1cccc(CC)c1NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271781873 1118864496 /nfs/dbraw/zinc/86/44/96/1118864496.db2.gz SIIADXLTEFJSPV-AWEZNQCLSA-N 1 1 355.438 4.009 20 5 FIBDMO CC(C)([NH2+]Cc1sccc1Br)c1ccccc1[N+](=O)[O-] ZINC000492194915 1119043387 /nfs/dbraw/zinc/04/33/87/1119043387.db2.gz TVWUAEZVCXXGEN-UHFFFAOYSA-N 1 1 355.257 4.444 20 5 FIBDMO CCOc1cc(C[NH+]2CC(c3nc4ccccc4s3)C2)ccc1[N+](=O)[O-] ZINC000492772867 1119189996 /nfs/dbraw/zinc/18/99/96/1119189996.db2.gz OMTMXOLKZVHQPT-UHFFFAOYSA-N 1 1 369.446 4.203 20 5 FIBDMO CC(=O)c1ccc2c(c1)CC[N@@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)CC2 ZINC000492804084 1119190793 /nfs/dbraw/zinc/19/07/93/1119190793.db2.gz CEKVTBCPEAJSSI-OAHLLOKOSA-N 1 1 352.434 4.268 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@H+](C)Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000031006328 1119211203 /nfs/dbraw/zinc/21/12/03/1119211203.db2.gz VJDVRBUUXXDYKY-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1c(NC(=O)[C@H](C)[N@@H+](C)Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000031006328 1119211207 /nfs/dbraw/zinc/21/12/07/1119211207.db2.gz VJDVRBUUXXDYKY-ZDUSSCGKSA-N 1 1 361.829 4.016 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](CCO)[C@H]2CCCc3ccccc32)cc1Cl ZINC000761511771 1119405215 /nfs/dbraw/zinc/40/52/15/1119405215.db2.gz PDQZUBXKIPPARG-SFHVURJKSA-N 1 1 360.841 4.120 20 5 FIBDMO COCC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)c1ccc(C)o1 ZINC000542577490 1121020184 /nfs/dbraw/zinc/02/01/84/1121020184.db2.gz PACGTGDTGDSDQN-KRWDZBQOSA-N 1 1 362.426 4.151 20 5 FIBDMO CC(C)[N@@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000732567855 1121079873 /nfs/dbraw/zinc/07/98/73/1121079873.db2.gz KNPUZKZAGXXFBK-UHFFFAOYSA-N 1 1 359.392 4.170 20 5 FIBDMO COc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1Cl ZINC000112533302 1121966356 /nfs/dbraw/zinc/96/63/56/1121966356.db2.gz IJMMYWZJZPWDAJ-LLVKDONJSA-N 1 1 350.802 4.116 20 5 FIBDMO C[C@@H]1C[C@@H](N(C)c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000301452187 1121979641 /nfs/dbraw/zinc/97/96/41/1121979641.db2.gz XQNMYBPHNVFKEA-ZJUUUORDSA-N 1 1 365.783 4.186 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1 ZINC000154526653 1122443525 /nfs/dbraw/zinc/44/35/25/1122443525.db2.gz QCLJUFNPOXPNAK-RTWAWAEBSA-N 1 1 365.433 4.337 20 5 FIBDMO C[C@@H]1CCCC[C@H]1CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000556873234 1123156803 /nfs/dbraw/zinc/15/68/03/1123156803.db2.gz VNIHPWKDGLFHJG-JTDSTZFVSA-N 1 1 356.470 4.224 20 5 FIBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccsc2)s1 ZINC000556996984 1123304337 /nfs/dbraw/zinc/30/43/37/1123304337.db2.gz DRWYJXOESBZYPT-UHFFFAOYSA-N 1 1 359.476 4.454 20 5 FIBDMO CC(C)CC[N@H+]1Cc2cccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3)c2C1 ZINC000076171318 1123577803 /nfs/dbraw/zinc/57/78/03/1123577803.db2.gz UXWKBGOTEOAFKF-UHFFFAOYSA-N 1 1 367.449 4.138 20 5 FIBDMO O=[N+]([O-])c1ccc(OC2CC[NH+](Cc3cnc(C4CCC4)s3)CC2)cc1 ZINC000130743731 1123677179 /nfs/dbraw/zinc/67/71/79/1123677179.db2.gz PEUOPCWZNFCQQC-UHFFFAOYSA-N 1 1 373.478 4.362 20 5 FIBDMO CCOc1ccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 ZINC000609598821 1123764379 /nfs/dbraw/zinc/76/43/79/1123764379.db2.gz UZORFMJGIOMGII-UHFFFAOYSA-N 1 1 369.446 4.407 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705025 1123803218 /nfs/dbraw/zinc/80/32/18/1123803218.db2.gz HSFJJDNTLJGZAB-HZPDHXFCSA-N 1 1 365.905 4.335 20 5 FIBDMO COc1cccc(C[C@@H]2CCC[N@H+]2Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000609705229 1123803682 /nfs/dbraw/zinc/80/36/82/1123803682.db2.gz ISJDNCABOJZHLH-KRWDZBQOSA-N 1 1 360.841 4.464 20 5 FIBDMO CCC[N@H+]1CCC[C@H]1C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609762690 1123834871 /nfs/dbraw/zinc/83/48/71/1123834871.db2.gz PFFUVFQOUGTJEK-IBGZPJMESA-N 1 1 369.421 4.200 20 5 FIBDMO C[C@@H]1C[C@@H](N(C)c2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000609964792 1123898963 /nfs/dbraw/zinc/89/89/63/1123898963.db2.gz MDICQIURRBAQBO-QAPCUYQASA-N 1 1 357.429 4.223 20 5 FIBDMO C[C@H]1C[C@H](N(C)Cc2c(F)cccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC000610003578 1123914215 /nfs/dbraw/zinc/91/42/15/1123914215.db2.gz XERCDIVENPXBQU-FUHWJXTLSA-N 1 1 371.456 4.219 20 5 FIBDMO COC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)c1ccc(F)c(F)c1 ZINC000091413650 1124386934 /nfs/dbraw/zinc/38/69/34/1124386934.db2.gz LJCURUCQAWBVRP-YVEFUNNKSA-N 1 1 350.365 4.220 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1 ZINC000181568102 1125018981 /nfs/dbraw/zinc/01/89/81/1125018981.db2.gz BGVLKFDWLRQUFG-ZDUSSCGKSA-N 1 1 374.412 4.382 20 5 FIBDMO CCOc1ccc(C(C)=O)cc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181822217 1125144092 /nfs/dbraw/zinc/14/40/92/1125144092.db2.gz VDGOLSBBOZHLGP-CQSZACIVSA-N 1 1 356.422 4.355 20 5 FIBDMO COCc1cccc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000113322733 1125151563 /nfs/dbraw/zinc/15/15/63/1125151563.db2.gz YTNGYHGUFDOONE-UHFFFAOYSA-N 1 1 369.446 4.155 20 5 FIBDMO Cc1sc(C(=O)Nc2cccc3c2C[N@@H+](CC(C)C)C3)cc1[N+](=O)[O-] ZINC000130941296 1125165477 /nfs/dbraw/zinc/16/54/77/1125165477.db2.gz MPXMPPWCDZWAHC-UHFFFAOYSA-N 1 1 359.451 4.189 20 5 FIBDMO C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311820347 1125228478 /nfs/dbraw/zinc/22/84/78/1125228478.db2.gz NDAOMRMOJOKZFD-QKLQHJQFSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311820347 1125228482 /nfs/dbraw/zinc/22/84/82/1125228482.db2.gz NDAOMRMOJOKZFD-QKLQHJQFSA-N 1 1 353.466 4.156 20 5 FIBDMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)c2ccncc21 ZINC000312139499 1125273402 /nfs/dbraw/zinc/27/34/02/1125273402.db2.gz OJXHTIOSRLDBNS-KRWDZBQOSA-N 1 1 362.433 4.220 20 5 FIBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000052212629 221036647 /nfs/dbraw/zinc/03/66/47/221036647.db2.gz ABNRMLPRUXWNAU-SFHVURJKSA-N 1 1 364.405 4.290 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000096967811 222146368 /nfs/dbraw/zinc/14/63/68/222146368.db2.gz NIBMDRZBFHATFC-INIZCTEOSA-N 1 1 367.449 4.142 20 5 FIBDMO COc1cc(C[N@@H+](C2CC2)C2CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000541872437 568039578 /nfs/dbraw/zinc/03/95/78/568039578.db2.gz LBYXIMVYXASEJC-UHFFFAOYSA-N 1 1 370.396 4.154 20 5 FIBDMO CCSCC[C@H](C)[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072901559 568056845 /nfs/dbraw/zinc/05/68/45/568056845.db2.gz XWGJWSKPPQLTII-AWEZNQCLSA-N 1 1 363.483 4.256 20 5 FIBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 ZINC000568933742 568253523 /nfs/dbraw/zinc/25/35/23/568253523.db2.gz RJUIENSMWASPLR-YXQCLYQKSA-N 1 1 364.445 4.113 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H]3[C@H]3CCCOC3)o2)c1 ZINC000517937067 568340315 /nfs/dbraw/zinc/34/03/15/568340315.db2.gz KZIVHBJKZWUOMY-QFBILLFUSA-N 1 1 356.422 4.246 20 5 FIBDMO COc1cc(F)cc(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000093970628 1125546496 /nfs/dbraw/zinc/54/64/96/1125546496.db2.gz ZENXSKGIEPAXIW-UHFFFAOYSA-N 1 1 373.409 4.156 20 5 FIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc(Br)cc1 ZINC000049525856 1079585277 /nfs/dbraw/zinc/58/52/77/1079585277.db2.gz MNRRYFZYSNWCKQ-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCOC[C@H](C4CCC4)C3)o2)c1 ZINC000430142929 1079594911 /nfs/dbraw/zinc/59/49/11/1079594911.db2.gz AYOSCLHZTUPJME-QGZVFWFLSA-N 1 1 356.422 4.103 20 5 FIBDMO Cc1ccccc1[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)C ZINC000183227503 1125781442 /nfs/dbraw/zinc/78/14/42/1125781442.db2.gz NSXRDNHWKYBHGH-LJQANCHMSA-N 1 1 366.421 4.440 20 5 FIBDMO CC[C@H]1CC[N@@H+]1Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000430192439 1079820503 /nfs/dbraw/zinc/82/05/03/1079820503.db2.gz CBFXEQVTUXXBTB-KRWDZBQOSA-N 1 1 356.422 4.167 20 5 FIBDMO CC[C@H]1CC[N@H+]1Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000430192439 1079820523 /nfs/dbraw/zinc/82/05/23/1079820523.db2.gz CBFXEQVTUXXBTB-KRWDZBQOSA-N 1 1 356.422 4.167 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000118787569 1080056533 /nfs/dbraw/zinc/05/65/33/1080056533.db2.gz YKEIOUDSYVNRMJ-DLBZAZTESA-N 1 1 374.485 4.022 20 5 FIBDMO O=C(CC[N@H+](Cc1ccccc1)CC1CCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC001167158696 1080764983 /nfs/dbraw/zinc/76/49/83/1080764983.db2.gz WOQCMMOCWSUUAE-UHFFFAOYSA-N 1 1 367.449 4.226 20 5 FIBDMO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCc2ccccc21 ZINC001167205858 1080843936 /nfs/dbraw/zinc/84/39/36/1080843936.db2.gz KBWVNBDNZVBIHB-LJQANCHMSA-N 1 1 350.422 4.371 20 5 FIBDMO COc1ccc(C[N@H+](C)Cc2cc(Br)cs2)cc1[N+](=O)[O-] ZINC000047751276 1080930410 /nfs/dbraw/zinc/93/04/10/1080930410.db2.gz OWAGYXDQCVTDQR-UHFFFAOYSA-N 1 1 371.256 4.059 20 5 FIBDMO COc1ccc(C[N@@H+](C)Cc2cc(Br)cs2)cc1[N+](=O)[O-] ZINC000047751276 1080930413 /nfs/dbraw/zinc/93/04/13/1080930413.db2.gz OWAGYXDQCVTDQR-UHFFFAOYSA-N 1 1 371.256 4.059 20 5 FIBDMO Cc1c(C[NH2+][C@H](C)c2nc3ccccc3n2C(F)F)cccc1[N+](=O)[O-] ZINC000275471640 1080931140 /nfs/dbraw/zinc/93/11/40/1080931140.db2.gz OVSQQGROXSFOFS-GFCCVEGCSA-N 1 1 360.364 4.499 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@H](c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001167306593 1081243922 /nfs/dbraw/zinc/24/39/22/1081243922.db2.gz HRRZIYMUOUMRHS-SFHVURJKSA-N 1 1 370.449 4.252 20 5 FIBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)c1 ZINC000175847578 1081455147 /nfs/dbraw/zinc/45/51/47/1081455147.db2.gz LKWLIPZZDBMRQP-CZUORRHYSA-N 1 1 366.870 4.398 20 5 FIBDMO CC[C@H](C)[C@H](C)[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC001167356322 1081616996 /nfs/dbraw/zinc/61/69/96/1081616996.db2.gz MCIKWTDSHBZCIQ-RYUDHWBXSA-N 1 1 353.850 4.086 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4OCC[C@@H]4C3)o2)c(Cl)c1 ZINC000579475032 1081744197 /nfs/dbraw/zinc/74/41/97/1081744197.db2.gz BQTCSEWVGMADRO-PXAZEXFGSA-N 1 1 362.813 4.119 20 5 FIBDMO C[C@H]([NH2+][C@@H](CN1CCCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610420445 1081835203 /nfs/dbraw/zinc/83/52/03/1081835203.db2.gz IAWPQWRURWCKGM-UWJYYQICSA-N 1 1 353.466 4.473 20 5 FIBDMO CC[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC001167380732 1081852789 /nfs/dbraw/zinc/85/27/89/1081852789.db2.gz ILVSWLBYIGOOTH-QWHCGFSZSA-N 1 1 353.850 4.087 20 5 FIBDMO CC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC001167380732 1081852791 /nfs/dbraw/zinc/85/27/91/1081852791.db2.gz ILVSWLBYIGOOTH-QWHCGFSZSA-N 1 1 353.850 4.087 20 5 FIBDMO C[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000237569202 1082087673 /nfs/dbraw/zinc/08/76/73/1082087673.db2.gz QOBBJNRDNFQZPX-MAUKXSAKSA-N 1 1 373.884 4.391 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2cc(Cl)c3c(c2)OCCO3)C2CC2)cc1 ZINC000510348407 1082140469 /nfs/dbraw/zinc/14/04/69/1082140469.db2.gz NFMZYCWCDPFHHJ-UHFFFAOYSA-N 1 1 374.824 4.184 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cc(Cl)c3c(c2)OCCO3)C2CC2)cc1 ZINC000510348407 1082140471 /nfs/dbraw/zinc/14/04/71/1082140471.db2.gz NFMZYCWCDPFHHJ-UHFFFAOYSA-N 1 1 374.824 4.184 20 5 FIBDMO Cc1ccc(C[N@@H+](CC(C)C)C[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001167439535 1082235728 /nfs/dbraw/zinc/23/57/28/1082235728.db2.gz ZCIPTLVTAFVZHA-FQEVSTJZSA-N 1 1 360.429 4.234 20 5 FIBDMO COc1ccc(OCC[N@H+]2CCC[C@H]2c2cccc(C)c2C)c([N+](=O)[O-])c1 ZINC001167464511 1082596550 /nfs/dbraw/zinc/59/65/50/1082596550.db2.gz NHUAUYCVZWOCCM-IBGZPJMESA-N 1 1 370.449 4.436 20 5 FIBDMO CCC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000510468324 1082922945 /nfs/dbraw/zinc/92/29/45/1082922945.db2.gz ACNXNCVLFBHQHG-UHFFFAOYSA-N 1 1 357.454 4.161 20 5 FIBDMO CC[C@H](Cc1ccc(C)cc1)[N@@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001167487148 1082956052 /nfs/dbraw/zinc/95/60/52/1082956052.db2.gz GKDZKSQJBPEABD-CTNGQTDRSA-N 1 1 356.466 4.280 20 5 FIBDMO COc1ccccc1[C@@H]1CCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582023 1083211628 /nfs/dbraw/zinc/21/16/28/1083211628.db2.gz JSRNVTMJEZZRBW-KRWDZBQOSA-N 1 1 367.405 4.472 20 5 FIBDMO COc1ccccc1[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582023 1083211631 /nfs/dbraw/zinc/21/16/31/1083211631.db2.gz JSRNVTMJEZZRBW-KRWDZBQOSA-N 1 1 367.405 4.472 20 5 FIBDMO C[N@H+](Cc1cccc(OCc2ccccn2)c1)Cc1ccccc1[N+](=O)[O-] ZINC000179316809 1083370682 /nfs/dbraw/zinc/37/06/82/1083370682.db2.gz OOWXKQMPCZSMLG-UHFFFAOYSA-N 1 1 363.417 4.201 20 5 FIBDMO C[N@@H+](Cc1cccc(OCc2ccccn2)c1)Cc1ccccc1[N+](=O)[O-] ZINC000179316809 1083370697 /nfs/dbraw/zinc/37/06/97/1083370697.db2.gz OOWXKQMPCZSMLG-UHFFFAOYSA-N 1 1 363.417 4.201 20 5 FIBDMO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1ccc(F)cc1 ZINC000053087990 1083658729 /nfs/dbraw/zinc/65/87/29/1083658729.db2.gz OWSPLUKQBHFORX-CYBMUJFWSA-N 1 1 360.385 4.184 20 5 FIBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1ccc(F)cc1 ZINC000053087990 1083658734 /nfs/dbraw/zinc/65/87/34/1083658734.db2.gz OWSPLUKQBHFORX-CYBMUJFWSA-N 1 1 360.385 4.184 20 5 FIBDMO Cc1nc(C(F)(F)F)c(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)s1 ZINC000548927601 1083772848 /nfs/dbraw/zinc/77/28/48/1083772848.db2.gz JXJKLPYZCSWMAQ-UHFFFAOYSA-N 1 1 359.373 4.053 20 5 FIBDMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)no1 ZINC000612954726 1084228024 /nfs/dbraw/zinc/22/80/24/1084228024.db2.gz OLEPOMISZNOFBO-IKKMQULASA-N 1 1 374.466 4.171 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(OC(C)C)c(OC)c1 ZINC000539252479 1084432447 /nfs/dbraw/zinc/43/24/47/1084432447.db2.gz GIJZRTRJTHTRCH-AWEZNQCLSA-N 1 1 374.437 4.250 20 5 FIBDMO C[C@H](c1cccc(Nc2ccc([N+](=O)[O-])cc2Cl)c1)[NH+]1CCOCC1 ZINC000511453737 1084479945 /nfs/dbraw/zinc/47/99/45/1084479945.db2.gz KQEUUOQGZRAPOI-CYBMUJFWSA-N 1 1 361.829 4.385 20 5 FIBDMO CCO[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])C12CCCCC2 ZINC001167539409 1084493160 /nfs/dbraw/zinc/49/31/60/1084493160.db2.gz MQIIWLUUIIIFGX-ZWKOTPCHSA-N 1 1 350.434 4.294 20 5 FIBDMO CC(=O)c1cc(N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000582139707 1084666520 /nfs/dbraw/zinc/66/65/20/1084666520.db2.gz XQEYNWIXBFGFAM-MRXNPFEDSA-N 1 1 373.497 4.278 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)o1 ZINC000539897042 1084693018 /nfs/dbraw/zinc/69/30/18/1084693018.db2.gz XWYSYPLQAJPZBQ-HZPDHXFCSA-N 1 1 356.422 4.103 20 5 FIBDMO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414168943 1084732324 /nfs/dbraw/zinc/73/23/24/1084732324.db2.gz ASDFNIONWDYHOQ-QWHCGFSZSA-N 1 1 356.451 4.469 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)ccc1OC(F)F ZINC000552015341 1084771583 /nfs/dbraw/zinc/77/15/83/1084771583.db2.gz MOXKPSDFYXINDL-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO Cc1ccc(-c2cnc(C[N@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511095491 1084814847 /nfs/dbraw/zinc/81/48/47/1084814847.db2.gz KIEHJDLFSQNCQS-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO Cc1ccc(-c2cnc(C[N@@H+](C)CCc3ccccc3[N+](=O)[O-])o2)cc1 ZINC000511095491 1084814853 /nfs/dbraw/zinc/81/48/53/1084814853.db2.gz KIEHJDLFSQNCQS-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO CC(C)(C)OC(=O)Nc1ccsc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000892609189 1085031543 /nfs/dbraw/zinc/03/15/43/1085031543.db2.gz XGKXRHXQVIGCOZ-UHFFFAOYSA-N 1 1 363.439 4.293 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc2c1C[N@@H+](CC(C)C)C2 ZINC000158366982 1085052693 /nfs/dbraw/zinc/05/26/93/1085052693.db2.gz WIZFKKJFARODAF-UHFFFAOYSA-N 1 1 353.422 4.127 20 5 FIBDMO C[C@H](Cc1ccsc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001167582229 1085103517 /nfs/dbraw/zinc/10/35/17/1085103517.db2.gz MSIBUXVPDPWZEG-LLVKDONJSA-N 1 1 369.284 4.482 20 5 FIBDMO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Br ZINC001167582229 1085103524 /nfs/dbraw/zinc/10/35/24/1085103524.db2.gz MSIBUXVPDPWZEG-LLVKDONJSA-N 1 1 369.284 4.482 20 5 FIBDMO C[C@@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1cccc(F)c1F ZINC000121863866 1085560860 /nfs/dbraw/zinc/56/08/60/1085560860.db2.gz KWAPLFVZHPLDDA-SECBINFHSA-N 1 1 371.181 4.486 20 5 FIBDMO C[C@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1cccc(F)c1F ZINC000121863761 1085561642 /nfs/dbraw/zinc/56/16/42/1085561642.db2.gz KWAPLFVZHPLDDA-VIFPVBQESA-N 1 1 371.181 4.486 20 5 FIBDMO CCc1nc2ccccc2n1C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000093301899 1085630225 /nfs/dbraw/zinc/63/02/25/1085630225.db2.gz MVODHDKCBNKUEJ-UHFFFAOYSA-N 1 1 370.478 4.406 20 5 FIBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC001167799444 1086430096 /nfs/dbraw/zinc/43/00/96/1086430096.db2.gz ZNUXSCVFMIAPKH-WFASDCNBSA-N 1 1 353.850 4.087 20 5 FIBDMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000054011134 1086632286 /nfs/dbraw/zinc/63/22/86/1086632286.db2.gz ICLOZCKRVGTYJX-UHFFFAOYSA-N 1 1 364.405 4.215 20 5 FIBDMO CCC[N@@H+](CC)Cc1ccc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000512170079 1086875119 /nfs/dbraw/zinc/87/51/19/1086875119.db2.gz BJNDECONPXXMSS-INIZCTEOSA-N 1 1 369.465 4.318 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2OC(F)F)cc1[N+](=O)[O-] ZINC000090177286 1087410765 /nfs/dbraw/zinc/41/07/65/1087410765.db2.gz TZXOZYVIGHEDNW-NSHDSACASA-N 1 1 354.328 4.495 20 5 FIBDMO CC[N@@H+](Cc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1)C1CC1 ZINC000504996234 1088026197 /nfs/dbraw/zinc/02/61/97/1088026197.db2.gz MBKVFEMEEUTRRS-UHFFFAOYSA-N 1 1 364.405 4.296 20 5 FIBDMO C[C@@H](C[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000514085434 1088728796 /nfs/dbraw/zinc/72/87/96/1088728796.db2.gz VZDXNLSUUBKWMZ-INIZCTEOSA-N 1 1 364.449 4.231 20 5 FIBDMO Cc1ccc(C[N@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000414539793 1088818768 /nfs/dbraw/zinc/81/87/68/1088818768.db2.gz BJBCMFZBQLPJGL-FQEVSTJZSA-N 1 1 352.434 4.257 20 5 FIBDMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1cccc(Cl)c1 ZINC000434623883 1088885819 /nfs/dbraw/zinc/88/58/19/1088885819.db2.gz NPWBWCXTHHCOEK-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1cccc(Cl)c1 ZINC000434623883 1088885837 /nfs/dbraw/zinc/88/58/37/1088885837.db2.gz NPWBWCXTHHCOEK-UHFFFAOYSA-N 1 1 361.829 4.017 20 5 FIBDMO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](c3ccccc3)[C@H]2C)cccc1[N+](=O)[O-] ZINC000434901351 1089117771 /nfs/dbraw/zinc/11/77/71/1089117771.db2.gz VDGKKKVSTCGSAF-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2cccc(F)c2)n[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC000511522456 1089210291 /nfs/dbraw/zinc/21/02/91/1089210291.db2.gz LDXOXKAESBDKNU-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO CC1(C)CC[N@@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCS1 ZINC000435049499 1089236425 /nfs/dbraw/zinc/23/64/25/1089236425.db2.gz OILKJXOHVWJGFW-UHFFFAOYSA-N 1 1 363.508 4.436 20 5 FIBDMO CCC[N@@H+](CCc1cccc(F)c1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000435063116 1089253980 /nfs/dbraw/zinc/25/39/80/1089253980.db2.gz IMOBPNOARWDWNJ-UHFFFAOYSA-N 1 1 357.385 4.330 20 5 FIBDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000505598205 1089254120 /nfs/dbraw/zinc/25/41/20/1089254120.db2.gz YFWQYFLPUIDPEP-YPMHNXCESA-N 1 1 358.385 4.010 20 5 FIBDMO C[C@@]1(c2ccccc2)CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000435064078 1089254785 /nfs/dbraw/zinc/25/47/85/1089254785.db2.gz MGMGRWFWRBXKKE-HXUWFJFHSA-N 1 1 351.406 4.290 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCOC[C@@H](C4CCC4)C3)o2)cc1 ZINC000430126355 1089366448 /nfs/dbraw/zinc/36/64/48/1089366448.db2.gz NZRGYIBHBLHYAK-KRWDZBQOSA-N 1 1 356.422 4.103 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H](CN1CCCC1)c1ccccc1 ZINC000515072344 1089771965 /nfs/dbraw/zinc/77/19/65/1089771965.db2.gz JFNYBMXVMDLFFB-PMACEKPBSA-N 1 1 351.450 4.009 20 5 FIBDMO COc1cc(C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)ccc1O ZINC000128353570 1089928109 /nfs/dbraw/zinc/92/81/09/1089928109.db2.gz DZBNRDDSFZEBJN-UHFFFAOYSA-N 1 1 362.813 4.127 20 5 FIBDMO COc1cc(C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)ccc1O ZINC000128353570 1089928110 /nfs/dbraw/zinc/92/81/10/1089928110.db2.gz DZBNRDDSFZEBJN-UHFFFAOYSA-N 1 1 362.813 4.127 20 5 FIBDMO C[NH+](C)Cc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000412307693 1089970415 /nfs/dbraw/zinc/97/04/15/1089970415.db2.gz MLVMTVMHZYPSBF-DLBZAZTESA-N 1 1 373.840 4.052 20 5 FIBDMO CC[C@@H](C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccccc1 ZINC000072588503 1090257145 /nfs/dbraw/zinc/25/71/45/1090257145.db2.gz YZYSHLZKDKPFBV-OAHLLOKOSA-N 1 1 366.421 4.446 20 5 FIBDMO COc1ccc(C(=O)C2CC[NH+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000014327144 1090470060 /nfs/dbraw/zinc/47/00/60/1090470060.db2.gz GJQHZJPLMSBXBP-HNNXBMFYSA-N 1 1 368.433 4.259 20 5 FIBDMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccn(-c3ccccc3)n1)CCCC2 ZINC000417340021 1090821271 /nfs/dbraw/zinc/82/12/71/1090821271.db2.gz LRQSTLAAHITFOE-OAQYLSRUSA-N 1 1 362.433 4.338 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572146 1090973470 /nfs/dbraw/zinc/97/34/70/1090973470.db2.gz ZIWWHNYUWCDCKP-AZUAARDMSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572146 1090973474 /nfs/dbraw/zinc/97/34/74/1090973474.db2.gz ZIWWHNYUWCDCKP-AZUAARDMSA-N 1 1 367.493 4.466 20 5 FIBDMO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000312572146 1090973475 /nfs/dbraw/zinc/97/34/75/1090973475.db2.gz ZIWWHNYUWCDCKP-AZUAARDMSA-N 1 1 367.493 4.466 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)c1ccc(Cl)c(F)c1)C1CC1 ZINC000759851963 1091327610 /nfs/dbraw/zinc/32/76/10/1091327610.db2.gz XDNMZDNDMJUDQD-GOSISDBHSA-N 1 1 364.804 4.085 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000512290790 1092012146 /nfs/dbraw/zinc/01/21/46/1092012146.db2.gz AXKLRTJPKLTETH-INIZCTEOSA-N 1 1 367.449 4.457 20 5 FIBDMO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000521402648 1092682208 /nfs/dbraw/zinc/68/22/08/1092682208.db2.gz BPGLYGRVWRJMEV-OAHLLOKOSA-N 1 1 362.433 4.002 20 5 FIBDMO CC[N@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236933403 1092810921 /nfs/dbraw/zinc/81/09/21/1092810921.db2.gz MRJDBGXORUAEJY-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CC[N@@H+]1CCC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236933403 1092810935 /nfs/dbraw/zinc/81/09/35/1092810935.db2.gz MRJDBGXORUAEJY-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CC[N@H+]1CCC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236933403 1092810951 /nfs/dbraw/zinc/81/09/51/1092810951.db2.gz MRJDBGXORUAEJY-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO CCN1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000236933403 1092810968 /nfs/dbraw/zinc/81/09/68/1092810968.db2.gz MRJDBGXORUAEJY-OAHLLOKOSA-N 1 1 359.495 4.145 20 5 FIBDMO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3CC[C@@H](c4ccccc4F)C3)co2)cc1 ZINC000549813928 1092832000 /nfs/dbraw/zinc/83/20/00/1092832000.db2.gz VHRZSGHYGNXTDO-OAHLLOKOSA-N 1 1 367.380 4.378 20 5 FIBDMO C[C@H](C[N@H+]1CCC[C@@H](C)C1)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000521813562 1092927958 /nfs/dbraw/zinc/92/79/58/1092927958.db2.gz ZIZRCKPJESWDFH-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO C[C@H](CN1CCC[C@@H](C)C1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000521813562 1092927959 /nfs/dbraw/zinc/92/79/59/1092927959.db2.gz ZIZRCKPJESWDFH-HZPDHXFCSA-N 1 1 357.454 4.065 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccncc1OCc1ccccc1 ZINC000512584380 1092962714 /nfs/dbraw/zinc/96/27/14/1092962714.db2.gz YKYDLFCSMDZSAX-UHFFFAOYSA-N 1 1 363.417 4.167 20 5 FIBDMO CCc1ccc([C@H](COC)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000433268269 1093511697 /nfs/dbraw/zinc/51/16/97/1093511697.db2.gz CUAMVUBJDTZIRH-MSOLQXFVSA-N 1 1 358.438 4.450 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000279961619 1093554690 /nfs/dbraw/zinc/55/46/90/1093554690.db2.gz CHCYPDUTPDNWPF-NEPJUHHUSA-N 1 1 364.243 4.473 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(Br)cn2)cc1[N+](=O)[O-] ZINC000279961628 1093555481 /nfs/dbraw/zinc/55/54/81/1093555481.db2.gz CHCYPDUTPDNWPF-VXGBXAGGSA-N 1 1 364.243 4.473 20 5 FIBDMO O=C(CC[N@H+]1CC[C@H](c2cccc(Cl)c2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000433308184 1093574648 /nfs/dbraw/zinc/57/46/48/1093574648.db2.gz XRFTWRGYMXNZQG-HNNXBMFYSA-N 1 1 373.840 4.066 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCCC[C@H]2c2nc3ccccc3o2)c1 ZINC000474229230 1093599333 /nfs/dbraw/zinc/59/93/33/1093599333.db2.gz HSRNBESTAIWHKT-SFHVURJKSA-N 1 1 367.405 4.342 20 5 FIBDMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCCC[C@H]2c2nc3ccccc3o2)c1 ZINC000474229230 1093599343 /nfs/dbraw/zinc/59/93/43/1093599343.db2.gz HSRNBESTAIWHKT-SFHVURJKSA-N 1 1 367.405 4.342 20 5 FIBDMO CC(C)[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C[C@H](C)O ZINC000513648945 1094253655 /nfs/dbraw/zinc/25/36/55/1094253655.db2.gz WIEIYVDEZOUSBI-AWEZNQCLSA-N 1 1 362.401 4.117 20 5 FIBDMO C[C@@H]([NH2+][C@H](C)c1ccc(Br)cn1)c1cccc([N+](=O)[O-])c1 ZINC000280187052 1094299674 /nfs/dbraw/zinc/29/96/74/1094299674.db2.gz SAOOCJATJXHQGI-GHMZBOCLSA-N 1 1 350.216 4.164 20 5 FIBDMO CC(C)(C)c1cn2c([nH+]1)CC[C@H](Nc1ccc([N+](=O)[O-])c3ncccc13)C2 ZINC000413113448 1094507547 /nfs/dbraw/zinc/50/75/47/1094507547.db2.gz WIIWBEHNLBGPGF-ZDUSSCGKSA-N 1 1 365.437 4.064 20 5 FIBDMO C[C@@H](Nc1ncc([N+](=O)[O-])cc1C(F)(F)F)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000413233265 1094765550 /nfs/dbraw/zinc/76/55/50/1094765550.db2.gz CRUGBYBBHAQPMX-NEPJUHHUSA-N 1 1 372.391 4.074 20 5 FIBDMO C[N@@H+](CCCNc1nccc2c1cccc2[N+](=O)[O-])Cc1ccccc1 ZINC000710680228 1095176531 /nfs/dbraw/zinc/17/65/31/1095176531.db2.gz DWUCFQVIIWVJHD-UHFFFAOYSA-N 1 1 350.422 4.077 20 5 FIBDMO Cc1c([C@@H](C)[NH2+]Cc2ccncc2OCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000281483809 1095554975 /nfs/dbraw/zinc/55/49/75/1095554975.db2.gz FWYCUFRIAHAWPU-GFCCVEGCSA-N 1 1 369.343 4.090 20 5 FIBDMO Cc1c([C@H](C)[NH2+]Cc2ccncc2OCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000281483835 1095555136 /nfs/dbraw/zinc/55/51/36/1095555136.db2.gz FWYCUFRIAHAWPU-LBPRGKRZSA-N 1 1 369.343 4.090 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000444162356 1095796009 /nfs/dbraw/zinc/79/60/09/1095796009.db2.gz AAITYKCCZGPGNG-DJJJIMSYSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000444162356 1095796019 /nfs/dbraw/zinc/79/60/19/1095796019.db2.gz AAITYKCCZGPGNG-DJJJIMSYSA-N 1 1 371.412 4.064 20 5 FIBDMO Cc1c(C[NH2+]Cc2ccc(F)cc2Br)cccc1[N+](=O)[O-] ZINC000231885479 1096126026 /nfs/dbraw/zinc/12/60/26/1096126026.db2.gz IONYWCIYSIBJBZ-UHFFFAOYSA-N 1 1 353.191 4.095 20 5 FIBDMO COCC[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccco1 ZINC000503953436 1096612468 /nfs/dbraw/zinc/61/24/68/1096612468.db2.gz SYYIEIDGHJJNNT-MRXNPFEDSA-N 1 1 356.378 4.315 20 5 FIBDMO Cc1ccc([C@H](C)NC[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000423483763 1096703150 /nfs/dbraw/zinc/70/31/50/1096703150.db2.gz ZICCFENHIVBQFI-ZAAXVRCTSA-N 1 1 371.456 4.086 20 5 FIBDMO C[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1Cl ZINC000008173451 1096797079 /nfs/dbraw/zinc/79/70/79/1096797079.db2.gz YKAACZHGDGEIEE-JTQLQIEISA-N 1 1 368.220 4.191 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(C)c1 ZINC000532931174 1098603098 /nfs/dbraw/zinc/60/30/98/1098603098.db2.gz VCZAPXMQLMNYRC-INIZCTEOSA-N 1 1 355.438 4.152 20 5 FIBDMO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c(C)c1 ZINC000532930494 1098603505 /nfs/dbraw/zinc/60/35/05/1098603505.db2.gz QBPOSHPPDIOUEN-MRXNPFEDSA-N 1 1 355.438 4.152 20 5 FIBDMO Cc1ccc([C@@H](C)[N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c(C)c1 ZINC000532930494 1098603510 /nfs/dbraw/zinc/60/35/10/1098603510.db2.gz QBPOSHPPDIOUEN-MRXNPFEDSA-N 1 1 355.438 4.152 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCCC[C@H]1c1ccco1 ZINC000532976522 1098647524 /nfs/dbraw/zinc/64/75/24/1098647524.db2.gz GAYLWZYJZRTUMR-SFHVURJKSA-N 1 1 371.437 4.442 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000532978553 1098649316 /nfs/dbraw/zinc/64/93/16/1098649316.db2.gz VQDBAYMHZONZSK-AEFFLSMTSA-N 1 1 367.449 4.110 20 5 FIBDMO Cc1ccc([C@H](C)[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000533243902 1098901302 /nfs/dbraw/zinc/90/13/02/1098901302.db2.gz HIFJHUCKMAZZSE-INIZCTEOSA-N 1 1 355.438 4.233 20 5 FIBDMO Cc1cccc([C@H]2CCC[N@@H+]2CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000533295319 1098949624 /nfs/dbraw/zinc/94/96/24/1098949624.db2.gz UTMUHBCOKVCRGE-HXUWFJFHSA-N 1 1 367.449 4.012 20 5 FIBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000533303365 1098955218 /nfs/dbraw/zinc/95/52/18/1098955218.db2.gz RIKOFMFWADKGLF-DZGCQCFKSA-N 1 1 373.840 4.065 20 5 FIBDMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000533303365 1098955223 /nfs/dbraw/zinc/95/52/23/1098955223.db2.gz RIKOFMFWADKGLF-DZGCQCFKSA-N 1 1 373.840 4.065 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425553329 1099025644 /nfs/dbraw/zinc/02/56/44/1099025644.db2.gz MFLSNNIITDPNBQ-QGZVFWFLSA-N 1 1 350.846 4.029 20 5 FIBDMO O=C(C[N@@H+](CC1CC1)C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000533413595 1099034978 /nfs/dbraw/zinc/03/49/78/1099034978.db2.gz ZMARQAOATJJYNY-UHFFFAOYSA-N 1 1 365.861 4.231 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CCC2(C1)CCCCC2 ZINC000533427391 1099047490 /nfs/dbraw/zinc/04/74/90/1099047490.db2.gz MYMZIQSEDJQIHQ-CYBMUJFWSA-N 1 1 365.861 4.231 20 5 FIBDMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CCC2(C1)CCCCC2 ZINC000533427391 1099047502 /nfs/dbraw/zinc/04/75/02/1099047502.db2.gz MYMZIQSEDJQIHQ-CYBMUJFWSA-N 1 1 365.861 4.231 20 5 FIBDMO Cc1ccc(C)c(NC(=O)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000064350503 1099344618 /nfs/dbraw/zinc/34/46/18/1099344618.db2.gz MVDZLRMAHAZBNB-UHFFFAOYSA-N 1 1 355.438 4.061 20 5 FIBDMO Cc1ccc(C)c(NC(=O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000064350503 1099344631 /nfs/dbraw/zinc/34/46/31/1099344631.db2.gz MVDZLRMAHAZBNB-UHFFFAOYSA-N 1 1 355.438 4.061 20 5 FIBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc(OC)c(OC)c1 ZINC000506016172 1099771255 /nfs/dbraw/zinc/77/12/55/1099771255.db2.gz FPZFWUXXBUYZJR-VQHVLOKHSA-N 1 1 356.422 4.147 20 5 FIBDMO O=C(CC[N@H+]1CC[C@@H](c2ccc(Cl)cc2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000517108643 1100076699 /nfs/dbraw/zinc/07/66/99/1100076699.db2.gz GOSBHIRHOCHIOZ-OAHLLOKOSA-N 1 1 373.840 4.066 20 5 FIBDMO CC(C)(C)[N@H+]1CCCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000536653846 1100109545 /nfs/dbraw/zinc/10/95/45/1100109545.db2.gz SVPIAVUEQCVSIK-UHFFFAOYSA-N 1 1 374.510 4.025 20 5 FIBDMO CN(C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000536673572 1100158519 /nfs/dbraw/zinc/15/85/19/1100158519.db2.gz MECBUBCCKIBXKE-RVPHRTOXSA-N 1 1 365.477 4.062 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000536703802 1100210126 /nfs/dbraw/zinc/21/01/26/1100210126.db2.gz ZNINXKKZJTYCPH-OLZOCXBDSA-N 1 1 365.861 4.087 20 5 FIBDMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+]1CC[C@@H](C)C2(CCC2)C1 ZINC000536703802 1100210136 /nfs/dbraw/zinc/21/01/36/1100210136.db2.gz ZNINXKKZJTYCPH-OLZOCXBDSA-N 1 1 365.861 4.087 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCc3ncsc3C2)s1 ZINC000438351174 1100608713 /nfs/dbraw/zinc/60/87/13/1100608713.db2.gz CQHKJXMUMPLRCD-UHFFFAOYSA-N 1 1 357.460 4.338 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCc3ncsc3C2)s1 ZINC000438351174 1100608717 /nfs/dbraw/zinc/60/87/17/1100608717.db2.gz CQHKJXMUMPLRCD-UHFFFAOYSA-N 1 1 357.460 4.338 20 5 FIBDMO CC(C)N1CCC([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000506325225 1100866722 /nfs/dbraw/zinc/86/67/22/1100866722.db2.gz HXDQMNLGVGCOMN-UHFFFAOYSA-N 1 1 357.454 4.159 20 5 FIBDMO CC(C)N1CCC([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000506325225 1100866730 /nfs/dbraw/zinc/86/67/30/1100866730.db2.gz HXDQMNLGVGCOMN-UHFFFAOYSA-N 1 1 357.454 4.159 20 5 FIBDMO C[N@@H+](CCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCC1 ZINC000518276610 1101070969 /nfs/dbraw/zinc/07/09/69/1101070969.db2.gz GRFZSFIZAGLNET-UHFFFAOYSA-N 1 1 357.454 4.209 20 5 FIBDMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H]2CCCc2ccccc2)c1 ZINC001168153006 1101464586 /nfs/dbraw/zinc/46/45/86/1101464586.db2.gz DGHSRYKOCJYPJT-CTNGQTDRSA-N 1 1 354.450 4.116 20 5 FIBDMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccccc1OCC(C)C ZINC000509605528 1101554891 /nfs/dbraw/zinc/55/48/91/1101554891.db2.gz 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Cc1c(NC(=O)CC[N@H+]2CCCCC[C@@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000532575856 1102498180 /nfs/dbraw/zinc/49/81/80/1102498180.db2.gz FHVLIVFBNOFWNH-GOSISDBHSA-N 1 1 371.437 4.442 20 5 FIBDMO CC[N@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000508664665 1102550588 /nfs/dbraw/zinc/55/05/88/1102550588.db2.gz UJRRJTRINUAXIU-CQSZACIVSA-N 1 1 374.437 4.204 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@H](C)c1cccc(OC)c1 ZINC000508664665 1102550595 /nfs/dbraw/zinc/55/05/95/1102550595.db2.gz UJRRJTRINUAXIU-CQSZACIVSA-N 1 1 374.437 4.204 20 5 FIBDMO CC[N@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000508664664 1102551006 /nfs/dbraw/zinc/55/10/06/1102551006.db2.gz UJRRJTRINUAXIU-AWEZNQCLSA-N 1 1 374.437 4.204 20 5 FIBDMO CC[N@@H+](Cc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1cccc(OC)c1 ZINC000508664664 1102551017 /nfs/dbraw/zinc/55/10/17/1102551017.db2.gz UJRRJTRINUAXIU-AWEZNQCLSA-N 1 1 374.437 4.204 20 5 FIBDMO 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ZINC000507167600 1103167513 /nfs/dbraw/zinc/16/75/13/1103167513.db2.gz MQNLSEWPGGQYHF-UHFFFAOYSA-N 1 1 366.396 4.289 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1c[nH]nc1-c1ccc(F)cc1)C1CC1 ZINC000507167600 1103167522 /nfs/dbraw/zinc/16/75/22/1103167522.db2.gz MQNLSEWPGGQYHF-UHFFFAOYSA-N 1 1 366.396 4.289 20 5 FIBDMO COc1cc(C[N@H+](Cc2cccc(F)c2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000507173162 1103191119 /nfs/dbraw/zinc/19/11/19/1103191119.db2.gz KWVAXEMDMQNSBP-UHFFFAOYSA-N 1 1 362.401 4.162 20 5 FIBDMO COc1cc(C[N@@H+](Cc2cccc(F)c2)C(C)C)c([N+](=O)[O-])cc1OC ZINC000507173162 1103191124 /nfs/dbraw/zinc/19/11/24/1103191124.db2.gz KWVAXEMDMQNSBP-UHFFFAOYSA-N 1 1 362.401 4.162 20 5 FIBDMO COc1cc(C[N@@H+](C)[C@H](C)C(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000507246141 1103248328 /nfs/dbraw/zinc/24/83/28/1103248328.db2.gz GXOSOIDQQMMFAI-LLVKDONJSA-N 1 1 364.364 4.021 20 5 FIBDMO Cc1ccc(Sc2ccc(C[N@@H+]3CC[C@H]([C@@H](C)O)C3)cc2[N+](=O)[O-])cc1 ZINC000507700956 1103630181 /nfs/dbraw/zinc/63/01/81/1103630181.db2.gz YBUKAKODIWJIAK-WBVHZDCISA-N 1 1 372.490 4.257 20 5 FIBDMO Cc1c(CN[C@@H]2CC[N@H+](Cc3ccccc3)C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000519650562 1103767421 /nfs/dbraw/zinc/76/74/21/1103767421.db2.gz JQGDBROQSPVPLL-HXUWFJFHSA-N 1 1 365.477 4.190 20 5 FIBDMO Cc1c(CN[C@@H]2CC[N@@H+](Cc3ccccc3)C3(CC3)C2)cccc1[N+](=O)[O-] ZINC000519650562 1103767438 /nfs/dbraw/zinc/76/74/38/1103767438.db2.gz JQGDBROQSPVPLL-HXUWFJFHSA-N 1 1 365.477 4.190 20 5 FIBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C[C@@H]1CCC[C@H]1O ZINC000537709491 1103870077 /nfs/dbraw/zinc/87/00/77/1103870077.db2.gz FVDUEXMXTDHWEM-YVEFUNNKSA-N 1 1 364.829 4.101 20 5 FIBDMO CCc1ccc(C[N@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000536319349 1104705527 /nfs/dbraw/zinc/70/55/27/1104705527.db2.gz HGPNTLHFVUQSPF-UHFFFAOYSA-N 1 1 351.406 4.444 20 5 FIBDMO CCc1ccc(C[N@@H+](C)Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000536319349 1104705535 /nfs/dbraw/zinc/70/55/35/1104705535.db2.gz HGPNTLHFVUQSPF-UHFFFAOYSA-N 1 1 351.406 4.444 20 5 FIBDMO CCc1ccc([C@@H]([NH2+]C[C@@H]2CCC(C)(C)O2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427957722 1105328046 /nfs/dbraw/zinc/32/80/46/1105328046.db2.gz LAQXVCIISQQLCG-HKUYNNGSSA-N 1 1 358.438 4.387 20 5 FIBDMO O=[N+]([O-])c1ccccc1CN1CC[C@]2(C1)CCC[N@@H+](Cc1ccccc1)C2 ZINC000530626141 1107205539 /nfs/dbraw/zinc/20/55/39/1107205539.db2.gz QLAOVHZKUGQPEY-JOCHJYFZSA-N 1 1 365.477 4.083 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@@](C)(OC)CC3)o2)c([N+](=O)[O-])c1 ZINC000475571872 1107773351 /nfs/dbraw/zinc/77/33/51/1107773351.db2.gz NZAXLLNIKWYPMB-HXUWFJFHSA-N 1 1 374.437 4.254 20 5 FIBDMO COc1ccc(-c2ccc(C[N@H+]3CCC[C@](C)(OC)CC3)o2)c([N+](=O)[O-])c1 ZINC000475571871 1107773741 /nfs/dbraw/zinc/77/37/41/1107773741.db2.gz NZAXLLNIKWYPMB-FQEVSTJZSA-N 1 1 374.437 4.254 20 5 FIBDMO CCC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(F)cc1 ZINC000520174126 1107945423 /nfs/dbraw/zinc/94/54/23/1107945423.db2.gz UZLIJZVJHASHGC-UHFFFAOYSA-N 1 1 370.384 4.196 20 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Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444689957 1108091260 /nfs/dbraw/zinc/09/12/60/1108091260.db2.gz PWNHNWOPYUFADV-LBPRGKRZSA-N 1 1 350.378 4.377 20 5 FIBDMO Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444689956 1108092880 /nfs/dbraw/zinc/09/28/80/1108092880.db2.gz PWNHNWOPYUFADV-GFCCVEGCSA-N 1 1 350.378 4.377 20 5 FIBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C(=O)c2ccc(F)cc2)C1 ZINC000523451606 1108213443 /nfs/dbraw/zinc/21/34/43/1108213443.db2.gz LJADJUASULHGJA-PBHICJAKSA-N 1 1 356.397 4.390 20 5 FIBDMO C[C@H](c1cccc(Nc2c(F)cc([N+](=O)[O-])cc2F)c1)[NH+]1CCOCC1 ZINC000440587346 1108288252 /nfs/dbraw/zinc/28/82/52/1108288252.db2.gz FINIIGRSMCLXOF-GFCCVEGCSA-N 1 1 363.364 4.010 20 5 FIBDMO CCC[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CC(C)(C)C(N)=O)C1 ZINC000453282834 1108358100 /nfs/dbraw/zinc/35/81/00/1108358100.db2.gz OIRVTEFUUOPZHJ-CRAIPNDOSA-N 1 1 361.486 4.050 20 5 FIBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(Br)s1 ZINC000523701987 1108454631 /nfs/dbraw/zinc/45/46/31/1108454631.db2.gz BPKIOSLYRRQSLR-UHFFFAOYSA-N 1 1 355.257 4.093 20 5 FIBDMO Cc1ccc(C[N@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)o1 ZINC000475624146 1108560086 /nfs/dbraw/zinc/56/00/86/1108560086.db2.gz ZCYICBFNDWOWSY-UHFFFAOYSA-N 1 1 372.446 4.219 20 5 FIBDMO Cc1ccc(C[N@@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)o1 ZINC000475624146 1108560101 /nfs/dbraw/zinc/56/01/01/1108560101.db2.gz ZCYICBFNDWOWSY-UHFFFAOYSA-N 1 1 372.446 4.219 20 5 FIBDMO C[C@H]([NH2+]Cc1cc(F)ccc1Br)c1cccc([N+](=O)[O-])c1 ZINC000038039038 1108600734 /nfs/dbraw/zinc/60/07/34/1108600734.db2.gz VYGICAAMIJGNKU-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000523841098 1108603571 /nfs/dbraw/zinc/60/35/71/1108603571.db2.gz KRXLKPTZGVUAJP-GOSISDBHSA-N 1 1 360.841 4.429 20 5 FIBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000523841098 1108603573 /nfs/dbraw/zinc/60/35/73/1108603573.db2.gz KRXLKPTZGVUAJP-GOSISDBHSA-N 1 1 360.841 4.429 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCCc3c[nH]nc32)s1 ZINC000532210146 1108710900 /nfs/dbraw/zinc/71/09/00/1108710900.db2.gz BDHSWNYRVSSJII-HNNXBMFYSA-N 1 1 354.435 4.214 20 5 FIBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCCc3c[nH]nc32)s1 ZINC000532210147 1108711376 /nfs/dbraw/zinc/71/13/76/1108711376.db2.gz BDHSWNYRVSSJII-OAHLLOKOSA-N 1 1 354.435 4.214 20 5 FIBDMO O=[N+]([O-])c1cccc(C[NH2+][C@H](CO)c2ccc(Cl)cc2C(F)(F)F)c1 ZINC000475633991 1108951197 /nfs/dbraw/zinc/95/11/97/1108951197.db2.gz IETOQSFORQQRHY-OAHLLOKOSA-N 1 1 374.746 4.090 20 5 FIBDMO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cc(Cl)cc(Cl)c3)nc2c1 ZINC000446839802 1109361179 /nfs/dbraw/zinc/36/11/79/1109361179.db2.gz VCUCKVJADLFDKZ-UHFFFAOYSA-N 1 1 351.193 4.068 20 5 FIBDMO Cc1cnc(C[NH2+]Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)s1 ZINC000525695377 1109485799 /nfs/dbraw/zinc/48/57/99/1109485799.db2.gz XDIMKSSXHLVUKQ-UHFFFAOYSA-N 1 1 368.462 4.417 20 5 FIBDMO C[C@@H]1C[C@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000525709015 1109487817 /nfs/dbraw/zinc/48/78/17/1109487817.db2.gz DCFGVVLHPVLAAA-RHSMWYFYSA-N 1 1 373.428 4.099 20 5 FIBDMO C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCN1C ZINC000525709015 1109487826 /nfs/dbraw/zinc/48/78/26/1109487826.db2.gz DCFGVVLHPVLAAA-RHSMWYFYSA-N 1 1 373.428 4.099 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000527054953 1109681263 /nfs/dbraw/zinc/68/12/63/1109681263.db2.gz BHTKVTJQTTWVHR-RQPMMQJISA-N 1 1 358.360 4.041 20 5 FIBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](OCC(F)(F)F)C1 ZINC000527054953 1109681264 /nfs/dbraw/zinc/68/12/64/1109681264.db2.gz BHTKVTJQTTWVHR-RQPMMQJISA-N 1 1 358.360 4.041 20 5 FIBDMO CO[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C[C@H]1C ZINC000449492916 1110087364 /nfs/dbraw/zinc/08/73/64/1110087364.db2.gz CUQAUINPSIYPCN-PXAZEXFGSA-N 1 1 364.829 4.365 20 5 FIBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000449517162 1110097460 /nfs/dbraw/zinc/09/74/60/1110097460.db2.gz JAUBNBBGFBUXOE-PZBSJLNOSA-N 1 1 356.466 4.279 20 5 FIBDMO CC(C)c1ccc(C[N@@H+](C)C2CCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000449756793 1110164018 /nfs/dbraw/zinc/16/40/18/1110164018.db2.gz BXNDNMPULVUGMA-UHFFFAOYSA-N 1 1 373.419 4.177 20 5 FIBDMO C[N@@H+](CCCc1cc(-c2ccccc2)n[nH]1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000728926618 1110169559 /nfs/dbraw/zinc/16/95/59/1110169559.db2.gz LUAFRLSQGYAGHT-UHFFFAOYSA-N 1 1 368.412 4.189 20 5 FIBDMO CCCC[N@@H+](C)CC1CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000450263280 1110272624 /nfs/dbraw/zinc/27/26/24/1110272624.db2.gz BDBVMHFQNXQORB-UHFFFAOYSA-N 1 1 356.470 4.091 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](C4CCOCC4)C3)o2)c1 ZINC000538750083 1111280715 /nfs/dbraw/zinc/28/07/15/1111280715.db2.gz ZBYBNBGRVVBZGK-KRWDZBQOSA-N 1 1 356.422 4.103 20 5 FIBDMO Cc1cc(NCCc2cn3c([nH+]2)CCCC3)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461740134 1111344000 /nfs/dbraw/zinc/34/40/00/1111344000.db2.gz SLJVDROYHWJMQT-UHFFFAOYSA-N 1 1 368.359 4.109 20 5 FIBDMO CCCCn1cc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)c(C)n1 ZINC000539106490 1111425435 /nfs/dbraw/zinc/42/54/35/1111425435.db2.gz XHNXYUCLQBMKJI-UHFFFAOYSA-N 1 1 368.437 4.450 20 5 FIBDMO C[C@@H]1CCCC[C@H]1CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000552045350 1111556097 /nfs/dbraw/zinc/55/60/97/1111556097.db2.gz DXDCPVVFNHKSFN-JTDSTZFVSA-N 1 1 356.470 4.224 20 5 FIBDMO C[C@@H](CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000552048924 1111557792 /nfs/dbraw/zinc/55/77/92/1111557792.db2.gz DCOUHQISXOOXMT-JXFKEZNVSA-N 1 1 364.449 4.201 20 5 FIBDMO CCc1nc2c(s1)[C@@H]([N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000478051478 1111666766 /nfs/dbraw/zinc/66/67/66/1111666766.db2.gz CBSZQFXGWYSSND-INIZCTEOSA-N 1 1 361.467 4.002 20 5 FIBDMO CC(C)[C@@]1(CO)CCC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000552406916 1111697746 /nfs/dbraw/zinc/69/77/46/1111697746.db2.gz XNUTVXOCPPFBFP-FQEVSTJZSA-N 1 1 358.438 4.085 20 5 FIBDMO CCC(=O)c1ccc(NC[C@@H](c2ccc(C)o2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000479986627 1112221559 /nfs/dbraw/zinc/22/15/59/1112221559.db2.gz JGQZPBXDDXKZFS-SFHVURJKSA-N 1 1 371.437 4.338 20 5 FIBDMO Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1NC(=O)C1CC(F)C1 ZINC001142577247 1112269722 /nfs/dbraw/zinc/26/97/22/1112269722.db2.gz TWPMDIWIJCMJKI-UHFFFAOYSA-N 1 1 351.425 4.449 20 5 FIBDMO CC[C@H]([NH2+][C@@H](CN1CCCC1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000480278556 1112370631 /nfs/dbraw/zinc/37/06/31/1112370631.db2.gz PAHYEOBISPWQIK-SFTDATJTSA-N 1 1 353.466 4.473 20 5 FIBDMO Cc1oc(-c2ccccc2)nc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000554847192 1112527538 /nfs/dbraw/zinc/52/75/38/1112527538.db2.gz SNSKCXDKKOCIDW-UHFFFAOYSA-N 1 1 351.406 4.233 20 5 FIBDMO COc1ccccc1O[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000554873671 1112539649 /nfs/dbraw/zinc/53/96/49/1112539649.db2.gz PDEDTLRHGODNGH-YOCVDRLZSA-N 1 1 368.433 4.160 20 5 FIBDMO C[C@H](c1cccc(Cl)c1F)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000480767184 1112585987 /nfs/dbraw/zinc/58/59/87/1112585987.db2.gz DLMQKDMVPNPWLU-VXGBXAGGSA-N 1 1 364.808 4.030 20 5 FIBDMO C[C@H](c1cccc(Cl)c1F)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000480767184 1112585993 /nfs/dbraw/zinc/58/59/93/1112585993.db2.gz DLMQKDMVPNPWLU-VXGBXAGGSA-N 1 1 364.808 4.030 20 5 FIBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000006995746 1113170496 /nfs/dbraw/zinc/17/04/96/1113170496.db2.gz PFCQTAMVHVRVST-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000006995746 1113170497 /nfs/dbraw/zinc/17/04/97/1113170497.db2.gz PFCQTAMVHVRVST-AWEZNQCLSA-N 1 1 352.394 4.146 20 5 FIBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H](CO)c1ccc(Cl)cc1C(F)(F)F ZINC000483267206 1113477135 /nfs/dbraw/zinc/47/71/35/1113477135.db2.gz BXUTVWTXPCFJGM-CQSZACIVSA-N 1 1 374.746 4.090 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+](CC3CC3)CC3CCC3)o2)c1 ZINC000483271380 1113477785 /nfs/dbraw/zinc/47/77/85/1113477785.db2.gz RMKSKNKSVVFFOC-UHFFFAOYSA-N 1 1 355.438 4.304 20 5 FIBDMO C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486551911 1113593449 /nfs/dbraw/zinc/59/34/49/1113593449.db2.gz UJUGEQLAUDSFOO-IITQPQQBSA-N 1 1 365.477 4.108 20 5 FIBDMO C[C@H](NC/C=C/c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000486551911 1113593453 /nfs/dbraw/zinc/59/34/53/1113593453.db2.gz UJUGEQLAUDSFOO-IITQPQQBSA-N 1 1 365.477 4.108 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2c2cccc(N(C)C)c2)ccc1[N+](=O)[O-] ZINC000490083614 1114216601 /nfs/dbraw/zinc/21/66/01/1114216601.db2.gz BDYCKLKVDCEEFC-GOSISDBHSA-N 1 1 355.438 4.007 20 5 FIBDMO COc1cc(C[N@H+]2CCC[C@@H]2C2CCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000491089491 1114371949 /nfs/dbraw/zinc/37/19/49/1114371949.db2.gz GBNRCWMPEIVJLJ-CQSZACIVSA-N 1 1 370.396 4.012 20 5 FIBDMO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000590967260 1114997735 /nfs/dbraw/zinc/99/77/35/1114997735.db2.gz WETAOHHVIVORPP-IYBDPMFKSA-N 1 1 370.380 4.222 20 5 FIBDMO O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000590967260 1114997743 /nfs/dbraw/zinc/99/77/43/1114997743.db2.gz WETAOHHVIVORPP-IYBDPMFKSA-N 1 1 370.380 4.222 20 5 FIBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cccnc1OC1CCCC1 ZINC000594494631 1115450014 /nfs/dbraw/zinc/45/00/14/1115450014.db2.gz ONAAOEYXMRQBEZ-GOSISDBHSA-N 1 1 353.422 4.088 20 5 FIBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](c1ccc(F)cc1)[C@H]1CCCO1 ZINC000595016965 1115503883 /nfs/dbraw/zinc/50/38/83/1115503883.db2.gz SQNWXVNGTBOIID-VIZZQPHQSA-N 1 1 374.412 4.313 20 5 FIBDMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000594981682 1115505065 /nfs/dbraw/zinc/50/50/65/1115505065.db2.gz BJNKSMXNOYSZFJ-UHFFFAOYSA-N 1 1 366.421 4.146 20 5 FIBDMO O=[N+]([O-])c1cc(CNC[C@@H]2C[N@@H+](Cc3ccccc3)CC23CCC3)cs1 ZINC000595001185 1115506842 /nfs/dbraw/zinc/50/68/42/1115506842.db2.gz RNXNSNLBOAMBQD-GOSISDBHSA-N 1 1 371.506 4.048 20 5 FIBDMO Cc1noc(C[NH2+][C@H](c2ccc(C(F)(F)F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000595419849 1115535152 /nfs/dbraw/zinc/53/51/52/1115535152.db2.gz MARLESOQHWCNCA-AWEZNQCLSA-N 1 1 357.332 4.397 20 5 FIBDMO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000595431745 1115536181 /nfs/dbraw/zinc/53/61/81/1115536181.db2.gz GYZRKJKGQZNMHA-MJGOQNOKSA-N 1 1 362.376 4.225 20 5 FIBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+]C1(c2ccc(OC(F)(F)F)cc2)CC1 ZINC000595506281 1115539486 /nfs/dbraw/zinc/53/94/86/1115539486.db2.gz BWVAFYNZOCAOPE-UHFFFAOYSA-N 1 1 370.302 4.411 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](Cc1ccsc1)C(C)(C)C ZINC000595603176 1115553295 /nfs/dbraw/zinc/55/32/95/1115553295.db2.gz YLFKDTLCIIAJBJ-UHFFFAOYSA-N 1 1 361.467 4.204 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](Cc1ccsc1)C(C)(C)C ZINC000595603176 1115553297 /nfs/dbraw/zinc/55/32/97/1115553297.db2.gz YLFKDTLCIIAJBJ-UHFFFAOYSA-N 1 1 361.467 4.204 20 5 FIBDMO Cc1ccc(CNc2ccc(C(F)F)cc2[N+](=O)[O-])c(N2CCCC2)[nH+]1 ZINC000596186459 1115576513 /nfs/dbraw/zinc/57/65/13/1115576513.db2.gz KLQDYDHZGBZSMM-UHFFFAOYSA-N 1 1 362.380 4.448 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH2+][C@H](CCO)c2cc(Cl)cc(Cl)c2)c(F)c1 ZINC000599013070 1115778901 /nfs/dbraw/zinc/77/89/01/1115778901.db2.gz JCXBHNAZHKFLJK-MRXNPFEDSA-N 1 1 373.211 4.254 20 5 FIBDMO O=[N+]([O-])c1cc(C[NH2+][C@H](CCO)c2cc(Cl)cc(Cl)c2)cs1 ZINC000599017025 1115779790 /nfs/dbraw/zinc/77/97/90/1115779790.db2.gz VZDMWSIYYGANNS-CYBMUJFWSA-N 1 1 361.250 4.176 20 5 FIBDMO CCc1ccc([C@@H](NC[C@H]2CCCC[N@@H+](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000599072034 1115786993 /nfs/dbraw/zinc/78/69/93/1115786993.db2.gz WZELYUUUCZYSPF-IERDGZPVSA-N 1 1 371.481 4.161 20 5 FIBDMO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCCc2ccccc21 ZINC000603580792 1115796273 /nfs/dbraw/zinc/79/62/73/1115796273.db2.gz HQQFQIWYVWLLHN-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCCc2ccccc21 ZINC000603580792 1115796274 /nfs/dbraw/zinc/79/62/74/1115796274.db2.gz HQQFQIWYVWLLHN-GOSISDBHSA-N 1 1 364.405 4.154 20 5 FIBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(CNc3ncccc3[N+](=O)[O-])cc2)C1 ZINC000603862715 1115822956 /nfs/dbraw/zinc/82/29/56/1115822956.db2.gz WNQJNDWEVBGWDX-IYBDPMFKSA-N 1 1 354.454 4.080 20 5 FIBDMO COc1cc(C[N@H+](C)Cc2cccc(C)c2)c([N+](=O)[O-])cc1OC(F)F ZINC000603859936 1115825351 /nfs/dbraw/zinc/82/53/51/1115825351.db2.gz LAWJJZQGDXKFTO-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO COc1cc(C[N@@H+](C)Cc2cccc(C)c2)c([N+](=O)[O-])cc1OC(F)F ZINC000603859936 1115825356 /nfs/dbraw/zinc/82/53/56/1115825356.db2.gz LAWJJZQGDXKFTO-UHFFFAOYSA-N 1 1 366.364 4.145 20 5 FIBDMO Cc1cccc([C@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C(C)C)c1 ZINC000599628637 1115832094 /nfs/dbraw/zinc/83/20/94/1115832094.db2.gz CFVMSSRXQXVLRB-LJQANCHMSA-N 1 1 366.421 4.440 20 5 FIBDMO C/C=C\C[C@@H]1CCC[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599689601 1115836138 /nfs/dbraw/zinc/83/61/38/1115836138.db2.gz JZYKUYLKBPCGIW-VUBDOFJKSA-N 1 1 356.426 4.384 20 5 FIBDMO C[C@H](c1ccc(F)c(F)c1)[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012521 1115840725 /nfs/dbraw/zinc/84/07/25/1115840725.db2.gz LNGOPYGOXLJEEY-CYBMUJFWSA-N 1 1 350.365 4.335 20 5 FIBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC(F)F)cc1 ZINC000604012724 1115840873 /nfs/dbraw/zinc/84/08/73/1115840873.db2.gz VJUAKBRXVDWYGT-UHFFFAOYSA-N 1 1 366.364 4.097 20 5 FIBDMO CC(C)[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCC1 ZINC000608835643 1116130981 /nfs/dbraw/zinc/13/09/81/1116130981.db2.gz GJPILWHAXRJSLV-IBGZPJMESA-N 1 1 357.454 4.065 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+](CC3CC3)C3CCCCC3)n2)c1 ZINC000609040629 1116142278 /nfs/dbraw/zinc/14/22/78/1116142278.db2.gz QYUIXONGKNDMCK-UHFFFAOYSA-N 1 1 356.426 4.190 20 5 FIBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000534108678 1116161248 /nfs/dbraw/zinc/16/12/48/1116161248.db2.gz KYAPHSVMBGKATB-NRFANRHFSA-N 1 1 363.417 4.413 20 5 FIBDMO Cc1ccc2[nH]c([C@H]3CCC[N@@H+](Cc4cccc([N+](=O)[O-])c4)C3)nc2c1 ZINC000534951685 1116255374 /nfs/dbraw/zinc/25/53/74/1116255374.db2.gz HPLBRGIJYSNIBI-INIZCTEOSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@H]3CCC[N@H+](Cc4cccc([N+](=O)[O-])c4)C3)[nH]c2c1 ZINC000534951685 1116255375 /nfs/dbraw/zinc/25/53/75/1116255375.db2.gz HPLBRGIJYSNIBI-INIZCTEOSA-N 1 1 350.422 4.159 20 5 FIBDMO Cc1ccc2nc([C@H]3CCC[N@@H+](Cc4cccc([N+](=O)[O-])c4)C3)[nH]c2c1 ZINC000534951685 1116255376 /nfs/dbraw/zinc/25/53/76/1116255376.db2.gz HPLBRGIJYSNIBI-INIZCTEOSA-N 1 1 350.422 4.159 20 5 FIBDMO C[C@H](Cc1ccc(O)cc1)[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089910132 1116351584 /nfs/dbraw/zinc/35/15/84/1116351584.db2.gz GDTJWQBWVOVCQQ-CQSZACIVSA-N 1 1 367.405 4.018 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nnc(C4CCCCC4)[nH]3)C2)cc1 ZINC000539765065 1116377516 /nfs/dbraw/zinc/37/75/16/1116377516.db2.gz JFHRJULGRJGSSB-QGZVFWFLSA-N 1 1 369.469 4.140 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3nc(C4CCCCC4)n[nH]3)C2)cc1 ZINC000539765065 1116377518 /nfs/dbraw/zinc/37/75/18/1116377518.db2.gz JFHRJULGRJGSSB-QGZVFWFLSA-N 1 1 369.469 4.140 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3nc(C4CCCCC4)n[nH]3)C2)cc1 ZINC000539765065 1116377519 /nfs/dbraw/zinc/37/75/19/1116377519.db2.gz JFHRJULGRJGSSB-QGZVFWFLSA-N 1 1 369.469 4.140 20 5 FIBDMO C[C@@H](c1ccsc1)[NH+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000462695967 1116391993 /nfs/dbraw/zinc/39/19/93/1116391993.db2.gz QGHBGRWDBKEVGF-AWEZNQCLSA-N 1 1 368.462 4.088 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H]3CC[N@@H+](CC4CCCC4)C3)o2)c1 ZINC000462740094 1117743511 /nfs/dbraw/zinc/74/35/11/1117743511.db2.gz RINRXMUPGGGFBU-GOSISDBHSA-N 1 1 369.465 4.209 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3CCN(CC4CCCC4)C3)o2)c1 ZINC000462740094 1117743513 /nfs/dbraw/zinc/74/35/13/1117743513.db2.gz RINRXMUPGGGFBU-GOSISDBHSA-N 1 1 369.465 4.209 20 5 FIBDMO Cc1noc(C[NH+]2CCC(Sc3ccc(Cl)cc3)CC2)c1[N+](=O)[O-] ZINC000595386607 1118172926 /nfs/dbraw/zinc/17/29/26/1118172926.db2.gz ISCLSDSABYQIRW-UHFFFAOYSA-N 1 1 367.858 4.301 20 5 FIBDMO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCc3ccccc3)CC2)c(Cl)c1 ZINC000541069031 1118374909 /nfs/dbraw/zinc/37/49/09/1118374909.db2.gz RGIMHJFWOLCYCF-UHFFFAOYSA-N 1 1 360.841 4.429 20 5 FIBDMO CCc1ccc([C@H]([NH2+]CCc2ccccc2O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541543887 1118549561 /nfs/dbraw/zinc/54/95/61/1118549561.db2.gz UMIIVWOHSYUHOL-OAQYLSRUSA-N 1 1 366.417 4.378 20 5 FIBDMO CCc1ccc([C@H]([NH2+]CCc2c(C)noc2C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541546054 1118550609 /nfs/dbraw/zinc/55/06/09/1118550609.db2.gz NOIGUONHBAYCFT-HXUWFJFHSA-N 1 1 369.421 4.277 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)c(Cl)c1 ZINC000541534557 1118553392 /nfs/dbraw/zinc/55/33/92/1118553392.db2.gz TUWRGWCNAWOPHJ-LJQANCHMSA-N 1 1 360.841 4.120 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](CCCO)[C@@H]2CCc3ccccc32)c(Cl)c1 ZINC000541534557 1118553394 /nfs/dbraw/zinc/55/33/94/1118553394.db2.gz TUWRGWCNAWOPHJ-LJQANCHMSA-N 1 1 360.841 4.120 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc(F)cc1OC(F)F ZINC000122445721 1118567903 /nfs/dbraw/zinc/56/79/03/1118567903.db2.gz WQHTUNMAWASUEM-JTQLQIEISA-N 1 1 370.327 4.195 20 5 FIBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000541701961 1118616900 /nfs/dbraw/zinc/61/69/00/1118616900.db2.gz ZTWZRZBPLQGYGD-XLIONFOSSA-N 1 1 374.412 4.095 20 5 FIBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000076342710 1118734271 /nfs/dbraw/zinc/73/42/71/1118734271.db2.gz OQBLDWQCWSRZLV-NSHDSACASA-N 1 1 367.858 4.077 20 5 FIBDMO Cc1ccc(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000076342710 1118734273 /nfs/dbraw/zinc/73/42/73/1118734273.db2.gz OQBLDWQCWSRZLV-NSHDSACASA-N 1 1 367.858 4.077 20 5 FIBDMO CCc1cnccc1[C@@H](C)[NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000542124188 1118798157 /nfs/dbraw/zinc/79/81/57/1118798157.db2.gz VXJMZHAIUJGKEN-CYBMUJFWSA-N 1 1 352.394 4.058 20 5 FIBDMO Cc1cccc([C@H]2CC[N@@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000542318076 1118900273 /nfs/dbraw/zinc/90/02/73/1118900273.db2.gz RMCUEXOWXKWWCA-SFHVURJKSA-N 1 1 367.449 4.030 20 5 FIBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H](CCO)c1ccccc1 ZINC000549861111 1118944831 /nfs/dbraw/zinc/94/48/31/1118944831.db2.gz ZJKDIOAURIMJNW-QGZVFWFLSA-N 1 1 368.355 4.169 20 5 FIBDMO COc1cc(C[NH2+][C@@H]2CCCc3sc(Cl)cc32)c([N+](=O)[O-])cc1O ZINC000492243916 1119054259 /nfs/dbraw/zinc/05/42/59/1119054259.db2.gz YBYFXGBZKTUJRV-LLVKDONJSA-N 1 1 368.842 4.191 20 5 FIBDMO CCOc1cc(C[N@H+]2CCC[C@H]2c2ccc(OC)cc2)ccc1[N+](=O)[O-] ZINC000492466952 1119099417 /nfs/dbraw/zinc/09/94/17/1119099417.db2.gz ZWMDOQNRVPUMAC-SFHVURJKSA-N 1 1 356.422 4.339 20 5 FIBDMO CCOc1cc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)ccc1[N+](=O)[O-] ZINC000492581296 1119135849 /nfs/dbraw/zinc/13/58/49/1119135849.db2.gz HUQCWRPTFLYULO-UHFFFAOYSA-N 1 1 362.376 4.441 20 5 FIBDMO COc1ccc2c(c1OC)CC[N@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000492756662 1119184375 /nfs/dbraw/zinc/18/43/75/1119184375.db2.gz KQMGNWXIYPVGNB-AWEZNQCLSA-N 1 1 356.422 4.040 20 5 FIBDMO COc1ccc2c(c1OC)CC[N@@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000492756662 1119184379 /nfs/dbraw/zinc/18/43/79/1119184379.db2.gz KQMGNWXIYPVGNB-AWEZNQCLSA-N 1 1 356.422 4.040 20 5 FIBDMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761507056 1119402999 /nfs/dbraw/zinc/40/29/99/1119402999.db2.gz SPEVNLIDPAOMRD-IJEWVQPXSA-N 1 1 351.878 4.085 20 5 FIBDMO O=[N+]([O-])c1ccc(C[N@H+](CCO)[C@@H]2CCCc3ccccc32)cc1Cl ZINC000761511767 1119405932 /nfs/dbraw/zinc/40/59/32/1119405932.db2.gz PDQZUBXKIPPARG-GOSISDBHSA-N 1 1 360.841 4.120 20 5 FIBDMO C[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C[N@@H+]1Cc1ccccc1 ZINC000761526498 1119410074 /nfs/dbraw/zinc/41/00/74/1119410074.db2.gz FDENJPUGQSEMJT-PBHICJAKSA-N 1 1 359.857 4.001 20 5 FIBDMO C[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])c(Cl)c2)C[N@H+]1Cc1ccccc1 ZINC000761526498 1119410076 /nfs/dbraw/zinc/41/00/76/1119410076.db2.gz FDENJPUGQSEMJT-PBHICJAKSA-N 1 1 359.857 4.001 20 5 FIBDMO CCc1ccc([C@@H](NCCC[N@@H+](C)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542476242 1119573615 /nfs/dbraw/zinc/57/36/15/1119573615.db2.gz CVWRLSRDRQSKSS-FQEVSTJZSA-N 1 1 359.470 4.160 20 5 FIBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Br)c(F)c1 ZINC000089512390 1120898914 /nfs/dbraw/zinc/89/89/14/1120898914.db2.gz SWYRPFOVFOHMOJ-JTQLQIEISA-N 1 1 353.191 4.347 20 5 FIBDMO C[C@@H]1CCCC[N@H+]1CCCCNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000915357635 1120932349 /nfs/dbraw/zinc/93/23/49/1120932349.db2.gz FQYPSCLHPJLAOI-CYBMUJFWSA-N 1 1 368.865 4.024 20 5 FIBDMO CC[C@H]([NH2+]Cc1ccn(-c2ccc(F)cc2)n1)c1cccc([N+](=O)[O-])c1 ZINC000090944512 1121207400 /nfs/dbraw/zinc/20/74/00/1121207400.db2.gz LZXKVDHUSCDWSV-IBGZPJMESA-N 1 1 354.385 4.161 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1Cl ZINC000112533301 1121966171 /nfs/dbraw/zinc/96/61/71/1121966171.db2.gz IJMMYWZJZPWDAJ-NSHDSACASA-N 1 1 350.802 4.116 20 5 FIBDMO C[N@H+]1CCC[C@H](CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301203368 1122155325 /nfs/dbraw/zinc/15/53/25/1122155325.db2.gz NOGJQEJESCXICM-SECBINFHSA-N 1 1 351.756 4.021 20 5 FIBDMO COc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000301520576 1122199407 /nfs/dbraw/zinc/19/94/07/1122199407.db2.gz FIYQJCWRHSELJA-YJBOKZPZSA-N 1 1 355.438 4.068 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2cnc(-c3ccccn3)s2)C2CC2)c1 ZINC000154300422 1122211691 /nfs/dbraw/zinc/21/16/91/1122211691.db2.gz ADYGHPRGKKKYHE-UHFFFAOYSA-N 1 1 366.446 4.278 20 5 FIBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cnc(-c3ccccn3)s2)C2CC2)c1 ZINC000154300422 1122211697 /nfs/dbraw/zinc/21/16/97/1122211697.db2.gz ADYGHPRGKKKYHE-UHFFFAOYSA-N 1 1 366.446 4.278 20 5 FIBDMO C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@H+]1Cc1ccccc1 ZINC000301544737 1122219061 /nfs/dbraw/zinc/21/90/61/1122219061.db2.gz OPADDSUAMSUSOR-UKRRQHHQSA-N 1 1 360.845 4.108 20 5 FIBDMO CC[C@H](NCc1cccc(C[NH+]2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000123038772 1122242816 /nfs/dbraw/zinc/24/28/16/1122242816.db2.gz ADLPACVTTWPQAX-NRFANRHFSA-N 1 1 353.466 4.432 20 5 FIBDMO C[N@@H+](Cc1ccc2ccccc2c1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917421054 1122307351 /nfs/dbraw/zinc/30/73/51/1122307351.db2.gz ZKFMJXSGVQMEQS-UHFFFAOYSA-N 1 1 373.416 4.096 20 5 FIBDMO C[N@H+](Cc1ccc2ccccc2c1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917421054 1122307366 /nfs/dbraw/zinc/30/73/66/1122307366.db2.gz ZKFMJXSGVQMEQS-UHFFFAOYSA-N 1 1 373.416 4.096 20 5 FIBDMO CC[C@@H](C)[N@H+](Cc1ccccc1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917455062 1122320601 /nfs/dbraw/zinc/32/06/01/1122320601.db2.gz PZKBKBJHKAHUJV-MRXNPFEDSA-N 1 1 365.437 4.112 20 5 FIBDMO CC[C@H](C)[N@H+](Cc1ccccc1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917455061 1122320780 /nfs/dbraw/zinc/32/07/80/1122320780.db2.gz PZKBKBJHKAHUJV-INIZCTEOSA-N 1 1 365.437 4.112 20 5 FIBDMO Cc1cccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000917841968 1122457955 /nfs/dbraw/zinc/45/79/55/1122457955.db2.gz RMYVIKTVFPNEMJ-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1cccc(C[N@H+](C)[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000917841968 1122457957 /nfs/dbraw/zinc/45/79/57/1122457957.db2.gz RMYVIKTVFPNEMJ-CYBMUJFWSA-N 1 1 361.829 4.016 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000556119092 1122669882 /nfs/dbraw/zinc/66/98/82/1122669882.db2.gz ORJUNGUSBAPFCH-LRQRDZAKSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000556119092 1122669886 /nfs/dbraw/zinc/66/98/86/1122669886.db2.gz ORJUNGUSBAPFCH-LRQRDZAKSA-N 1 1 353.466 4.389 20 5 FIBDMO Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000194857124 1122932513 /nfs/dbraw/zinc/93/25/13/1122932513.db2.gz PWBIOHQUIYLOLH-QGZVFWFLSA-N 1 1 373.497 4.020 20 5 FIBDMO C[N@H+](Cc1ccc(OCc2ccncc2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000194916850 1123007261 /nfs/dbraw/zinc/00/72/61/1123007261.db2.gz RJZLWZOVUOTTQH-UHFFFAOYSA-N 1 1 363.417 4.201 20 5 FIBDMO C[N@@H+](Cc1ccc(OCc2ccncc2)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000194916850 1123007263 /nfs/dbraw/zinc/00/72/63/1123007263.db2.gz RJZLWZOVUOTTQH-UHFFFAOYSA-N 1 1 363.417 4.201 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](Cc1cccc(O)c1)CC1CC1 ZINC000498895059 1123064891 /nfs/dbraw/zinc/06/48/91/1123064891.db2.gz FMBUWHPXOAEJBZ-UHFFFAOYSA-N 1 1 370.449 4.500 20 5 FIBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](Cc1cccc(O)c1)CC1CC1 ZINC000498895059 1123064896 /nfs/dbraw/zinc/06/48/96/1123064896.db2.gz FMBUWHPXOAEJBZ-UHFFFAOYSA-N 1 1 370.449 4.500 20 5 FIBDMO COc1ccc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1Br ZINC000037563029 1123075834 /nfs/dbraw/zinc/07/58/34/1123075834.db2.gz IIDGJUVPDCLMES-VIFPVBQESA-N 1 1 371.256 4.278 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133415 1123160980 /nfs/dbraw/zinc/16/09/80/1123160980.db2.gz DVHASIMOUONSLP-IEBWSBKVSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([C@@H](C)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133415 1123160982 /nfs/dbraw/zinc/16/09/82/1123160982.db2.gz DVHASIMOUONSLP-IEBWSBKVSA-N 1 1 353.466 4.076 20 5 FIBDMO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000195133415 1123160984 /nfs/dbraw/zinc/16/09/84/1123160984.db2.gz DVHASIMOUONSLP-IEBWSBKVSA-N 1 1 353.466 4.076 20 5 FIBDMO C[N@H+](CCc1ccc(F)cc1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000919949143 1123268828 /nfs/dbraw/zinc/26/88/28/1123268828.db2.gz XMJFHBLVOGJFIR-UHFFFAOYSA-N 1 1 361.398 4.143 20 5 FIBDMO C[N@@H+](CCc1ccc(F)cc1)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000919949143 1123268830 /nfs/dbraw/zinc/26/88/30/1123268830.db2.gz XMJFHBLVOGJFIR-UHFFFAOYSA-N 1 1 361.398 4.143 20 5 FIBDMO Cc1ccccc1C[N@H+]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609705233 1123803893 /nfs/dbraw/zinc/80/38/93/1123803893.db2.gz JFJHORYUGKEIFG-UHFFFAOYSA-N 1 1 373.884 4.265 20 5 FIBDMO COc1ccc(C[NH+]2CCC(Oc3cc(C)ccc3C)CC2)cc1[N+](=O)[O-] ZINC000064632418 1123875724 /nfs/dbraw/zinc/87/57/24/1123875724.db2.gz CMRNCKWPGOPOJR-UHFFFAOYSA-N 1 1 370.449 4.264 20 5 FIBDMO CN1Cc2ccccc2[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000542776806 1124257274 /nfs/dbraw/zinc/25/72/74/1124257274.db2.gz JONINFBGUWVVJT-DHIUTWEWSA-N 1 1 373.456 4.461 20 5 FIBDMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C(C)C)[C@H](C)c1ccccc1 ZINC000428838460 1124499005 /nfs/dbraw/zinc/49/90/05/1124499005.db2.gz HDPWKNONEBJPRD-MRXNPFEDSA-N 1 1 355.438 4.313 20 5 FIBDMO COc1cccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2Br)c1 ZINC001168675289 1124745701 /nfs/dbraw/zinc/74/57/01/1124745701.db2.gz DFYWGKYSFXIWAR-NSHDSACASA-N 1 1 365.227 4.217 20 5 FIBDMO CC(=O)c1ccc(N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000301678226 1124949058 /nfs/dbraw/zinc/94/90/58/1124949058.db2.gz RNYWHKGHFFIEDV-MRXNPFEDSA-N 1 1 373.497 4.278 20 5 FIBDMO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@H]3CCCc4occc43)cs2)c1 ZINC000113320812 1125149120 /nfs/dbraw/zinc/14/91/20/1125149120.db2.gz WEFUFZDPAJNZPK-INIZCTEOSA-N 1 1 355.419 4.479 20 5 FIBDMO C[C@H](NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000311547105 1125185966 /nfs/dbraw/zinc/18/59/66/1125185966.db2.gz OUOZAOGHOCYDRE-MAUKXSAKSA-N 1 1 373.884 4.248 20 5 FIBDMO C[C@H](N[C@@H](C)[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000311850867 1125232850 /nfs/dbraw/zinc/23/28/50/1125232850.db2.gz SJRSXTIWISVEFY-LNLFQRSKSA-N 1 1 353.466 4.156 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](Cc2ccc(F)cc2)CC1 ZINC000097039152 222154199 /nfs/dbraw/zinc/15/41/99/222154199.db2.gz FLBNNWVAFKMGJI-INIZCTEOSA-N 1 1 357.429 4.003 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCN(Cc2ccc(F)cc2)CC1 ZINC000097039152 222154204 /nfs/dbraw/zinc/15/42/04/222154204.db2.gz FLBNNWVAFKMGJI-INIZCTEOSA-N 1 1 357.429 4.003 20 5 FIBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCN(Cc2ccc(F)cc2)CC1 ZINC000097039152 222154206 /nfs/dbraw/zinc/15/42/06/222154206.db2.gz FLBNNWVAFKMGJI-INIZCTEOSA-N 1 1 357.429 4.003 20 5 FIBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000481715107 568093833 /nfs/dbraw/zinc/09/38/33/568093833.db2.gz WRFMFPATUWFOEK-IERDGZPVSA-N 1 1 352.434 4.486 20 5 FIBDMO