smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190850 1018989454 /nfs/dbraw/zinc/98/94/54/1018989454.db2.gz MNHFIYNNJLNKRB-APWZRJJASA-N 2 2 339.439 3.595 20 5 EHBDLP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190850 1018989466 /nfs/dbraw/zinc/98/94/66/1018989466.db2.gz MNHFIYNNJLNKRB-APWZRJJASA-N 2 2 339.439 3.595 20 5 EHBDLP CC[N@H+](CCC[NH+](C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000515660424 1025465184 /nfs/dbraw/zinc/46/51/84/1025465184.db2.gz ZXCJVWHKKZEPAK-UHFFFAOYSA-N 2 2 331.416 3.628 20 5 EHBDLP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000515660424 1025465197 /nfs/dbraw/zinc/46/51/97/1025465197.db2.gz ZXCJVWHKKZEPAK-UHFFFAOYSA-N 2 2 331.416 3.628 20 5 EHBDLP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CC([NH+]3CCCCC3)C1)CCCC2 ZINC000417328096 1039674897 /nfs/dbraw/zinc/67/48/97/1039674897.db2.gz HYHZWDWLIICTKV-NLPFYKDJSA-N 2 2 343.471 3.969 20 5 EHBDLP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)cs1 ZINC000282180655 1128037091 /nfs/dbraw/zinc/03/70/91/1128037091.db2.gz VTYMTMUMFTVEAU-AWEZNQCLSA-N 2 2 346.456 3.569 20 5 EHBDLP O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)cs1 ZINC000282180655 1128037094 /nfs/dbraw/zinc/03/70/94/1128037094.db2.gz VTYMTMUMFTVEAU-AWEZNQCLSA-N 2 2 346.456 3.569 20 5 EHBDLP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811482895 1136091328 /nfs/dbraw/zinc/09/13/28/1136091328.db2.gz WQNMISQFJUQGPI-CHWSQXEVSA-N 2 2 346.258 3.864 20 5 EHBDLP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000479594823 1026733310 /nfs/dbraw/zinc/73/33/10/1026733310.db2.gz UQYDZZYIWSCPCK-UHFFFAOYSA-N 2 2 325.478 3.791 20 5 EHBDLP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595016108 1033609914 /nfs/dbraw/zinc/60/99/14/1033609914.db2.gz QCDDBVVNQWRCLN-CQSZACIVSA-N 2 2 335.448 3.519 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000598992025 1033644532 /nfs/dbraw/zinc/64/45/32/1033644532.db2.gz JQPCZTQHQCRJDA-IWHGQQBYSA-N 2 2 329.444 3.605 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000598992025 1033644540 /nfs/dbraw/zinc/64/45/40/1033644540.db2.gz JQPCZTQHQCRJDA-IWHGQQBYSA-N 2 2 329.444 3.605 20 5 EHBDLP C[N@H+](CCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000761522474 1037089851 /nfs/dbraw/zinc/08/98/51/1037089851.db2.gz QKUHVTGCPTZJLX-UHFFFAOYSA-N 2 2 347.846 3.860 20 5 EHBDLP C[N@@H+](CCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000761522474 1037089872 /nfs/dbraw/zinc/08/98/72/1037089872.db2.gz QKUHVTGCPTZJLX-UHFFFAOYSA-N 2 2 347.846 3.860 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cccc(Cn2cc[nH+]c2)c1 ZINC000570986057 1041157999 /nfs/dbraw/zinc/15/79/99/1041157999.db2.gz ZHXFJEFEDQBOHG-LJQANCHMSA-N 2 2 348.406 3.617 20 5 EHBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C1CCCC1)C1CC[NH+](C)CC1 ZINC001173238089 1132027752 /nfs/dbraw/zinc/02/77/52/1132027752.db2.gz MXBKHSMOVKBUDF-MRXNPFEDSA-N 2 2 345.487 3.865 20 5 EHBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C1CCCC1)C1CC[NH+](C)CC1 ZINC001173238089 1132027760 /nfs/dbraw/zinc/02/77/60/1132027760.db2.gz MXBKHSMOVKBUDF-MRXNPFEDSA-N 2 2 345.487 3.865 20 5 EHBDLP Cc1[nH]c(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3Cl)CC2)[nH+]c1C ZINC000886663003 1138110812 /nfs/dbraw/zinc/11/08/12/1138110812.db2.gz RCKKGXHFJSKQEF-UHFFFAOYSA-N 2 2 348.834 3.968 20 5 EHBDLP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@@H+]1C ZINC000130638800 1138466195 /nfs/dbraw/zinc/46/61/95/1138466195.db2.gz ORYPXUNXPRKABX-RHSMWYFYSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000130638800 1138466197 /nfs/dbraw/zinc/46/61/97/1138466197.db2.gz ORYPXUNXPRKABX-RHSMWYFYSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[NH+]1C ZINC000130638800 1138466198 /nfs/dbraw/zinc/46/61/98/1138466198.db2.gz ORYPXUNXPRKABX-RHSMWYFYSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[NH+]1C ZINC000130638800 1138466200 /nfs/dbraw/zinc/46/62/00/1138466200.db2.gz ORYPXUNXPRKABX-RHSMWYFYSA-N 2 2 343.427 3.769 20 5 EHBDLP C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-n2cc[nH+]c2)cs1 ZINC000348674980 1141564759 /nfs/dbraw/zinc/56/47/59/1141564759.db2.gz PDNAATNUNFLCES-UHFFFAOYSA-N 2 2 342.424 3.517 20 5 EHBDLP C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-n2cc[nH+]c2)cs1 ZINC000348674980 1141564762 /nfs/dbraw/zinc/56/47/62/1141564762.db2.gz PDNAATNUNFLCES-UHFFFAOYSA-N 2 2 342.424 3.517 20 5 EHBDLP [NH3+][C@H](C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000414842980 1017232534 /nfs/dbraw/zinc/23/25/34/1017232534.db2.gz ZXVIWHXCRVTCEP-QRQLOZEOSA-N 2 2 339.439 3.596 20 5 EHBDLP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190853 1018988833 /nfs/dbraw/zinc/98/88/33/1018988833.db2.gz MNHFIYNNJLNKRB-VQIMIIECSA-N 2 2 339.439 3.595 20 5 EHBDLP C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190853 1018988846 /nfs/dbraw/zinc/98/88/46/1018988846.db2.gz MNHFIYNNJLNKRB-VQIMIIECSA-N 2 2 339.439 3.595 20 5 EHBDLP Cc1c(C[NH2+][C@@H](C)c2ccc(-n3cc[nH+]c3)cc2)cccc1[N+](=O)[O-] ZINC000327712685 1023106924 /nfs/dbraw/zinc/10/69/24/1023106924.db2.gz ZUPBHXYEWCOAQH-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP C[NH2+]C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000435391399 1024877813 /nfs/dbraw/zinc/87/78/13/1024877813.db2.gz WLDFJMYVDDYRHP-UHFFFAOYSA-N 2 2 349.818 3.692 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897980984 1033276813 /nfs/dbraw/zinc/27/68/13/1033276813.db2.gz HMYHCNYBUPHXSY-NTCAYCPXSA-N 2 2 329.444 3.605 20 5 EHBDLP CCc1ccc([C@H]([NH2+][C@@H]2CCC[C@H]([NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423375033 1028412260 /nfs/dbraw/zinc/41/22/60/1028412260.db2.gz IPIWAEXTGNMUPC-QMTMVMCOSA-N 2 2 343.427 3.699 20 5 EHBDLP C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCC(C)CC1 ZINC000481971112 1030140847 /nfs/dbraw/zinc/14/08/47/1030140847.db2.gz FZJNZOJECPVUPP-APWZRJJASA-N 2 2 345.487 3.626 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1-n1cc[nH+]c1 ZINC000152241714 1036203627 /nfs/dbraw/zinc/20/36/27/1036203627.db2.gz LPWIBCFNBDYASN-OAHLLOKOSA-N 2 2 336.395 3.940 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000542703453 1128548856 /nfs/dbraw/zinc/54/88/56/1128548856.db2.gz NREBROWZIHKNCX-QZTJIDSGSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000542703453 1128548860 /nfs/dbraw/zinc/54/88/60/1128548860.db2.gz NREBROWZIHKNCX-QZTJIDSGSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000542703453 1128548865 /nfs/dbraw/zinc/54/88/65/1128548865.db2.gz NREBROWZIHKNCX-QZTJIDSGSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000542703453 1128548870 /nfs/dbraw/zinc/54/88/70/1128548870.db2.gz NREBROWZIHKNCX-QZTJIDSGSA-N 2 2 345.487 3.990 20 5 EHBDLP C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272245300 1121131903 /nfs/dbraw/zinc/13/19/03/1121131903.db2.gz XDIIOAJLVWRAAS-PBHICJAKSA-N 2 2 345.468 3.657 20 5 EHBDLP C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272245300 1121131907 /nfs/dbraw/zinc/13/19/07/1121131907.db2.gz XDIIOAJLVWRAAS-PBHICJAKSA-N 2 2 345.468 3.657 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CC[N@@H+](C2CCCC2)C1)C1CC1 ZINC000153682307 1121581217 /nfs/dbraw/zinc/58/12/17/1121581217.db2.gz OPGAJSYCQGAFOS-HKUYNNGSSA-N 2 2 343.471 3.522 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CC[N@H+](C2CCCC2)C1)C1CC1 ZINC000153682307 1121581226 /nfs/dbraw/zinc/58/12/26/1121581226.db2.gz OPGAJSYCQGAFOS-HKUYNNGSSA-N 2 2 343.471 3.522 20 5 EHBDLP C[C@@H](C[NH+]1CCC(C)CC1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913498 1131918796 /nfs/dbraw/zinc/91/87/96/1131918796.db2.gz WJEOTRIREBCRGR-QFBILLFUSA-N 2 2 345.487 3.552 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000872027537 1137566105 /nfs/dbraw/zinc/56/61/05/1137566105.db2.gz DYRVSNPVZSMBNW-ZDUSSCGKSA-N 2 2 349.500 3.984 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H](Cn1cc[nH+]c1)c1ccccc1 ZINC000883387721 1137859081 /nfs/dbraw/zinc/85/90/81/1137859081.db2.gz CUTYDKJKPWUWIJ-MOPGFXCFSA-N 2 2 348.406 3.810 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000093563704 1138238509 /nfs/dbraw/zinc/23/85/09/1138238509.db2.gz IDEGDDWVSWEWHK-MOTZXUDYSA-N 2 2 329.444 3.558 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000093563704 1138238511 /nfs/dbraw/zinc/23/85/11/1138238511.db2.gz IDEGDDWVSWEWHK-MOTZXUDYSA-N 2 2 329.444 3.558 20 5 EHBDLP C[C@@H]([NH3+])[C@H](C)[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000415014163 1017408456 /nfs/dbraw/zinc/40/84/56/1017408456.db2.gz LOHVRPDQLHDFHK-NEPJUHHUSA-N 2 2 349.818 3.866 20 5 EHBDLP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCn2cc[nH+]c2)s1 ZINC000102419184 1018525167 /nfs/dbraw/zinc/52/51/67/1018525167.db2.gz RTOGGQRKBSZRPJ-UHFFFAOYSA-N 2 2 342.424 3.700 20 5 EHBDLP CC(C)[NH+]1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602504878 1032939241 /nfs/dbraw/zinc/93/92/41/1032939241.db2.gz WNHZJPOMARPHMU-UHFFFAOYSA-N 2 2 345.365 3.576 20 5 EHBDLP CC(C)(C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCCC1 ZINC000479852697 1026863789 /nfs/dbraw/zinc/86/37/89/1026863789.db2.gz NTYGRRPIIFADKI-SFHVURJKSA-N 2 2 345.487 3.770 20 5 EHBDLP Cc1ccc([C@@H](C)[NH2+]CCCCNc2cccc[nH+]2)cc1[N+](=O)[O-] ZINC000162864468 1029618031 /nfs/dbraw/zinc/61/80/31/1029618031.db2.gz RHNOKFIFZRGXLC-OAHLLOKOSA-N 2 2 328.416 3.841 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000598992027 1033644872 /nfs/dbraw/zinc/64/48/72/1033644872.db2.gz JQPCZTQHQCRJDA-POZKEBTKSA-N 2 2 329.444 3.605 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000598992027 1033644878 /nfs/dbraw/zinc/64/48/78/1033644878.db2.gz JQPCZTQHQCRJDA-POZKEBTKSA-N 2 2 329.444 3.605 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000595032289 1033653619 /nfs/dbraw/zinc/65/36/19/1033653619.db2.gz MCIYFACWUPUEPL-HUUCEWRRSA-N 2 2 335.448 3.519 20 5 EHBDLP Cc1ccc([C@H](C)[NH2+]C2CCN(c3cccc[nH+]3)CC2)cc1[N+](=O)[O-] ZINC000121344573 1042765092 /nfs/dbraw/zinc/76/50/92/1042765092.db2.gz MYITZVFQDUVVPG-HNNXBMFYSA-N 2 2 340.427 3.618 20 5 EHBDLP CCOc1ccc([C@@H](C)[NH2+]CCCNc2cccc[nH+]2)cc1[N+](=O)[O-] ZINC000154158274 1129536112 /nfs/dbraw/zinc/53/61/12/1129536112.db2.gz UMMDFEYUONECJT-CQSZACIVSA-N 2 2 344.415 3.541 20 5 EHBDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086664 1137570661 /nfs/dbraw/zinc/57/06/61/1137570661.db2.gz BNHWWAMYWLCMDV-HIFRSBDPSA-N 2 2 335.423 3.507 20 5 EHBDLP C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086664 1137570662 /nfs/dbraw/zinc/57/06/62/1137570662.db2.gz BNHWWAMYWLCMDV-HIFRSBDPSA-N 2 2 335.423 3.507 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)cc1 ZINC000281896180 1025649943 /nfs/dbraw/zinc/64/99/43/1025649943.db2.gz BEHOEPNUEIXAFU-MRXNPFEDSA-N 2 2 340.427 3.507 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)cc1 ZINC000281896180 1025649948 /nfs/dbraw/zinc/64/99/48/1025649948.db2.gz BEHOEPNUEIXAFU-MRXNPFEDSA-N 2 2 340.427 3.507 20 5 EHBDLP CCC[NH+]1CCC([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000279444173 1044090802 /nfs/dbraw/zinc/09/08/02/1044090802.db2.gz HSTYRCWEVBQLJL-UHFFFAOYSA-N 2 2 345.365 3.578 20 5 EHBDLP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210002 1044160904 /nfs/dbraw/zinc/16/09/04/1044160904.db2.gz BQBYPBXYTWTOGL-WMZOPIPTSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210002 1044160907 /nfs/dbraw/zinc/16/09/07/1044160907.db2.gz BQBYPBXYTWTOGL-WMZOPIPTSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210002 1044160912 /nfs/dbraw/zinc/16/09/12/1044160912.db2.gz BQBYPBXYTWTOGL-WMZOPIPTSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210002 1044160915 /nfs/dbraw/zinc/16/09/15/1044160915.db2.gz BQBYPBXYTWTOGL-WMZOPIPTSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@@H]([NH2+]CCn1cc[nH+]c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000155630413 1129653912 /nfs/dbraw/zinc/65/39/12/1129653912.db2.gz KSTSISSNHNADKS-CYBMUJFWSA-N 2 2 342.424 3.871 20 5 EHBDLP OCC[N@@H+]1CCCC[C@@H]1C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC001202513958 1137236722 /nfs/dbraw/zinc/23/67/22/1137236722.db2.gz SGMVAOWKJWJCRT-HXUWFJFHSA-N 2 2 348.490 3.929 20 5 EHBDLP OCC[N@H+]1CCCC[C@@H]1C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC001202513958 1137236723 /nfs/dbraw/zinc/23/67/23/1137236723.db2.gz SGMVAOWKJWJCRT-HXUWFJFHSA-N 2 2 348.490 3.929 20 5 EHBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCCC[NH2+]C3)s2)cc1 ZINC000415064679 1017484365 /nfs/dbraw/zinc/48/43/65/1017484365.db2.gz DKRZTBMSGUVSSB-AWEZNQCLSA-N 2 2 331.441 3.555 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000247233594 1017537680 /nfs/dbraw/zinc/53/76/80/1017537680.db2.gz WKYNLOMPHWPJDJ-LPRVLWEOSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000247233594 1017537691 /nfs/dbraw/zinc/53/76/91/1017537691.db2.gz WKYNLOMPHWPJDJ-LPRVLWEOSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000247233594 1017537701 /nfs/dbraw/zinc/53/77/01/1017537701.db2.gz WKYNLOMPHWPJDJ-LPRVLWEOSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000247233594 1017537709 /nfs/dbraw/zinc/53/77/09/1017537709.db2.gz WKYNLOMPHWPJDJ-LPRVLWEOSA-N 2 2 341.455 3.557 20 5 EHBDLP Cc1c(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475453 1023246782 /nfs/dbraw/zinc/24/67/82/1023246782.db2.gz XAKNSKZHOLWYIM-FUHWJXTLSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475453 1023246787 /nfs/dbraw/zinc/24/67/87/1023246787.db2.gz XAKNSKZHOLWYIM-FUHWJXTLSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475453 1023246796 /nfs/dbraw/zinc/24/67/96/1023246796.db2.gz XAKNSKZHOLWYIM-FUHWJXTLSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475453 1023246804 /nfs/dbraw/zinc/24/68/04/1023246804.db2.gz XAKNSKZHOLWYIM-FUHWJXTLSA-N 2 2 345.487 3.990 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000895672075 1024717232 /nfs/dbraw/zinc/71/72/32/1024717232.db2.gz VSZULTRGEBUHEI-SSZFMOIBSA-N 2 2 329.444 3.558 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599073561 1033715461 /nfs/dbraw/zinc/71/54/61/1033715461.db2.gz KDKIHOYVMLLXSO-QAPCUYQASA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599073561 1033715468 /nfs/dbraw/zinc/71/54/68/1033715468.db2.gz KDKIHOYVMLLXSO-QAPCUYQASA-N 2 2 331.460 3.522 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000540911791 1035789825 /nfs/dbraw/zinc/78/98/25/1035789825.db2.gz NLYBIIVDAIHLSH-OAHLLOKOSA-N 2 2 340.427 3.936 20 5 EHBDLP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000493233797 1036957999 /nfs/dbraw/zinc/95/79/99/1036957999.db2.gz UYHZXTBHFAACFG-ZTNFWEORSA-N 2 2 339.439 3.757 20 5 EHBDLP C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000493233797 1036958016 /nfs/dbraw/zinc/95/80/16/1036958016.db2.gz UYHZXTBHFAACFG-ZTNFWEORSA-N 2 2 339.439 3.757 20 5 EHBDLP CC1(C)C[C@H]([NH2+]CCCNc2cccc[nH+]2)c2cc([N+](=O)[O-])ccc21 ZINC000433284638 1041232593 /nfs/dbraw/zinc/23/25/93/1041232593.db2.gz FEYYLVCXOOXZEI-KRWDZBQOSA-N 2 2 340.427 3.804 20 5 EHBDLP Cc1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171372 1043609968 /nfs/dbraw/zinc/60/99/68/1043609968.db2.gz WWVGNJGPMVWXCJ-MJGOQNOKSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171372 1043609973 /nfs/dbraw/zinc/60/99/73/1043609973.db2.gz WWVGNJGPMVWXCJ-MJGOQNOKSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171372 1043609978 /nfs/dbraw/zinc/60/99/78/1043609978.db2.gz WWVGNJGPMVWXCJ-MJGOQNOKSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171372 1043609982 /nfs/dbraw/zinc/60/99/82/1043609982.db2.gz WWVGNJGPMVWXCJ-MJGOQNOKSA-N 2 2 345.487 3.990 20 5 EHBDLP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC000154755318 1129585124 /nfs/dbraw/zinc/58/51/24/1129585124.db2.gz ZKJRZTBMQNSNKY-KRWDZBQOSA-N 2 2 331.460 3.539 20 5 EHBDLP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC000154755318 1129585126 /nfs/dbraw/zinc/58/51/26/1129585126.db2.gz ZKJRZTBMQNSNKY-KRWDZBQOSA-N 2 2 331.460 3.539 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000872027535 1137566051 /nfs/dbraw/zinc/56/60/51/1137566051.db2.gz DYRVSNPVZSMBNW-CYBMUJFWSA-N 2 2 349.500 3.984 20 5 EHBDLP C[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000340283538 1016857900 /nfs/dbraw/zinc/85/79/00/1016857900.db2.gz YTWMDWGSDRCURK-PKOBYXMFSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@H+]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000340283538 1016857937 /nfs/dbraw/zinc/85/79/37/1016857937.db2.gz YTWMDWGSDRCURK-PKOBYXMFSA-N 2 2 325.412 3.520 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697212 1032153911 /nfs/dbraw/zinc/15/39/11/1032153911.db2.gz GIRXXFUBWSKOFA-GOSISDBHSA-N 2 2 345.487 3.882 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697212 1032153917 /nfs/dbraw/zinc/15/39/17/1032153917.db2.gz GIRXXFUBWSKOFA-GOSISDBHSA-N 2 2 345.487 3.882 20 5 EHBDLP CC(C)c1ccc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697212 1032153924 /nfs/dbraw/zinc/15/39/24/1032153924.db2.gz GIRXXFUBWSKOFA-GOSISDBHSA-N 2 2 345.487 3.882 20 5 EHBDLP CC(C)c1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697212 1032153932 /nfs/dbraw/zinc/15/39/32/1032153932.db2.gz GIRXXFUBWSKOFA-GOSISDBHSA-N 2 2 345.487 3.882 20 5 EHBDLP O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCCCNc1cccc[nH+]1 ZINC000892872486 1017622041 /nfs/dbraw/zinc/62/20/41/1017622041.db2.gz UEZMMJWNUPYVNV-UHFFFAOYSA-N 2 2 334.807 3.625 20 5 EHBDLP Cc1c([C@H](C)[NH2+]CCCCNc2cccc[nH+]2)cccc1[N+](=O)[O-] ZINC000162874518 1029645069 /nfs/dbraw/zinc/64/50/69/1029645069.db2.gz SJQSCOSQCZLKCE-HNNXBMFYSA-N 2 2 328.416 3.841 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(-n2cc[nH+]c2)c1 ZINC000532224216 1030489920 /nfs/dbraw/zinc/48/99/20/1030489920.db2.gz VGXRXGNTCGFVHP-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000595023873 1033615497 /nfs/dbraw/zinc/61/54/97/1033615497.db2.gz ZDYMKGXOENHQBS-HOTGVXAUSA-N 2 2 349.475 3.622 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000595023873 1033615504 /nfs/dbraw/zinc/61/55/04/1033615504.db2.gz ZDYMKGXOENHQBS-HOTGVXAUSA-N 2 2 349.475 3.622 20 5 EHBDLP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390421 1035434286 /nfs/dbraw/zinc/43/42/86/1035434286.db2.gz XJCHAXOGYFCURI-SQNIBIBYSA-N 2 2 329.444 3.534 20 5 EHBDLP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@H+]3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390421 1035434289 /nfs/dbraw/zinc/43/42/89/1035434289.db2.gz XJCHAXOGYFCURI-SQNIBIBYSA-N 2 2 329.444 3.534 20 5 EHBDLP C[C@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000338716739 1128745417 /nfs/dbraw/zinc/74/54/17/1128745417.db2.gz RHOOSXANEGYPTL-CYBMUJFWSA-N 2 2 342.424 3.698 20 5 EHBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444201 1130208711 /nfs/dbraw/zinc/20/87/11/1130208711.db2.gz XUPBLFHDHOYJRW-MAUKXSAKSA-N 2 2 349.475 3.544 20 5 EHBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444201 1130208719 /nfs/dbraw/zinc/20/87/19/1130208719.db2.gz XUPBLFHDHOYJRW-MAUKXSAKSA-N 2 2 349.475 3.544 20 5 EHBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444201 1130208724 /nfs/dbraw/zinc/20/87/24/1130208724.db2.gz XUPBLFHDHOYJRW-MAUKXSAKSA-N 2 2 349.475 3.544 20 5 EHBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444201 1130208729 /nfs/dbraw/zinc/20/87/29/1130208729.db2.gz XUPBLFHDHOYJRW-MAUKXSAKSA-N 2 2 349.475 3.544 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(-n2cc[nH+]c2)cc1 ZINC000786813485 1133910303 /nfs/dbraw/zinc/91/03/03/1133910303.db2.gz XMVARSFETAJQBE-WJDWOHSUSA-N 2 2 348.406 3.974 20 5 EHBDLP C[C@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000811474380 1136095891 /nfs/dbraw/zinc/09/58/91/1136095891.db2.gz HNHAPRZAMLFQSE-LLVKDONJSA-N 2 2 346.258 3.723 20 5 EHBDLP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086666 1137570559 /nfs/dbraw/zinc/57/05/59/1137570559.db2.gz BNHWWAMYWLCMDV-UKRRQHHQSA-N 2 2 335.423 3.507 20 5 EHBDLP C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086666 1137570560 /nfs/dbraw/zinc/57/05/60/1137570560.db2.gz BNHWWAMYWLCMDV-UKRRQHHQSA-N 2 2 335.423 3.507 20 5 EHBDLP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@@H+]1C ZINC000130639358 1138466173 /nfs/dbraw/zinc/46/61/73/1138466173.db2.gz ORYPXUNXPRKABX-YOEHRIQHSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000130639358 1138466175 /nfs/dbraw/zinc/46/61/75/1138466175.db2.gz ORYPXUNXPRKABX-YOEHRIQHSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[NH+]1C ZINC000130639358 1138466177 /nfs/dbraw/zinc/46/61/77/1138466177.db2.gz ORYPXUNXPRKABX-YOEHRIQHSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[NH+]1C ZINC000130639358 1138466180 /nfs/dbraw/zinc/46/61/80/1138466180.db2.gz ORYPXUNXPRKABX-YOEHRIQHSA-N 2 2 343.427 3.769 20 5 EHBDLP [NH3+][C@H](C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000414842981 1017231847 /nfs/dbraw/zinc/23/18/47/1017231847.db2.gz ZXVIWHXCRVTCEP-QXAKKESOSA-N 2 2 339.439 3.596 20 5 EHBDLP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH+](C)C)CCC1 ZINC000437090978 1021543636 /nfs/dbraw/zinc/54/36/36/1021543636.db2.gz BVKSBEQBIGBGDR-AWEZNQCLSA-N 2 2 337.489 3.539 20 5 EHBDLP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1(C[NH3+])CCC1 ZINC000414777556 1029961019 /nfs/dbraw/zinc/96/10/19/1029961019.db2.gz FWYGTUMEGWKXIW-UHFFFAOYSA-N 2 2 331.441 3.637 20 5 EHBDLP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1(C[NH3+])CCC1 ZINC000414777556 1029961039 /nfs/dbraw/zinc/96/10/39/1029961039.db2.gz FWYGTUMEGWKXIW-UHFFFAOYSA-N 2 2 331.441 3.637 20 5 EHBDLP Cc1[nH+]ccn1-c1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000089512122 1033760899 /nfs/dbraw/zinc/76/08/99/1033760899.db2.gz ILQJQSPNHWITLG-AWEZNQCLSA-N 2 2 336.395 3.940 20 5 EHBDLP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000122129445 1035603422 /nfs/dbraw/zinc/60/34/22/1035603422.db2.gz OKVNABLJFOSDOT-MRXNPFEDSA-N 2 2 339.439 3.910 20 5 EHBDLP CC(C)[N@H+](C1CC[NH+](C)CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911755 1131917814 /nfs/dbraw/zinc/91/78/14/1131917814.db2.gz FRFPFYKIEAZMRD-SFHVURJKSA-N 2 2 345.487 3.647 20 5 EHBDLP CC(C)[N@@H+](C1CC[NH+](C)CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911755 1131917819 /nfs/dbraw/zinc/91/78/19/1131917819.db2.gz FRFPFYKIEAZMRD-SFHVURJKSA-N 2 2 345.487 3.647 20 5 EHBDLP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1[N+](=O)[O-] ZINC001190826216 1134755898 /nfs/dbraw/zinc/75/58/98/1134755898.db2.gz GGCYZQSSEQGAPI-IBGZPJMESA-N 2 2 345.487 3.991 20 5 EHBDLP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1[N+](=O)[O-] ZINC001190826216 1134755901 /nfs/dbraw/zinc/75/59/01/1134755901.db2.gz GGCYZQSSEQGAPI-IBGZPJMESA-N 2 2 345.487 3.991 20 5 EHBDLP Cc1c(C[NH2+][C@H](Cn2cc[nH+]c2)c2ccccc2)cccc1[N+](=O)[O-] ZINC001197263913 1135667052 /nfs/dbraw/zinc/66/70/52/1135667052.db2.gz GBELDLXNYHIVNF-GOSISDBHSA-N 2 2 336.395 3.631 20 5 EHBDLP Cc1[nH+]ccn1CCCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000125739193 1137643536 /nfs/dbraw/zinc/64/35/36/1137643536.db2.gz OVFJVFCWPQZBOA-UHFFFAOYSA-N 2 2 336.823 3.665 20 5 EHBDLP Cc1[nH+]ccn1CCCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000125739193 1137643537 /nfs/dbraw/zinc/64/35/37/1137643537.db2.gz OVFJVFCWPQZBOA-UHFFFAOYSA-N 2 2 336.823 3.665 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697214 1032154389 /nfs/dbraw/zinc/15/43/89/1032154389.db2.gz GIRXXFUBWSKOFA-SFHVURJKSA-N 2 2 345.487 3.882 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697214 1032154398 /nfs/dbraw/zinc/15/43/98/1032154398.db2.gz GIRXXFUBWSKOFA-SFHVURJKSA-N 2 2 345.487 3.882 20 5 EHBDLP CC(C)c1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697214 1032154412 /nfs/dbraw/zinc/15/44/12/1032154412.db2.gz GIRXXFUBWSKOFA-SFHVURJKSA-N 2 2 345.487 3.882 20 5 EHBDLP CC(C)c1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697214 1032154425 /nfs/dbraw/zinc/15/44/25/1032154425.db2.gz GIRXXFUBWSKOFA-SFHVURJKSA-N 2 2 345.487 3.882 20 5 EHBDLP C[NH+](C)C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000091669467 1023293520 /nfs/dbraw/zinc/29/35/20/1023293520.db2.gz FDBCTBFYWDRWME-UHFFFAOYSA-N 2 2 345.468 3.849 20 5 EHBDLP C[C@H]([NH2+][C@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144924 1028206076 /nfs/dbraw/zinc/20/60/76/1028206076.db2.gz IITODWJQSXXXPY-UCLAIMLFSA-N 2 2 325.412 3.739 20 5 EHBDLP CCOc1ccc([C@@H](C)[NH2+][C@H](C[NH3+])C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263496 1028302406 /nfs/dbraw/zinc/30/24/06/1028302406.db2.gz ONIYCTQSCNLKDS-CZUORRHYSA-N 2 2 335.448 3.552 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000347376204 1028804620 /nfs/dbraw/zinc/80/46/20/1028804620.db2.gz ZXLMWYKYWMGKIP-DKGMDFAASA-N 2 2 326.400 3.601 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000347376204 1028804638 /nfs/dbraw/zinc/80/46/38/1028804638.db2.gz ZXLMWYKYWMGKIP-DKGMDFAASA-N 2 2 326.400 3.601 20 5 EHBDLP CC[N@H+](CCC[NH+](C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000583661178 1030386204 /nfs/dbraw/zinc/38/62/04/1030386204.db2.gz CXLIRDPDHHHPQB-UHFFFAOYSA-N 2 2 331.416 3.628 20 5 EHBDLP CC[N@@H+](CCC[NH+](C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000583661178 1030386219 /nfs/dbraw/zinc/38/62/19/1030386219.db2.gz CXLIRDPDHHHPQB-UHFFFAOYSA-N 2 2 331.416 3.628 20 5 EHBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000532538079 1037565396 /nfs/dbraw/zinc/56/53/96/1037565396.db2.gz XLAUKQLNFHMHDJ-LSDHHAIUSA-N 2 2 328.416 3.636 20 5 EHBDLP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245907093 1130330178 /nfs/dbraw/zinc/33/01/78/1130330178.db2.gz FJFVBIMQLOFCHF-OXJNMPFZSA-N 2 2 339.439 3.616 20 5 EHBDLP CC[N@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245907093 1130330184 /nfs/dbraw/zinc/33/01/84/1130330184.db2.gz FJFVBIMQLOFCHF-OXJNMPFZSA-N 2 2 339.439 3.616 20 5 EHBDLP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@@H+]1C ZINC000130639010 1138466316 /nfs/dbraw/zinc/46/63/16/1138466316.db2.gz ORYPXUNXPRKABX-WMLDXEAASA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000130639010 1138466318 /nfs/dbraw/zinc/46/63/18/1138466318.db2.gz ORYPXUNXPRKABX-WMLDXEAASA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[NH+]1C ZINC000130639010 1138466319 /nfs/dbraw/zinc/46/63/19/1138466319.db2.gz ORYPXUNXPRKABX-WMLDXEAASA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[NH+]1C ZINC000130639010 1138466320 /nfs/dbraw/zinc/46/63/20/1138466320.db2.gz ORYPXUNXPRKABX-WMLDXEAASA-N 2 2 343.427 3.769 20 5 EHBDLP C[NH2+]C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000435372185 1024837379 /nfs/dbraw/zinc/83/73/79/1024837379.db2.gz QGPACZXXPHSNHV-UHFFFAOYSA-N 2 2 331.441 3.507 20 5 EHBDLP CCOc1ccc([C@H](C)[NH2+][C@H](C[NH3+])C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263497 1028301318 /nfs/dbraw/zinc/30/13/18/1028301318.db2.gz ONIYCTQSCNLKDS-XJKSGUPXSA-N 2 2 335.448 3.552 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000504900446 1029027706 /nfs/dbraw/zinc/02/77/06/1029027706.db2.gz YDVQJCLQMRLQPN-OAGGEKHMSA-N 2 2 349.500 3.682 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000504900446 1029027716 /nfs/dbraw/zinc/02/77/16/1029027716.db2.gz YDVQJCLQMRLQPN-OAGGEKHMSA-N 2 2 349.500 3.682 20 5 EHBDLP Cc1c([C@@H](C)[NH2+]Cc2ccccc2-n2cc[nH+]c2)cccc1[N+](=O)[O-] ZINC000152241894 1029840678 /nfs/dbraw/zinc/84/06/78/1029840678.db2.gz VFNZTLKEVVUTHF-OAHLLOKOSA-N 2 2 336.395 3.940 20 5 EHBDLP Cc1c[nH+]ccc1OC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278532795 1031261160 /nfs/dbraw/zinc/26/11/60/1031261160.db2.gz FGYQXWMEDMVSDY-HNNXBMFYSA-N 2 2 341.411 3.903 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCn2cc(C)[nH+]c21 ZINC000344857161 1044533580 /nfs/dbraw/zinc/53/35/80/1044533580.db2.gz LQMJXTKGTXCPDI-RKCSUWQLSA-N 2 2 340.427 3.670 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000542703456 1128549258 /nfs/dbraw/zinc/54/92/58/1128549258.db2.gz NREBROWZIHKNCX-ROUUACIJSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000542703456 1128549261 /nfs/dbraw/zinc/54/92/61/1128549261.db2.gz NREBROWZIHKNCX-ROUUACIJSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000542703456 1128549264 /nfs/dbraw/zinc/54/92/64/1128549264.db2.gz NREBROWZIHKNCX-ROUUACIJSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000542703456 1128549266 /nfs/dbraw/zinc/54/92/66/1128549266.db2.gz NREBROWZIHKNCX-ROUUACIJSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cccc1[N+](=O)[O-] ZINC000498911741 1123112473 /nfs/dbraw/zinc/11/24/73/1123112473.db2.gz QEPZMWXAKMHBMB-GOSISDBHSA-N 2 2 345.487 3.847 20 5 EHBDLP Cc1c(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cccc1[N+](=O)[O-] ZINC000498911741 1123112476 /nfs/dbraw/zinc/11/24/76/1123112476.db2.gz QEPZMWXAKMHBMB-GOSISDBHSA-N 2 2 345.487 3.847 20 5 EHBDLP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC000154755405 1129585097 /nfs/dbraw/zinc/58/50/97/1129585097.db2.gz ZKJRZTBMQNSNKY-QGZVFWFLSA-N 2 2 331.460 3.539 20 5 EHBDLP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC000154755405 1129585099 /nfs/dbraw/zinc/58/50/99/1129585099.db2.gz ZKJRZTBMQNSNKY-QGZVFWFLSA-N 2 2 331.460 3.539 20 5 EHBDLP Cc1[nH]c(C2CC[NH+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2)[nH+]c1C ZINC000886664462 1138111214 /nfs/dbraw/zinc/11/12/14/1138111214.db2.gz NIZSHWOPIXIOQX-UHFFFAOYSA-N 2 2 348.834 3.968 20 5 EHBDLP CC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(C[NH+](C)C)cc1 ZINC000349015512 1141623215 /nfs/dbraw/zinc/62/32/15/1141623215.db2.gz YKSHCIGYQGLHKW-UHFFFAOYSA-N 2 2 333.457 3.740 20 5 EHBDLP CC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(C[NH+](C)C)cc1 ZINC000349015512 1141623217 /nfs/dbraw/zinc/62/32/17/1141623217.db2.gz YKSHCIGYQGLHKW-UHFFFAOYSA-N 2 2 333.457 3.740 20 5 EHBDLP CCc1ccccc1[C@@H]([NH3+])C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415070020 1017502277 /nfs/dbraw/zinc/50/22/77/1017502277.db2.gz UEUAZGFSCJSEAB-BEFAXECRSA-N 2 2 341.455 3.768 20 5 EHBDLP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548010021 1018197065 /nfs/dbraw/zinc/19/70/65/1018197065.db2.gz BSXIIFICMOXOGP-RHSMWYFYSA-N 2 2 340.427 3.678 20 5 EHBDLP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548010021 1018197077 /nfs/dbraw/zinc/19/70/77/1018197077.db2.gz BSXIIFICMOXOGP-RHSMWYFYSA-N 2 2 340.427 3.678 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000182970085 1019859338 /nfs/dbraw/zinc/85/93/38/1019859338.db2.gz QJIXSGDGBJIGTC-JKSUJKDBSA-N 2 2 342.443 3.652 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000182970085 1019859355 /nfs/dbraw/zinc/85/93/55/1019859355.db2.gz QJIXSGDGBJIGTC-JKSUJKDBSA-N 2 2 342.443 3.652 20 5 EHBDLP Cc1c([C@@H](C)[NH2+]CCCCNc2cccc[nH+]2)cccc1[N+](=O)[O-] ZINC000162874424 1029645017 /nfs/dbraw/zinc/64/50/17/1029645017.db2.gz SJQSCOSQCZLKCE-OAHLLOKOSA-N 2 2 328.416 3.841 20 5 EHBDLP O=[N+]([O-])c1cccc([C@H]([NH2+]CCCn2cc[nH+]c2)c2ccccc2)c1 ZINC000179963807 1035095407 /nfs/dbraw/zinc/09/54/07/1035095407.db2.gz BWPUXWHXTTXJFX-LJQANCHMSA-N 2 2 336.395 3.561 20 5 EHBDLP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000493233795 1036957861 /nfs/dbraw/zinc/95/78/61/1036957861.db2.gz UYHZXTBHFAACFG-MOXGXCLJSA-N 2 2 339.439 3.757 20 5 EHBDLP C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000493233795 1036957881 /nfs/dbraw/zinc/95/78/81/1036957881.db2.gz UYHZXTBHFAACFG-MOXGXCLJSA-N 2 2 339.439 3.757 20 5 EHBDLP CC1(C)C[C@@H]([NH2+]CCCNc2cccc[nH+]2)c2cc([N+](=O)[O-])ccc21 ZINC000433284640 1041233214 /nfs/dbraw/zinc/23/32/14/1041233214.db2.gz FEYYLVCXOOXZEI-QGZVFWFLSA-N 2 2 340.427 3.804 20 5 EHBDLP CC(C)([NH2+]Cc1cc(-n2cc[nH+]c2)cs1)c1ccc([N+](=O)[O-])cc1 ZINC000344146133 1043328718 /nfs/dbraw/zinc/32/87/18/1043328718.db2.gz QEUMDEZXKSUOEI-UHFFFAOYSA-N 2 2 342.424 3.867 20 5 EHBDLP C[C@H]([NH2+]Cc1ccc(Cn2cc[nH+]c2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173316591 1130205374 /nfs/dbraw/zinc/20/53/74/1130205374.db2.gz YJUXMNCGNUFARK-HNNXBMFYSA-N 2 2 336.395 3.690 20 5 EHBDLP Cc1ccc(C[NH2+][C@@H](C)c2cccc(-n3cc[nH+]c3)c2)cc1[N+](=O)[O-] ZINC000742391433 1131714923 /nfs/dbraw/zinc/71/49/23/1131714923.db2.gz HYVNGRXIUUBPQO-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP CC(C)[NH+]1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC001177157974 1133037321 /nfs/dbraw/zinc/03/73/21/1133037321.db2.gz PCENBIDTWINYRZ-UHFFFAOYSA-N 2 2 343.427 3.817 20 5 EHBDLP CC1(C)[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000415039974 1017444202 /nfs/dbraw/zinc/44/42/02/1017444202.db2.gz NVTQXQHCQWFZRK-INIZCTEOSA-N 2 2 331.441 3.553 20 5 EHBDLP O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CCc3[nH+]c[nH]c3C2)c2ccccc2)c1 ZINC000377799746 1018394534 /nfs/dbraw/zinc/39/45/34/1018394534.db2.gz YWSRMZCRZGKJLG-JXFKEZNVSA-N 2 2 348.406 3.554 20 5 EHBDLP CCC([NH3+])(CC)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423287762 1028326619 /nfs/dbraw/zinc/32/66/19/1028326619.db2.gz OJRLQXHMLZDCRT-SFHVURJKSA-N 2 2 327.428 3.791 20 5 EHBDLP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000268738972 1028330249 /nfs/dbraw/zinc/33/02/49/1028330249.db2.gz OXPIEQQLWAEQGB-INIZCTEOSA-N 2 2 339.439 3.910 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000278781512 1033514517 /nfs/dbraw/zinc/51/45/17/1033514517.db2.gz DFDRNGSMGGNXMT-UHFFFAOYSA-N 2 2 340.427 3.507 20 5 EHBDLP [NH3+]C1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000596648352 1034346876 /nfs/dbraw/zinc/34/68/76/1034346876.db2.gz QSXLDCLQXSBNQF-GOSISDBHSA-N 2 2 325.412 3.545 20 5 EHBDLP CC(C)([NH2+]Cc1cc(-n2cc[nH+]c2)cs1)c1ccccc1[N+](=O)[O-] ZINC000492192557 1038103165 /nfs/dbraw/zinc/10/31/65/1038103165.db2.gz HOPDHILMJXZALX-UHFFFAOYSA-N 2 2 342.424 3.867 20 5 EHBDLP CCC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153888093 1122088022 /nfs/dbraw/zinc/08/80/22/1122088022.db2.gz TVWJVOTVMZCJSX-UHFFFAOYSA-N 2 2 325.840 3.554 20 5 EHBDLP CCC[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153888093 1122088028 /nfs/dbraw/zinc/08/80/28/1122088028.db2.gz TVWJVOTVMZCJSX-UHFFFAOYSA-N 2 2 325.840 3.554 20 5 EHBDLP CCCC[N@H+](Cc1cccnc1[N+](=O)[O-])C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545654 1135579311 /nfs/dbraw/zinc/57/93/11/1135579311.db2.gz SAPCROPURPRYMY-UHFFFAOYSA-N 2 2 348.491 3.901 20 5 EHBDLP CCCC[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545654 1135579317 /nfs/dbraw/zinc/57/93/17/1135579317.db2.gz SAPCROPURPRYMY-UHFFFAOYSA-N 2 2 348.491 3.901 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066264 1138224402 /nfs/dbraw/zinc/22/44/02/1138224402.db2.gz WKYNLOMPHWPJDJ-NMXXFREBSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066264 1138224405 /nfs/dbraw/zinc/22/44/05/1138224405.db2.gz WKYNLOMPHWPJDJ-NMXXFREBSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000092066264 1138224407 /nfs/dbraw/zinc/22/44/07/1138224407.db2.gz WKYNLOMPHWPJDJ-NMXXFREBSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000092066264 1138224409 /nfs/dbraw/zinc/22/44/09/1138224409.db2.gz WKYNLOMPHWPJDJ-NMXXFREBSA-N 2 2 341.455 3.557 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH+](C)C)CCC1 ZINC000437090980 1021544191 /nfs/dbraw/zinc/54/41/91/1021544191.db2.gz BVKSBEQBIGBGDR-CQSZACIVSA-N 2 2 337.489 3.539 20 5 EHBDLP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548336453 1022375324 /nfs/dbraw/zinc/37/53/24/1022375324.db2.gz JTMBQUVGXPWYQY-GJZGRUSLSA-N 2 2 340.427 3.678 20 5 EHBDLP C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548336453 1022375339 /nfs/dbraw/zinc/37/53/39/1022375339.db2.gz JTMBQUVGXPWYQY-GJZGRUSLSA-N 2 2 340.427 3.678 20 5 EHBDLP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000539531014 1036888844 /nfs/dbraw/zinc/88/88/44/1036888844.db2.gz OYEIKQQHERQRTO-CABCVRRESA-N 2 2 325.478 3.647 20 5 EHBDLP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761506898 1037076127 /nfs/dbraw/zinc/07/61/27/1037076127.db2.gz OWJHEGPSDIXLCM-UHFFFAOYSA-N 2 2 325.840 3.553 20 5 EHBDLP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761506898 1037076144 /nfs/dbraw/zinc/07/61/44/1037076144.db2.gz OWJHEGPSDIXLCM-UHFFFAOYSA-N 2 2 325.840 3.553 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057271 1040894032 /nfs/dbraw/zinc/89/40/32/1040894032.db2.gz KQYGJOSRMWHAJD-GOSISDBHSA-N 2 2 331.460 3.683 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057271 1040894042 /nfs/dbraw/zinc/89/40/42/1040894042.db2.gz KQYGJOSRMWHAJD-GOSISDBHSA-N 2 2 331.460 3.683 20 5 EHBDLP Cc1ccc(C[NH2+][C@H](Cn2cc[nH+]c2)c2ccccc2)cc1[N+](=O)[O-] ZINC001197275702 1135668564 /nfs/dbraw/zinc/66/85/64/1135668564.db2.gz VWERBNDPVHEGHK-GOSISDBHSA-N 2 2 336.395 3.631 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000872024721 1137565516 /nfs/dbraw/zinc/56/55/16/1137565516.db2.gz DMSVBAHCYGUJDE-BFHYXJOUSA-N 2 2 335.473 3.594 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000872024721 1137565517 /nfs/dbraw/zinc/56/55/17/1137565517.db2.gz DMSVBAHCYGUJDE-BFHYXJOUSA-N 2 2 335.473 3.594 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000872024723 1137565595 /nfs/dbraw/zinc/56/55/95/1137565595.db2.gz DMSVBAHCYGUJDE-MELADBBJSA-N 2 2 335.473 3.594 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000872024723 1137565596 /nfs/dbraw/zinc/56/55/96/1137565596.db2.gz DMSVBAHCYGUJDE-MELADBBJSA-N 2 2 335.473 3.594 20 5 EHBDLP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000479580438 1026710481 /nfs/dbraw/zinc/71/04/81/1026710481.db2.gz QSSJEZJXFHXEJE-SFHVURJKSA-N 2 2 331.460 3.539 20 5 EHBDLP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000479580438 1026710491 /nfs/dbraw/zinc/71/04/91/1026710491.db2.gz QSSJEZJXFHXEJE-SFHVURJKSA-N 2 2 331.460 3.539 20 5 EHBDLP Cc1ccc(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171373 1043610388 /nfs/dbraw/zinc/61/03/88/1043610388.db2.gz WWVGNJGPMVWXCJ-PKOBYXMFSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171373 1043610390 /nfs/dbraw/zinc/61/03/90/1043610390.db2.gz WWVGNJGPMVWXCJ-PKOBYXMFSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171373 1043610397 /nfs/dbraw/zinc/61/03/97/1043610397.db2.gz WWVGNJGPMVWXCJ-PKOBYXMFSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171373 1043610402 /nfs/dbraw/zinc/61/04/02/1043610402.db2.gz WWVGNJGPMVWXCJ-PKOBYXMFSA-N 2 2 345.487 3.990 20 5 EHBDLP C[C@@H](C[NH+]1CCC(C)CC1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913496 1131918906 /nfs/dbraw/zinc/91/89/06/1131918906.db2.gz WJEOTRIREBCRGR-LPHOPBHVSA-N 2 2 345.487 3.552 20 5 EHBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1c[nH+]cc1-c1cccc(C[NH3+])c1 ZINC001173229645 1132008084 /nfs/dbraw/zinc/00/80/84/1132008084.db2.gz OKXIVWVFWHHJBH-CQSZACIVSA-N 2 2 336.395 3.721 20 5 EHBDLP C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)Cc1cccc2c1CC[NH2+]C2 ZINC000852745689 1136482936 /nfs/dbraw/zinc/48/29/36/1136482936.db2.gz WYWSNNIUUISUKH-UHFFFAOYSA-N 2 2 345.830 3.526 20 5 EHBDLP C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)Cc1cccc2c1CC[NH2+]C2 ZINC000852745689 1136482938 /nfs/dbraw/zinc/48/29/38/1136482938.db2.gz WYWSNNIUUISUKH-UHFFFAOYSA-N 2 2 345.830 3.526 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cccc(-c2[nH+]ccn2C)c1 ZINC000359866639 201114925 /nfs/dbraw/zinc/11/49/25/201114925.db2.gz JDIFSMOLWBZSLO-UHFFFAOYSA-N 2 2 336.395 3.594 20 5 EHBDLP C[C@H]([NH3+])[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077320 1025497185 /nfs/dbraw/zinc/49/71/85/1025497185.db2.gz VKAZDDPBVQESRX-GUYCJALGSA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@H]([NH3+])[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077320 1025497197 /nfs/dbraw/zinc/49/71/97/1025497197.db2.gz VKAZDDPBVQESRX-GUYCJALGSA-N 2 2 329.400 3.557 20 5 EHBDLP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]([NH3+])c1ccccc1 ZINC000423231339 1028297530 /nfs/dbraw/zinc/29/75/30/1028297530.db2.gz ATJJXOJRWLWFCJ-HOTGVXAUSA-N 2 2 345.468 3.755 20 5 EHBDLP C[C@H]([NH2+]C[C@H]1CCC[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423246328 1028306336 /nfs/dbraw/zinc/30/63/36/1028306336.db2.gz ZDHNCBILQWSZOZ-QWHCGFSZSA-N 2 2 331.441 3.726 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594520390 1033429102 /nfs/dbraw/zinc/42/91/02/1033429102.db2.gz OCCPLGCGJVBRNV-SZVBFZGTSA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594520390 1033429119 /nfs/dbraw/zinc/42/91/19/1033429119.db2.gz OCCPLGCGJVBRNV-SZVBFZGTSA-N 2 2 331.460 3.522 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCCCNc1cccc[nH+]1 ZINC000595040916 1033661297 /nfs/dbraw/zinc/66/12/97/1033661297.db2.gz PKFUEUXXZDMLKC-CQSZACIVSA-N 2 2 344.415 3.541 20 5 EHBDLP CCC[C@@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000152784734 1036724083 /nfs/dbraw/zinc/72/40/83/1036724083.db2.gz GIFBWJLVFAOQNE-GOSISDBHSA-N 2 2 342.443 3.801 20 5 EHBDLP CC(C)([NH2+]Cc1ccc(-n2cc[nH+]c2)cc1)c1ccccc1[N+](=O)[O-] ZINC000492001610 1037853615 /nfs/dbraw/zinc/85/36/15/1037853615.db2.gz QOCBIHZWNMFPLS-UHFFFAOYSA-N 2 2 336.395 3.805 20 5 EHBDLP C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272245305 1121133304 /nfs/dbraw/zinc/13/33/04/1121133304.db2.gz XDIIOAJLVWRAAS-YOEHRIQHSA-N 2 2 345.468 3.657 20 5 EHBDLP C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272245305 1121133308 /nfs/dbraw/zinc/13/33/08/1121133308.db2.gz XDIIOAJLVWRAAS-YOEHRIQHSA-N 2 2 345.468 3.657 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000811474564 1136096255 /nfs/dbraw/zinc/09/62/55/1136096255.db2.gz LVQMHQZRVZDYEH-CHWSQXEVSA-N 2 2 344.242 3.618 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000811474564 1136096258 /nfs/dbraw/zinc/09/62/58/1136096258.db2.gz LVQMHQZRVZDYEH-CHWSQXEVSA-N 2 2 344.242 3.618 20 5 EHBDLP OCC[N@@H+]1CCCC[C@H]1C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC001202513954 1137236760 /nfs/dbraw/zinc/23/67/60/1137236760.db2.gz SGMVAOWKJWJCRT-FQEVSTJZSA-N 2 2 348.490 3.929 20 5 EHBDLP OCC[N@H+]1CCCC[C@H]1C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC001202513954 1137236761 /nfs/dbraw/zinc/23/67/61/1137236761.db2.gz SGMVAOWKJWJCRT-FQEVSTJZSA-N 2 2 348.490 3.929 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000872024724 1137565575 /nfs/dbraw/zinc/56/55/75/1137565575.db2.gz DMSVBAHCYGUJDE-MJBXVCDLSA-N 2 2 335.473 3.594 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000872024724 1137565576 /nfs/dbraw/zinc/56/55/76/1137565576.db2.gz DMSVBAHCYGUJDE-MJBXVCDLSA-N 2 2 335.473 3.594 20 5 EHBDLP C[C@@H]([NH2+]CCCCNc1cccc[nH+]1)c1c(F)cccc1[N+](=O)[O-] ZINC000872032433 1137566495 /nfs/dbraw/zinc/56/64/95/1137566495.db2.gz TZSFDNOULYBPDG-CYBMUJFWSA-N 2 2 332.379 3.672 20 5 EHBDLP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548336452 1022375117 /nfs/dbraw/zinc/37/51/17/1022375117.db2.gz JTMBQUVGXPWYQY-CABCVRRESA-N 2 2 340.427 3.678 20 5 EHBDLP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548336452 1022375132 /nfs/dbraw/zinc/37/51/32/1022375132.db2.gz JTMBQUVGXPWYQY-CABCVRRESA-N 2 2 340.427 3.678 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000347376209 1028805084 /nfs/dbraw/zinc/80/50/84/1028805084.db2.gz ZXLMWYKYWMGKIP-SCOADAFUSA-N 2 2 326.400 3.601 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000347376209 1028805104 /nfs/dbraw/zinc/80/51/04/1028805104.db2.gz ZXLMWYKYWMGKIP-SCOADAFUSA-N 2 2 326.400 3.601 20 5 EHBDLP Cc1cc(-n2cc[nH+]c2)ccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000192152421 1029604771 /nfs/dbraw/zinc/60/47/71/1029604771.db2.gz BZULNZIOAIOQDB-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP Cc1ccc([C@H](C)[NH2+]CCCCNc2cccc[nH+]2)cc1[N+](=O)[O-] ZINC000162864597 1029617777 /nfs/dbraw/zinc/61/77/77/1029617777.db2.gz RHNOKFIFZRGXLC-HNNXBMFYSA-N 2 2 328.416 3.841 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(-n2cc[nH+]c2)c1 ZINC000532224217 1030490889 /nfs/dbraw/zinc/49/08/89/1030490889.db2.gz VGXRXGNTCGFVHP-OAHLLOKOSA-N 2 2 336.395 3.940 20 5 EHBDLP C[C@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000338716178 1128745247 /nfs/dbraw/zinc/74/52/47/1128745247.db2.gz MWLAMBRYZXEFTA-CYBMUJFWSA-N 2 2 342.424 3.698 20 5 EHBDLP C[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000338716740 1128745394 /nfs/dbraw/zinc/74/53/94/1128745394.db2.gz RHOOSXANEGYPTL-ZDUSSCGKSA-N 2 2 342.424 3.698 20 5 EHBDLP C[C@@H]([NH2+]Cc1cccc(Cn2cc[nH+]c2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173314319 1130205739 /nfs/dbraw/zinc/20/57/39/1130205739.db2.gz XMEFPLSUFVUZGX-OAHLLOKOSA-N 2 2 336.395 3.690 20 5 EHBDLP CC(C)(C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCCC1 ZINC000479852696 1026856865 /nfs/dbraw/zinc/85/68/65/1026856865.db2.gz NTYGRRPIIFADKI-GOSISDBHSA-N 2 2 345.487 3.770 20 5 EHBDLP C[C@@]1(C[NH2+]Cc2ccccc2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC000311216154 1040912474 /nfs/dbraw/zinc/91/24/74/1040912474.db2.gz RVNBSEBBQMFLNT-FQEVSTJZSA-N 2 2 339.439 3.597 20 5 EHBDLP C[C@@]1(C[NH2+]Cc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000311216154 1040912494 /nfs/dbraw/zinc/91/24/94/1040912494.db2.gz RVNBSEBBQMFLNT-FQEVSTJZSA-N 2 2 339.439 3.597 20 5 EHBDLP C[C@H]([NH2+]Cc1cccc(Cn2cc[nH+]c2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173314305 1130205624 /nfs/dbraw/zinc/20/56/24/1130205624.db2.gz XMEFPLSUFVUZGX-HNNXBMFYSA-N 2 2 336.395 3.690 20 5 EHBDLP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000866238597 1137337833 /nfs/dbraw/zinc/33/78/33/1137337833.db2.gz PZLWRYNNLCRIBK-SUMWQHHRSA-N 2 2 348.422 3.566 20 5 EHBDLP C[C@@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414951486 1017352335 /nfs/dbraw/zinc/35/23/35/1017352335.db2.gz JBUJSQUPLGQWKD-LRDDRELGSA-N 2 2 331.441 3.553 20 5 EHBDLP [NH3+][C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000424366437 1029028886 /nfs/dbraw/zinc/02/88/86/1029028886.db2.gz IUXMLIPKIQVCPM-HZPDHXFCSA-N 2 2 349.818 3.868 20 5 EHBDLP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180155413 1035919385 /nfs/dbraw/zinc/91/93/85/1035919385.db2.gz FJFVBIMQLOFCHF-UZLBHIALSA-N 2 2 339.439 3.616 20 5 EHBDLP CC[N@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180155413 1035919401 /nfs/dbraw/zinc/91/94/01/1035919401.db2.gz FJFVBIMQLOFCHF-UZLBHIALSA-N 2 2 339.439 3.616 20 5 EHBDLP CCc1[nH+]ccn1[C@H]1CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493310267 1037245451 /nfs/dbraw/zinc/24/54/51/1037245451.db2.gz JFXQREAJWQMPSS-ZDUSSCGKSA-N 2 2 348.834 3.844 20 5 EHBDLP CCc1[nH+]ccn1[C@H]1CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493310267 1037245467 /nfs/dbraw/zinc/24/54/67/1037245467.db2.gz JFXQREAJWQMPSS-ZDUSSCGKSA-N 2 2 348.834 3.844 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057275 1040894901 /nfs/dbraw/zinc/89/49/01/1040894901.db2.gz KQYGJOSRMWHAJD-SFHVURJKSA-N 2 2 331.460 3.683 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057275 1040894909 /nfs/dbraw/zinc/89/49/09/1040894909.db2.gz KQYGJOSRMWHAJD-SFHVURJKSA-N 2 2 331.460 3.683 20 5 EHBDLP CC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245907099 1130330235 /nfs/dbraw/zinc/33/02/35/1130330235.db2.gz FJFVBIMQLOFCHF-OXQOHEQNSA-N 2 2 339.439 3.616 20 5 EHBDLP CC[N@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245907099 1130330239 /nfs/dbraw/zinc/33/02/39/1130330239.db2.gz FJFVBIMQLOFCHF-OXQOHEQNSA-N 2 2 339.439 3.616 20 5 EHBDLP C[C@@H]([NH3+])[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113922 1025521436 /nfs/dbraw/zinc/52/14/36/1025521436.db2.gz SPCNAGMJLLIOHY-DYVFJYSZSA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@@H]([NH3+])[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113922 1025521446 /nfs/dbraw/zinc/52/14/46/1025521446.db2.gz SPCNAGMJLLIOHY-DYVFJYSZSA-N 2 2 329.400 3.557 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000347376206 1028804202 /nfs/dbraw/zinc/80/42/02/1028804202.db2.gz ZXLMWYKYWMGKIP-DNXIFWLFSA-N 2 2 326.400 3.601 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2[nH]cc[nH+]2)C1 ZINC000347376206 1028804216 /nfs/dbraw/zinc/80/42/16/1028804216.db2.gz ZXLMWYKYWMGKIP-DNXIFWLFSA-N 2 2 326.400 3.601 20 5 EHBDLP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000892630771 1036916567 /nfs/dbraw/zinc/91/65/67/1036916567.db2.gz DDYUBTBCHHFYTB-UHFFFAOYSA-N 2 2 325.840 3.601 20 5 EHBDLP C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(-n2cc[nH+]c2)c1 ZINC000180662573 1037054550 /nfs/dbraw/zinc/05/45/50/1037054550.db2.gz HBQKZSHTYOOIGS-OAHLLOKOSA-N 2 2 336.395 3.674 20 5 EHBDLP C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110238 1037326154 /nfs/dbraw/zinc/32/61/54/1037326154.db2.gz QCZWISMDYHIKNP-GOSISDBHSA-N 2 2 339.439 3.549 20 5 EHBDLP C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110238 1037326172 /nfs/dbraw/zinc/32/61/72/1037326172.db2.gz QCZWISMDYHIKNP-GOSISDBHSA-N 2 2 339.439 3.549 20 5 EHBDLP C[NH+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076110238 1037326190 /nfs/dbraw/zinc/32/61/90/1037326190.db2.gz QCZWISMDYHIKNP-GOSISDBHSA-N 2 2 339.439 3.549 20 5 EHBDLP C[NH+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076110238 1037326208 /nfs/dbraw/zinc/32/62/08/1037326208.db2.gz QCZWISMDYHIKNP-GOSISDBHSA-N 2 2 339.439 3.549 20 5 EHBDLP CC(C)[NH2+]CCC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000591577295 1037514259 /nfs/dbraw/zinc/51/42/59/1037514259.db2.gz MULQTVPQRGEWFU-IBGZPJMESA-N 2 2 327.428 3.662 20 5 EHBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)CCC2 ZINC000378180721 1038150039 /nfs/dbraw/zinc/15/00/39/1038150039.db2.gz AHQOCJHQLSNDQH-GJZGRUSLSA-N 2 2 328.416 3.636 20 5 EHBDLP C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272245301 1121133457 /nfs/dbraw/zinc/13/34/57/1121133457.db2.gz XDIIOAJLVWRAAS-RHSMWYFYSA-N 2 2 345.468 3.657 20 5 EHBDLP C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272245301 1121133461 /nfs/dbraw/zinc/13/34/61/1121133461.db2.gz XDIIOAJLVWRAAS-RHSMWYFYSA-N 2 2 345.468 3.657 20 5 EHBDLP Cc1c(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cccc1[N+](=O)[O-] ZINC000498911743 1123112465 /nfs/dbraw/zinc/11/24/65/1123112465.db2.gz QEPZMWXAKMHBMB-SFHVURJKSA-N 2 2 345.487 3.847 20 5 EHBDLP Cc1c(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cccc1[N+](=O)[O-] ZINC000498911743 1123112467 /nfs/dbraw/zinc/11/24/67/1123112467.db2.gz QEPZMWXAKMHBMB-SFHVURJKSA-N 2 2 345.487 3.847 20 5 EHBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1c[nH+]cc1-c1cccc(C[NH3+])c1 ZINC001173229644 1132008593 /nfs/dbraw/zinc/00/85/93/1132008593.db2.gz OKXIVWVFWHHJBH-AWEZNQCLSA-N 2 2 336.395 3.721 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000811474566 1136096638 /nfs/dbraw/zinc/09/66/38/1136096638.db2.gz LVQMHQZRVZDYEH-QWHCGFSZSA-N 2 2 344.242 3.618 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000811474566 1136096640 /nfs/dbraw/zinc/09/66/40/1136096640.db2.gz LVQMHQZRVZDYEH-QWHCGFSZSA-N 2 2 344.242 3.618 20 5 EHBDLP C[N@H+](Cc1ccc2c(c1)C[NH2+]CC2)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000846217671 1137341982 /nfs/dbraw/zinc/34/19/82/1137341982.db2.gz KYHWKEXZMIMEMM-UHFFFAOYSA-N 2 2 345.830 3.526 20 5 EHBDLP C[N@@H+](Cc1ccc2c(c1)C[NH2+]CC2)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000846217671 1137341983 /nfs/dbraw/zinc/34/19/83/1137341983.db2.gz KYHWKEXZMIMEMM-UHFFFAOYSA-N 2 2 345.830 3.526 20 5 EHBDLP CC[NH+](CC)CCCC1CC[NH+](Cc2cc(O)ccc2[N+](=O)[O-])CC1 ZINC000339080783 1137408576 /nfs/dbraw/zinc/40/85/76/1137408576.db2.gz DXTMJOGLCVFRKI-UHFFFAOYSA-N 2 2 349.475 3.634 20 5 EHBDLP C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000090909963 1021694474 /nfs/dbraw/zinc/69/44/74/1021694474.db2.gz RYXYIEJAGYJFHC-OAHLLOKOSA-N 2 2 336.395 3.674 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]([NH3+])c1ccccc1 ZINC000423231341 1028296093 /nfs/dbraw/zinc/29/60/93/1028296093.db2.gz ATJJXOJRWLWFCJ-HZPDHXFCSA-N 2 2 345.468 3.755 20 5 EHBDLP CCc1[nH+]ccn1[C@@H]1CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493310266 1037245945 /nfs/dbraw/zinc/24/59/45/1037245945.db2.gz JFXQREAJWQMPSS-CYBMUJFWSA-N 2 2 348.834 3.844 20 5 EHBDLP CCc1[nH+]ccn1[C@@H]1CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493310266 1037245960 /nfs/dbraw/zinc/24/59/60/1037245960.db2.gz JFXQREAJWQMPSS-CYBMUJFWSA-N 2 2 348.834 3.844 20 5 EHBDLP Cc1cc(N[C@@H]2CCN(c3cccc[nH+]3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302092075 1129767764 /nfs/dbraw/zinc/76/77/64/1129767764.db2.gz QAAYOFWGKYLXGO-CQSZACIVSA-N 2 2 349.394 3.537 20 5 EHBDLP Cc1c(C[NH2+]Cc2ccc(-n3cc[nH+]c3)c(F)c2)cccc1[N+](=O)[O-] ZINC000790999905 1134491154 /nfs/dbraw/zinc/49/11/54/1134491154.db2.gz PJHGZMMZWLKKQP-UHFFFAOYSA-N 2 2 340.358 3.518 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000811474565 1136096448 /nfs/dbraw/zinc/09/64/48/1136096448.db2.gz LVQMHQZRVZDYEH-OLZOCXBDSA-N 2 2 344.242 3.618 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000811474565 1136096452 /nfs/dbraw/zinc/09/64/52/1136096452.db2.gz LVQMHQZRVZDYEH-OLZOCXBDSA-N 2 2 344.242 3.618 20 5 EHBDLP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000866238591 1137337981 /nfs/dbraw/zinc/33/79/81/1137337981.db2.gz PZLWRYNNLCRIBK-CXAGYDPISA-N 2 2 348.422 3.566 20 5 EHBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCCC[NH2+]C3)s2)cc1 ZINC000415064680 1017484310 /nfs/dbraw/zinc/48/43/10/1017484310.db2.gz DKRZTBMSGUVSSB-CQSZACIVSA-N 2 2 331.441 3.555 20 5 EHBDLP O=[N+]([O-])c1cc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cs1 ZINC000054175033 1021295377 /nfs/dbraw/zinc/29/53/77/1021295377.db2.gz ZDMGTDMETJLCDB-UHFFFAOYSA-N 2 2 337.489 3.744 20 5 EHBDLP CCC1([NH+](C)C)CC[NH+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000602740569 1033128993 /nfs/dbraw/zinc/12/89/93/1033128993.db2.gz WUUXVFUZUGEMHL-SSZFMOIBSA-N 2 2 331.460 3.804 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccccc1Cn1cc[nH+]c1 ZINC000574530522 1033274375 /nfs/dbraw/zinc/27/43/75/1033274375.db2.gz BORYFPCPGXLAQG-LJQANCHMSA-N 2 2 348.406 3.617 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000504900447 1029025971 /nfs/dbraw/zinc/02/59/71/1029025971.db2.gz YDVQJCLQMRLQPN-OWCLPIDISA-N 2 2 349.500 3.682 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@H+]2CCCC[C@H]12 ZINC000504900447 1029025985 /nfs/dbraw/zinc/02/59/85/1029025985.db2.gz YDVQJCLQMRLQPN-OWCLPIDISA-N 2 2 349.500 3.682 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000504900445 1029027534 /nfs/dbraw/zinc/02/75/34/1029027534.db2.gz YDVQJCLQMRLQPN-BZUAXINKSA-N 2 2 349.500 3.682 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000504900445 1029027546 /nfs/dbraw/zinc/02/75/46/1029027546.db2.gz YDVQJCLQMRLQPN-BZUAXINKSA-N 2 2 349.500 3.682 20 5 EHBDLP C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000480613168 1034679440 /nfs/dbraw/zinc/67/94/40/1034679440.db2.gz MMCWZXDCVREWJW-MDZRGWNJSA-N 2 2 345.487 3.626 20 5 EHBDLP C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000480613168 1034679442 /nfs/dbraw/zinc/67/94/42/1034679442.db2.gz MMCWZXDCVREWJW-MDZRGWNJSA-N 2 2 345.487 3.626 20 5 EHBDLP C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@@H+]1CCCC[C@H]1C ZINC000480622396 1034694526 /nfs/dbraw/zinc/69/45/26/1034694526.db2.gz XYWCUHSQXJTGRH-JTDSTZFVSA-N 2 2 345.487 3.768 20 5 EHBDLP C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCCC[C@H]1C ZINC000480622396 1034694539 /nfs/dbraw/zinc/69/45/39/1034694539.db2.gz XYWCUHSQXJTGRH-JTDSTZFVSA-N 2 2 345.487 3.768 20 5 EHBDLP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209997 1044161061 /nfs/dbraw/zinc/16/10/61/1044161061.db2.gz BQBYPBXYTWTOGL-AEFFLSMTSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@@H]1CCCC[N@H+]1C[C@H]1CCC[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209997 1044161068 /nfs/dbraw/zinc/16/10/68/1044161068.db2.gz BQBYPBXYTWTOGL-AEFFLSMTSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209997 1044161076 /nfs/dbraw/zinc/16/10/76/1044161076.db2.gz BQBYPBXYTWTOGL-AEFFLSMTSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@@H]1CCCC[NH+]1C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209997 1044161079 /nfs/dbraw/zinc/16/10/79/1044161079.db2.gz BQBYPBXYTWTOGL-AEFFLSMTSA-N 2 2 331.460 3.681 20 5 EHBDLP CC(C)(C)[C@@H](Cn1cc[nH+]c1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774133926 1133620650 /nfs/dbraw/zinc/62/06/50/1133620650.db2.gz JRHLCGWLNROLLS-QZTJIDSGSA-N 2 2 342.443 3.873 20 5 EHBDLP CC(C)(C)[C@H](Cn1cc[nH+]c1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774133927 1133620708 /nfs/dbraw/zinc/62/07/08/1133620708.db2.gz JRHLCGWLNROLLS-ROUUACIJSA-N 2 2 342.443 3.873 20 5 EHBDLP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCCC[NH2+]C2)s1 ZINC000415071380 1017505168 /nfs/dbraw/zinc/50/51/68/1017505168.db2.gz SVHQJVOOHUUQGI-ZDUSSCGKSA-N 2 2 331.441 3.555 20 5 EHBDLP C[N@H+](CCCn1cc[nH+]c1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290397733 1018583672 /nfs/dbraw/zinc/58/36/72/1018583672.db2.gz JFOKOEZGYGUYKL-UHFFFAOYSA-N 2 2 340.383 3.573 20 5 EHBDLP C[N@@H+](CCCn1cc[nH+]c1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290397733 1018583680 /nfs/dbraw/zinc/58/36/80/1018583680.db2.gz JFOKOEZGYGUYKL-UHFFFAOYSA-N 2 2 340.383 3.573 20 5 EHBDLP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000539531019 1036888955 /nfs/dbraw/zinc/88/89/55/1036888955.db2.gz OYEIKQQHERQRTO-GJZGRUSLSA-N 2 2 325.478 3.647 20 5 EHBDLP Cc1c([C@@H](C)[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000765251223 1127588998 /nfs/dbraw/zinc/58/89/98/1127588998.db2.gz MXILNQPPUJXVMP-PBHICJAKSA-N 2 2 330.432 3.865 20 5 EHBDLP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cc[nH+]cc1 ZINC001173884604 1132179475 /nfs/dbraw/zinc/17/94/75/1132179475.db2.gz MVFGJEHOGMZBCH-UHFFFAOYSA-N 2 2 330.391 3.639 20 5 EHBDLP Cc1[nH]c(C2CC[NH+](Cc3cc(Cl)ccc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000886666737 1138111615 /nfs/dbraw/zinc/11/16/15/1138111615.db2.gz ZFQVMOZKSLDYTK-UHFFFAOYSA-N 2 2 348.834 3.968 20 5 EHBDLP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1-n1cc[nH+]c1)CCC2 ZINC000192727166 1140547554 /nfs/dbraw/zinc/54/75/54/1140547554.db2.gz AYOCYGCCRLZCSX-IBGZPJMESA-N 2 2 348.406 3.948 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425501 1032811227 /nfs/dbraw/zinc/81/12/27/1032811227.db2.gz HBDGRRYFCBHDGL-AEFFLSMTSA-N 2 2 331.460 3.682 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425501 1032811235 /nfs/dbraw/zinc/81/12/35/1032811235.db2.gz HBDGRRYFCBHDGL-AEFFLSMTSA-N 2 2 331.460 3.682 20 5 EHBDLP C[NH+]1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000237169220 1028115794 /nfs/dbraw/zinc/11/57/94/1028115794.db2.gz XJBHMNZDVPDBRB-UHFFFAOYSA-N 2 2 349.818 3.692 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000595015067 1033609401 /nfs/dbraw/zinc/60/94/01/1033609401.db2.gz WWVUSVDHLMSCAN-CQSZACIVSA-N 2 2 347.459 3.661 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000595023872 1033616273 /nfs/dbraw/zinc/61/62/73/1033616273.db2.gz ZDYMKGXOENHQBS-CVEARBPZSA-N 2 2 349.475 3.622 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000595023872 1033616286 /nfs/dbraw/zinc/61/62/86/1033616286.db2.gz ZDYMKGXOENHQBS-CVEARBPZSA-N 2 2 349.475 3.622 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCn2cc(C)[nH+]c21 ZINC000344857162 1044532611 /nfs/dbraw/zinc/53/26/11/1044532611.db2.gz LQMJXTKGTXCPDI-ZGUWOUCSSA-N 2 2 340.427 3.670 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000850424806 1136256576 /nfs/dbraw/zinc/25/65/76/1136256576.db2.gz HMQWRFRQCMUZLW-DYVFJYSZSA-N 2 2 346.431 3.565 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000872076606 1137570097 /nfs/dbraw/zinc/57/00/97/1137570097.db2.gz OCKAUYOBVUEJJG-FUDCBSFHSA-N 2 2 335.473 3.593 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000872076606 1137570098 /nfs/dbraw/zinc/57/00/98/1137570098.db2.gz OCKAUYOBVUEJJG-FUDCBSFHSA-N 2 2 335.473 3.593 20 5 EHBDLP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C ZINC000093644280 1138239131 /nfs/dbraw/zinc/23/91/31/1138239131.db2.gz QVJALBYKUFALHM-LSDHHAIUSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000093644280 1138239132 /nfs/dbraw/zinc/23/91/32/1138239132.db2.gz QVJALBYKUFALHM-LSDHHAIUSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[NH+]1C ZINC000093644280 1138239133 /nfs/dbraw/zinc/23/91/33/1138239133.db2.gz QVJALBYKUFALHM-LSDHHAIUSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[NH+]1C ZINC000093644280 1138239134 /nfs/dbraw/zinc/23/91/34/1138239134.db2.gz QVJALBYKUFALHM-LSDHHAIUSA-N 2 2 343.427 3.769 20 5 EHBDLP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCCC[NH2+]C2)s1 ZINC000415071378 1017503205 /nfs/dbraw/zinc/50/32/05/1017503205.db2.gz SVHQJVOOHUUQGI-CYBMUJFWSA-N 2 2 331.441 3.555 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccc(Cn2cc[nH+]c2)cc1 ZINC000521460597 1025397110 /nfs/dbraw/zinc/39/71/10/1025397110.db2.gz GJJMWARHYMZHKT-LJQANCHMSA-N 2 2 348.406 3.617 20 5 EHBDLP Cc1c(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cccc1[N+](=O)[O-] ZINC000303207311 1037218189 /nfs/dbraw/zinc/21/81/89/1037218189.db2.gz QEDOPMFMFPZUGM-GOSISDBHSA-N 2 2 345.487 3.991 20 5 EHBDLP Cc1c(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cccc1[N+](=O)[O-] ZINC000303207311 1037218204 /nfs/dbraw/zinc/21/82/04/1037218204.db2.gz QEDOPMFMFPZUGM-GOSISDBHSA-N 2 2 345.487 3.991 20 5 EHBDLP Cc1ccc(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171370 1043610295 /nfs/dbraw/zinc/61/02/95/1043610295.db2.gz WWVGNJGPMVWXCJ-HKUYNNGSSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171370 1043610297 /nfs/dbraw/zinc/61/02/97/1043610297.db2.gz WWVGNJGPMVWXCJ-HKUYNNGSSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171370 1043610300 /nfs/dbraw/zinc/61/03/00/1043610300.db2.gz WWVGNJGPMVWXCJ-HKUYNNGSSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171370 1043610306 /nfs/dbraw/zinc/61/03/06/1043610306.db2.gz WWVGNJGPMVWXCJ-HKUYNNGSSA-N 2 2 345.487 3.990 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CC[N@@H+](C2CCCC2)C1)C1CC1 ZINC000153682206 1121581195 /nfs/dbraw/zinc/58/11/95/1121581195.db2.gz OPGAJSYCQGAFOS-IEBWSBKVSA-N 2 2 343.471 3.522 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CC[N@H+](C2CCCC2)C1)C1CC1 ZINC000153682206 1121581203 /nfs/dbraw/zinc/58/12/03/1121581203.db2.gz OPGAJSYCQGAFOS-IEBWSBKVSA-N 2 2 343.471 3.522 20 5 EHBDLP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180507371 1124019553 /nfs/dbraw/zinc/01/95/53/1124019553.db2.gz QFCLJLXJDVBIHZ-JXFKEZNVSA-N 2 2 339.439 3.616 20 5 EHBDLP C[N@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180507371 1124019558 /nfs/dbraw/zinc/01/95/58/1124019558.db2.gz QFCLJLXJDVBIHZ-JXFKEZNVSA-N 2 2 339.439 3.616 20 5 EHBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555294 1133155461 /nfs/dbraw/zinc/15/54/61/1133155461.db2.gz PTUBEMVHGYPQCN-GXTWGEPZSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555294 1133155466 /nfs/dbraw/zinc/15/54/66/1133155466.db2.gz PTUBEMVHGYPQCN-GXTWGEPZSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555294 1133155470 /nfs/dbraw/zinc/15/54/70/1133155470.db2.gz PTUBEMVHGYPQCN-GXTWGEPZSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555294 1133155472 /nfs/dbraw/zinc/15/54/72/1133155472.db2.gz PTUBEMVHGYPQCN-GXTWGEPZSA-N 2 2 325.840 3.553 20 5 EHBDLP O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C3CC[NH+](C4CC4)CC3)o2)c1 ZINC001199078893 1135879948 /nfs/dbraw/zinc/87/99/48/1135879948.db2.gz VRHYFPSMMBGMBT-UHFFFAOYSA-N 2 2 341.411 3.571 20 5 EHBDLP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811482897 1136091529 /nfs/dbraw/zinc/09/15/29/1136091529.db2.gz WQNMISQFJUQGPI-QWHCGFSZSA-N 2 2 346.258 3.864 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCCCn1cc[nH+]c1 ZINC000811474935 1136096105 /nfs/dbraw/zinc/09/61/05/1136096105.db2.gz FVWCSYCPIOSQOQ-UHFFFAOYSA-N 2 2 343.214 3.668 20 5 EHBDLP C[N@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703278 1018570495 /nfs/dbraw/zinc/57/04/95/1018570495.db2.gz AVXHJTUINJHSDS-CQSZACIVSA-N 2 2 325.840 3.554 20 5 EHBDLP C[N@@H+](CC[C@H]1CCCC[NH+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703278 1018570504 /nfs/dbraw/zinc/57/05/04/1018570504.db2.gz AVXHJTUINJHSDS-CQSZACIVSA-N 2 2 325.840 3.554 20 5 EHBDLP C[NH+](CC[C@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703278 1018570516 /nfs/dbraw/zinc/57/05/16/1018570516.db2.gz AVXHJTUINJHSDS-CQSZACIVSA-N 2 2 325.840 3.554 20 5 EHBDLP C[NH+](CC[C@H]1CCCC[N@H+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703278 1018570524 /nfs/dbraw/zinc/57/05/24/1018570524.db2.gz AVXHJTUINJHSDS-CQSZACIVSA-N 2 2 325.840 3.554 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000434789211 1024427658 /nfs/dbraw/zinc/42/76/58/1024427658.db2.gz MKTLNDCRAKGUNQ-HVEPWOEZSA-N 2 2 329.444 3.605 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCC[N@H+]1C1CC1 ZINC000434789211 1024427664 /nfs/dbraw/zinc/42/76/64/1024427664.db2.gz MKTLNDCRAKGUNQ-HVEPWOEZSA-N 2 2 329.444 3.605 20 5 EHBDLP C[NH+]1CCC([N@H+](Cc2ccccc2)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000342528731 1026109461 /nfs/dbraw/zinc/10/94/61/1026109461.db2.gz VTNHEMDPLVGUJL-UHFFFAOYSA-N 2 2 339.439 3.691 20 5 EHBDLP C[NH+]1CCC([N@@H+](Cc2ccccc2)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000342528731 1026109475 /nfs/dbraw/zinc/10/94/75/1026109475.db2.gz VTNHEMDPLVGUJL-UHFFFAOYSA-N 2 2 339.439 3.691 20 5 EHBDLP Cc1ccc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000061003351 1033418424 /nfs/dbraw/zinc/41/84/24/1033418424.db2.gz YBSWUNJPIMSHBX-UHFFFAOYSA-N 2 2 339.439 3.657 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000595015066 1033610209 /nfs/dbraw/zinc/61/02/09/1033610209.db2.gz WWVUSVDHLMSCAN-AWEZNQCLSA-N 2 2 347.459 3.661 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(-n3cc[nH+]c3)cc2)C2CC2)cc1 ZINC000343951397 1042930896 /nfs/dbraw/zinc/93/08/96/1042930896.db2.gz LFCBSWCZKQMCLK-UHFFFAOYSA-N 2 2 348.406 3.945 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccc(-n3cc[nH+]c3)cc2)C2CC2)cc1 ZINC000343951397 1042930899 /nfs/dbraw/zinc/93/08/99/1042930899.db2.gz LFCBSWCZKQMCLK-UHFFFAOYSA-N 2 2 348.406 3.945 20 5 EHBDLP C[C@@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000811474381 1136095727 /nfs/dbraw/zinc/09/57/27/1136095727.db2.gz HNHAPRZAMLFQSE-NSHDSACASA-N 2 2 346.258 3.723 20 5 EHBDLP C[C@H]([NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872023191 1137565328 /nfs/dbraw/zinc/56/53/28/1137565328.db2.gz CZOGVNCIGOVAAH-WFASDCNBSA-N 2 2 334.395 3.696 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000872045788 1137567575 /nfs/dbraw/zinc/56/75/75/1137567575.db2.gz BIPUMCZYQOSUJH-ZDUSSCGKSA-N 2 2 337.489 3.840 20 5 EHBDLP O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(-n3cc[nH+]c3)cc2)C2CC2)c1 ZINC000507169200 1023171834 /nfs/dbraw/zinc/17/18/34/1023171834.db2.gz UMMTZIJTDGDQDA-UHFFFAOYSA-N 2 2 348.406 3.945 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000595032290 1033653235 /nfs/dbraw/zinc/65/32/35/1033653235.db2.gz MCIYFACWUPUEPL-LSDHHAIUSA-N 2 2 335.448 3.519 20 5 EHBDLP [NH3+]C1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000596648353 1034346013 /nfs/dbraw/zinc/34/60/13/1034346013.db2.gz QSXLDCLQXSBNQF-SFHVURJKSA-N 2 2 325.412 3.545 20 5 EHBDLP C[NH+](C)CC(C)(C)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491370045 1037429418 /nfs/dbraw/zinc/42/94/18/1037429418.db2.gz XYILRTPSMCDAAX-LJQANCHMSA-N 2 2 341.455 3.862 20 5 EHBDLP Cc1c([C@H](C)[NH2+][C@@H](Cn2cc[nH+]c2)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000765251231 1127588762 /nfs/dbraw/zinc/58/87/62/1127588762.db2.gz MXILNQPPUJXVMP-YOEHRIQHSA-N 2 2 330.432 3.865 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(-n2cc[nH+]c2)cc1 ZINC000765357702 1127601090 /nfs/dbraw/zinc/60/10/90/1127601090.db2.gz CEGHVNWIDSGYDN-OAHLLOKOSA-N 2 2 336.395 3.940 20 5 EHBDLP CCC1([NH+]2CCC2)CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC001176234839 1132882544 /nfs/dbraw/zinc/88/25/44/1132882544.db2.gz JCYZTAAERRFJOP-INIZCTEOSA-N 2 2 331.460 3.915 20 5 EHBDLP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1[N+](=O)[O-] ZINC001190826219 1134756037 /nfs/dbraw/zinc/75/60/37/1134756037.db2.gz GGCYZQSSEQGAPI-LJQANCHMSA-N 2 2 345.487 3.991 20 5 EHBDLP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1[N+](=O)[O-] ZINC001190826219 1134756042 /nfs/dbraw/zinc/75/60/42/1134756042.db2.gz GGCYZQSSEQGAPI-LJQANCHMSA-N 2 2 345.487 3.991 20 5 EHBDLP CC[NH+]1CCC([N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000339011800 1136975001 /nfs/dbraw/zinc/97/50/01/1136975001.db2.gz SUXZTLFNJPQQGG-UHFFFAOYSA-N 2 2 345.365 3.530 20 5 EHBDLP CC[NH+]1CCC([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000339011800 1136975003 /nfs/dbraw/zinc/97/50/03/1136975003.db2.gz SUXZTLFNJPQQGG-UHFFFAOYSA-N 2 2 345.365 3.530 20 5 EHBDLP CCc1ccccc1[C@H]([NH3+])C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415070022 1017503427 /nfs/dbraw/zinc/50/34/27/1017503427.db2.gz UEUAZGFSCJSEAB-HNAYVOBHSA-N 2 2 341.455 3.768 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C)([NH+]2CCC2)CC1 ZINC000895672074 1024718136 /nfs/dbraw/zinc/71/81/36/1024718136.db2.gz VSZULTRGEBUHEI-DTQAZKPQSA-N 2 2 329.444 3.558 20 5 EHBDLP CCC[C@@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000159143136 1026499377 /nfs/dbraw/zinc/49/93/77/1026499377.db2.gz NVXCAUHQZPHVGQ-LJQANCHMSA-N 2 2 349.475 3.527 20 5 EHBDLP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1(C[NH3+])CCC1 ZINC000414794776 1029107223 /nfs/dbraw/zinc/10/72/23/1029107223.db2.gz VYJQAMTVQWRTJZ-UHFFFAOYSA-N 2 2 331.441 3.637 20 5 EHBDLP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1(C[NH3+])CCC1 ZINC000414794776 1029107235 /nfs/dbraw/zinc/10/72/35/1029107235.db2.gz VYJQAMTVQWRTJZ-UHFFFAOYSA-N 2 2 331.441 3.637 20 5 EHBDLP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599073562 1033715002 /nfs/dbraw/zinc/71/50/02/1033715002.db2.gz KDKIHOYVMLLXSO-YJBOKZPZSA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000599073562 1033715013 /nfs/dbraw/zinc/71/50/13/1033715013.db2.gz KDKIHOYVMLLXSO-YJBOKZPZSA-N 2 2 331.460 3.522 20 5 EHBDLP C[NH+](C)CC(C)(C)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491370044 1037428698 /nfs/dbraw/zinc/42/86/98/1037428698.db2.gz XYILRTPSMCDAAX-IBGZPJMESA-N 2 2 341.455 3.862 20 5 EHBDLP C[N@@H+]1CCC[C@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245987161 1130335969 /nfs/dbraw/zinc/33/59/69/1130335969.db2.gz QFCLJLXJDVBIHZ-OXQOHEQNSA-N 2 2 339.439 3.616 20 5 EHBDLP C[N@H+]1CCC[C@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245987161 1130335972 /nfs/dbraw/zinc/33/59/72/1130335972.db2.gz QFCLJLXJDVBIHZ-OXQOHEQNSA-N 2 2 339.439 3.616 20 5 EHBDLP CCC[NH+]1CCC([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1 ZINC000872018101 1137564812 /nfs/dbraw/zinc/56/48/12/1137564812.db2.gz IKDVWUOQOBXKAW-CYBMUJFWSA-N 2 2 337.489 3.842 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCCn1cc[nH+]c1 ZINC000872023517 1137565490 /nfs/dbraw/zinc/56/54/90/1137565490.db2.gz IFULKMVADLFPJQ-ZDUSSCGKSA-N 2 2 334.445 3.644 20 5 EHBDLP C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000090909962 1021691870 /nfs/dbraw/zinc/69/18/70/1021691870.db2.gz RYXYIEJAGYJFHC-HNNXBMFYSA-N 2 2 336.395 3.674 20 5 EHBDLP CCC1([NH+](C)C)CC[NH+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000602740562 1033129052 /nfs/dbraw/zinc/12/90/52/1033129052.db2.gz WUUXVFUZUGEMHL-DTQAZKPQSA-N 2 2 331.460 3.804 20 5 EHBDLP C[C@H]([NH3+])[C@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113924 1025521805 /nfs/dbraw/zinc/52/18/05/1025521805.db2.gz SPCNAGMJLLIOHY-SUMWQHHRSA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@H]([NH3+])[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113924 1025521815 /nfs/dbraw/zinc/52/18/15/1025521815.db2.gz SPCNAGMJLLIOHY-SUMWQHHRSA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@H]([NH3+])[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113923 1025522161 /nfs/dbraw/zinc/52/21/61/1025522161.db2.gz SPCNAGMJLLIOHY-GUYCJALGSA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@H]([NH3+])[C@@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113923 1025522170 /nfs/dbraw/zinc/52/21/70/1025522170.db2.gz SPCNAGMJLLIOHY-GUYCJALGSA-N 2 2 329.400 3.557 20 5 EHBDLP C[NH+]1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000237169519 1028116275 /nfs/dbraw/zinc/11/62/75/1028116275.db2.gz HYHGWWKYRHHKLH-UHFFFAOYSA-N 2 2 331.441 3.507 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000347376207 1028805171 /nfs/dbraw/zinc/80/51/71/1028805171.db2.gz ZXLMWYKYWMGKIP-HFQYIWAZSA-N 2 2 326.400 3.601 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2[nH]cc[nH+]2)C1 ZINC000347376207 1028805189 /nfs/dbraw/zinc/80/51/89/1028805189.db2.gz ZXLMWYKYWMGKIP-HFQYIWAZSA-N 2 2 326.400 3.601 20 5 EHBDLP CC[C@H]([NH2+]C1CCN(c2cccc[nH+]2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090918696 1127125521 /nfs/dbraw/zinc/12/55/21/1127125521.db2.gz VPFRYAARLUZHMG-SFHVURJKSA-N 2 2 340.427 3.700 20 5 EHBDLP Cc1ccc(C[NH2+][C@@H](Cn2cc[nH+]c2)c2ccccc2)cc1[N+](=O)[O-] ZINC001197275703 1135668707 /nfs/dbraw/zinc/66/87/07/1135668707.db2.gz VWERBNDPVHEGHK-SFHVURJKSA-N 2 2 336.395 3.631 20 5 EHBDLP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811482896 1136091631 /nfs/dbraw/zinc/09/16/31/1136091631.db2.gz WQNMISQFJUQGPI-OLZOCXBDSA-N 2 2 346.258 3.864 20 5 EHBDLP CC(C)([NH3+])C[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414802697 1017204945 /nfs/dbraw/zinc/20/49/45/1017204945.db2.gz LGYOIZIDVJBHIS-UHFFFAOYSA-N 2 2 349.818 3.867 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)cc1 ZINC000281896176 1025650027 /nfs/dbraw/zinc/65/00/27/1025650027.db2.gz BEHOEPNUEIXAFU-INIZCTEOSA-N 2 2 340.427 3.507 20 5 EHBDLP O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)cc1 ZINC000281896176 1025650029 /nfs/dbraw/zinc/65/00/29/1025650029.db2.gz BEHOEPNUEIXAFU-INIZCTEOSA-N 2 2 340.427 3.507 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000347355960 1025699983 /nfs/dbraw/zinc/69/99/83/1025699983.db2.gz JUXCZMKUAAHYHB-SDNWHVSQSA-N 2 2 326.400 3.601 20 5 EHBDLP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144925 1028207001 /nfs/dbraw/zinc/20/70/01/1028207001.db2.gz IITODWJQSXXXPY-YJLNNSPDSA-N 2 2 325.412 3.739 20 5 EHBDLP CCOc1ccc([C@H](C)[NH2+][C@@H](C[NH3+])C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263494 1028300531 /nfs/dbraw/zinc/30/05/31/1028300531.db2.gz ONIYCTQSCNLKDS-BBRMVZONSA-N 2 2 335.448 3.552 20 5 EHBDLP C[C@@]1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC[NH2+]C1 ZINC000423338931 1028373222 /nfs/dbraw/zinc/37/32/22/1028373222.db2.gz LFFWKPYINQUKJN-WOJBJXKFSA-N 2 2 339.439 3.664 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000282059897 1029721262 /nfs/dbraw/zinc/72/12/62/1029721262.db2.gz MOUVGIPNKBJTIM-MRXNPFEDSA-N 2 2 340.427 3.507 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](c2[nH+]cc3n2CCCC3)C1 ZINC000282059897 1029721267 /nfs/dbraw/zinc/72/12/67/1029721267.db2.gz MOUVGIPNKBJTIM-MRXNPFEDSA-N 2 2 340.427 3.507 20 5 EHBDLP C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000480613166 1039760023 /nfs/dbraw/zinc/76/00/23/1039760023.db2.gz MMCWZXDCVREWJW-JTDSTZFVSA-N 2 2 345.487 3.626 20 5 EHBDLP C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000480613166 1039760046 /nfs/dbraw/zinc/76/00/46/1039760046.db2.gz MMCWZXDCVREWJW-JTDSTZFVSA-N 2 2 345.487 3.626 20 5 EHBDLP C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000074322116 1123291711 /nfs/dbraw/zinc/29/17/11/1123291711.db2.gz AQEKYWIGZCLROF-UHFFFAOYSA-N 2 2 339.439 3.691 20 5 EHBDLP C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000074322116 1123291716 /nfs/dbraw/zinc/29/17/16/1123291716.db2.gz AQEKYWIGZCLROF-UHFFFAOYSA-N 2 2 339.439 3.691 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(-n2cc[nH+]c2)cc1 ZINC000786813484 1133910539 /nfs/dbraw/zinc/91/05/39/1133910539.db2.gz XMVARSFETAJQBE-LFIBNONCSA-N 2 2 348.406 3.974 20 5 EHBDLP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476106 1136096264 /nfs/dbraw/zinc/09/62/64/1136096264.db2.gz FLYYLAUNFFWELN-LLVKDONJSA-N 2 2 346.258 3.723 20 5 EHBDLP CC[N@H+]1CCC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476106 1136096267 /nfs/dbraw/zinc/09/62/67/1136096267.db2.gz FLYYLAUNFFWELN-LLVKDONJSA-N 2 2 346.258 3.723 20 5 EHBDLP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279954 1016848766 /nfs/dbraw/zinc/84/87/66/1016848766.db2.gz RQJIRDKWDPAXNH-MJGOQNOKSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279954 1016848782 /nfs/dbraw/zinc/84/87/82/1016848782.db2.gz RQJIRDKWDPAXNH-MJGOQNOKSA-N 2 2 325.412 3.520 20 5 EHBDLP CC(C)([NH2+]Cc1ccc(-n2cc[nH+]c2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000175986148 1022374720 /nfs/dbraw/zinc/37/47/20/1022374720.db2.gz LKFYWIZTRKZYGD-UHFFFAOYSA-N 2 2 336.395 3.805 20 5 EHBDLP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000125235490 1026334382 /nfs/dbraw/zinc/33/43/82/1026334382.db2.gz NRZVGXDTKSUBPZ-UHFFFAOYSA-N 2 2 343.427 3.771 20 5 EHBDLP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000125235490 1026334402 /nfs/dbraw/zinc/33/44/02/1026334402.db2.gz NRZVGXDTKSUBPZ-UHFFFAOYSA-N 2 2 343.427 3.771 20 5 EHBDLP CC[NH2+][C@H](C)C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423390904 1028405455 /nfs/dbraw/zinc/40/54/55/1028405455.db2.gz WLOQRHHONNYCPT-OLZOCXBDSA-N 2 2 333.457 3.972 20 5 EHBDLP Cc1cc(-n2cc[nH+]c2)ccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000192152427 1029604747 /nfs/dbraw/zinc/60/47/47/1029604747.db2.gz BZULNZIOAIOQDB-OAHLLOKOSA-N 2 2 336.395 3.940 20 5 EHBDLP C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCC(C)CC1 ZINC000481971120 1030140307 /nfs/dbraw/zinc/14/03/07/1030140307.db2.gz FZJNZOJECPVUPP-QFBILLFUSA-N 2 2 345.487 3.626 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000470174505 1038468276 /nfs/dbraw/zinc/46/82/76/1038468276.db2.gz LKOIBKHNXXCDEU-SSZFMOIBSA-N 2 2 329.444 3.558 20 5 EHBDLP CC(C)[NH+]1CCC([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000279517271 1044168331 /nfs/dbraw/zinc/16/83/31/1044168331.db2.gz NZVASDVLEWWGER-UHFFFAOYSA-N 2 2 345.365 3.576 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CC[N@@H+](C2CCCC2)C1)C1CC1 ZINC000153682098 1121581625 /nfs/dbraw/zinc/58/16/25/1121581625.db2.gz OPGAJSYCQGAFOS-MJGOQNOKSA-N 2 2 343.471 3.522 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CC[N@H+](C2CCCC2)C1)C1CC1 ZINC000153682098 1121581628 /nfs/dbraw/zinc/58/16/28/1121581628.db2.gz OPGAJSYCQGAFOS-MJGOQNOKSA-N 2 2 343.471 3.522 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000255210933 1129046187 /nfs/dbraw/zinc/04/61/87/1129046187.db2.gz IDEGDDWVSWEWHK-MTIYJEKLSA-N 2 2 329.444 3.558 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000255210933 1129046189 /nfs/dbraw/zinc/04/61/89/1129046189.db2.gz IDEGDDWVSWEWHK-MTIYJEKLSA-N 2 2 329.444 3.558 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245528189 1130230713 /nfs/dbraw/zinc/23/07/13/1130230713.db2.gz QJIXSGDGBJIGTC-HOTGVXAUSA-N 2 2 342.443 3.652 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245528189 1130230718 /nfs/dbraw/zinc/23/07/18/1130230718.db2.gz QJIXSGDGBJIGTC-HOTGVXAUSA-N 2 2 342.443 3.652 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000850444158 1136259888 /nfs/dbraw/zinc/25/98/88/1136259888.db2.gz XAEBBXZUPWPFMR-CYBMUJFWSA-N 2 2 335.448 3.517 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1[N+](=O)[O-] ZINC000092072748 1032764044 /nfs/dbraw/zinc/76/40/44/1032764044.db2.gz KEAMYLBHTGPGTP-OAHLLOKOSA-N 2 2 328.416 3.821 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc1[N+](=O)[O-] ZINC000092072748 1032764054 /nfs/dbraw/zinc/76/40/54/1032764054.db2.gz KEAMYLBHTGPGTP-OAHLLOKOSA-N 2 2 328.416 3.821 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCC[N@@H+]1C1CC1 ZINC000434789206 1024427875 /nfs/dbraw/zinc/42/78/75/1024427875.db2.gz MKTLNDCRAKGUNQ-FERCGXDMSA-N 2 2 329.444 3.605 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCC[N@H+]1C1CC1 ZINC000434789206 1024427881 /nfs/dbraw/zinc/42/78/81/1024427881.db2.gz MKTLNDCRAKGUNQ-FERCGXDMSA-N 2 2 329.444 3.605 20 5 EHBDLP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423246327 1028306040 /nfs/dbraw/zinc/30/60/40/1028306040.db2.gz ZDHNCBILQWSZOZ-OLZOCXBDSA-N 2 2 331.441 3.726 20 5 EHBDLP CCc1ccc([C@H]([NH2+][C@H]2CCC[C@H]([NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423375035 1028412338 /nfs/dbraw/zinc/41/23/38/1028412338.db2.gz IPIWAEXTGNMUPC-YZVOILCLSA-N 2 2 343.427 3.699 20 5 EHBDLP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)[N@H+](C)C1CC1 ZINC000504899156 1029026586 /nfs/dbraw/zinc/02/65/86/1029026586.db2.gz BLUJULSVVANRKO-KBPBESRZSA-N 2 2 337.489 3.538 20 5 EHBDLP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)[N@@H+](C)C1CC1 ZINC000504899156 1029026593 /nfs/dbraw/zinc/02/65/93/1029026593.db2.gz BLUJULSVVANRKO-KBPBESRZSA-N 2 2 337.489 3.538 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000595032288 1033653447 /nfs/dbraw/zinc/65/34/47/1033653447.db2.gz MCIYFACWUPUEPL-GJZGRUSLSA-N 2 2 335.448 3.519 20 5 EHBDLP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245987157 1130335884 /nfs/dbraw/zinc/33/58/84/1130335884.db2.gz QFCLJLXJDVBIHZ-OXJNMPFZSA-N 2 2 339.439 3.616 20 5 EHBDLP C[N@H+]1CCC[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245987157 1130335890 /nfs/dbraw/zinc/33/58/90/1130335890.db2.gz QFCLJLXJDVBIHZ-OXJNMPFZSA-N 2 2 339.439 3.616 20 5 EHBDLP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811506561 1136101586 /nfs/dbraw/zinc/10/15/86/1136101586.db2.gz AEACYQKTXFQHAQ-NSHDSACASA-N 2 2 346.258 3.722 20 5 EHBDLP CC(C)[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811506561 1136101590 /nfs/dbraw/zinc/10/15/90/1136101590.db2.gz AEACYQKTXFQHAQ-NSHDSACASA-N 2 2 346.258 3.722 20 5 EHBDLP C[C@@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316595 1018160154 /nfs/dbraw/zinc/16/01/54/1018160154.db2.gz CQFSGVYEVSFNEH-RHSMWYFYSA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316595 1018160159 /nfs/dbraw/zinc/16/01/59/1018160159.db2.gz CQFSGVYEVSFNEH-RHSMWYFYSA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316595 1018160163 /nfs/dbraw/zinc/16/01/63/1018160163.db2.gz CQFSGVYEVSFNEH-RHSMWYFYSA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316595 1018160166 /nfs/dbraw/zinc/16/01/66/1018160166.db2.gz CQFSGVYEVSFNEH-RHSMWYFYSA-N 2 2 343.427 3.627 20 5 EHBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)CCC2 ZINC000377837605 1018453994 /nfs/dbraw/zinc/45/39/94/1018453994.db2.gz PADPXEUYJWROBJ-INIZCTEOSA-N 2 2 342.443 3.890 20 5 EHBDLP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144922 1028206212 /nfs/dbraw/zinc/20/62/12/1028206212.db2.gz IITODWJQSXXXPY-FNHZYXHNSA-N 2 2 325.412 3.739 20 5 EHBDLP Cc1c[nH+]ccc1OC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278532799 1031260068 /nfs/dbraw/zinc/26/00/68/1031260068.db2.gz FGYQXWMEDMVSDY-OAHLLOKOSA-N 2 2 341.411 3.903 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000598998911 1033634594 /nfs/dbraw/zinc/63/45/94/1033634594.db2.gz ZCJFANUGNNSFPZ-HVEPWOEZSA-N 2 2 329.444 3.605 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000598998911 1033634604 /nfs/dbraw/zinc/63/46/04/1033634604.db2.gz ZCJFANUGNNSFPZ-HVEPWOEZSA-N 2 2 329.444 3.605 20 5 EHBDLP C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@@H+]1CCCC[C@H]1C ZINC000480622398 1034696973 /nfs/dbraw/zinc/69/69/73/1034696973.db2.gz XYWCUHSQXJTGRH-MDZRGWNJSA-N 2 2 345.487 3.768 20 5 EHBDLP C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCCC[C@H]1C ZINC000480622398 1034696985 /nfs/dbraw/zinc/69/69/85/1034696985.db2.gz XYWCUHSQXJTGRH-MDZRGWNJSA-N 2 2 345.487 3.768 20 5 EHBDLP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000479595829 1040435941 /nfs/dbraw/zinc/43/59/41/1040435941.db2.gz XHABLWDTXFSNTQ-UHFFFAOYSA-N 2 2 337.439 3.868 20 5 EHBDLP O=[N+]([O-])c1cc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)cs1 ZINC000278858121 1042597356 /nfs/dbraw/zinc/59/73/56/1042597356.db2.gz KYQOWELLHLGAPI-UHFFFAOYSA-N 2 2 346.456 3.569 20 5 EHBDLP Cc1ccc(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1[N+](=O)[O-] ZINC000512164292 1043546066 /nfs/dbraw/zinc/54/60/66/1043546066.db2.gz BYRFRQJXBVRYNS-LJQANCHMSA-N 2 2 345.487 3.847 20 5 EHBDLP Cc1ccc(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1[N+](=O)[O-] ZINC000512164292 1043546074 /nfs/dbraw/zinc/54/60/74/1043546074.db2.gz BYRFRQJXBVRYNS-LJQANCHMSA-N 2 2 345.487 3.847 20 5 EHBDLP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872033038 1137566622 /nfs/dbraw/zinc/56/66/22/1137566622.db2.gz AYNNCZPWEFRYRL-LBPRGKRZSA-N 2 2 349.381 3.785 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066266 1138224378 /nfs/dbraw/zinc/22/43/78/1138224378.db2.gz WKYNLOMPHWPJDJ-GBNVKOLXSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000092066266 1138224382 /nfs/dbraw/zinc/22/43/82/1138224382.db2.gz WKYNLOMPHWPJDJ-GBNVKOLXSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000092066266 1138224384 /nfs/dbraw/zinc/22/43/84/1138224384.db2.gz WKYNLOMPHWPJDJ-GBNVKOLXSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000092066266 1138224386 /nfs/dbraw/zinc/22/43/86/1138224386.db2.gz WKYNLOMPHWPJDJ-GBNVKOLXSA-N 2 2 341.455 3.557 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCC[N@@H+]1C1CC1 ZINC000434789380 1024426900 /nfs/dbraw/zinc/42/69/00/1024426900.db2.gz MKTLNDCRAKGUNQ-LSSBLYJVSA-N 2 2 329.444 3.605 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCC[N@H+]1C1CC1 ZINC000434789380 1024426905 /nfs/dbraw/zinc/42/69/05/1024426905.db2.gz MKTLNDCRAKGUNQ-LSSBLYJVSA-N 2 2 329.444 3.605 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000282059892 1029721454 /nfs/dbraw/zinc/72/14/54/1029721454.db2.gz MOUVGIPNKBJTIM-INIZCTEOSA-N 2 2 340.427 3.507 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 ZINC000282059892 1029721462 /nfs/dbraw/zinc/72/14/62/1029721462.db2.gz MOUVGIPNKBJTIM-INIZCTEOSA-N 2 2 340.427 3.507 20 5 EHBDLP Cc1c(C[NH2+][C@H](C)c2cccc(-n3cc[nH+]c3)c2)cccc1[N+](=O)[O-] ZINC000180645858 1037034639 /nfs/dbraw/zinc/03/46/39/1037034639.db2.gz HHVWGSZXOVECPZ-OAHLLOKOSA-N 2 2 336.395 3.940 20 5 EHBDLP C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000194415332 1121884149 /nfs/dbraw/zinc/88/41/49/1121884149.db2.gz QQBJNNSZTKSXGH-OAHLLOKOSA-N 2 2 336.395 3.674 20 5 EHBDLP C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2cc[nH+]c2)cc1 ZINC000194415321 1121884337 /nfs/dbraw/zinc/88/43/37/1121884337.db2.gz QQBJNNSZTKSXGH-HNNXBMFYSA-N 2 2 336.395 3.674 20 5 EHBDLP CCC1([NH+]2CCC2)CC[NH+](Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC001183865836 1133872935 /nfs/dbraw/zinc/87/29/35/1133872935.db2.gz VRJCQMPIQHPEOS-UHFFFAOYSA-N 2 2 331.460 3.662 20 5 EHBDLP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811506560 1136101736 /nfs/dbraw/zinc/10/17/36/1136101736.db2.gz AEACYQKTXFQHAQ-LLVKDONJSA-N 2 2 346.258 3.722 20 5 EHBDLP CC(C)[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811506560 1136101738 /nfs/dbraw/zinc/10/17/38/1136101738.db2.gz AEACYQKTXFQHAQ-LLVKDONJSA-N 2 2 346.258 3.722 20 5 EHBDLP C[C@H]([NH2+]CCCCNc1cccc[nH+]1)c1c(F)cccc1[N+](=O)[O-] ZINC000872032434 1137566578 /nfs/dbraw/zinc/56/65/78/1137566578.db2.gz TZSFDNOULYBPDG-ZDUSSCGKSA-N 2 2 332.379 3.672 20 5 EHBDLP O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2CCc3[nH+]c[nH]c3C2)c2ccccc2)c1 ZINC000377799749 1018394668 /nfs/dbraw/zinc/39/46/68/1018394668.db2.gz YWSRMZCRZGKJLG-UZLBHIALSA-N 2 2 348.406 3.554 20 5 EHBDLP Cc1c(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475455 1023246478 /nfs/dbraw/zinc/24/64/78/1023246478.db2.gz XAKNSKZHOLWYIM-WMZOPIPTSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475455 1023246491 /nfs/dbraw/zinc/24/64/91/1023246491.db2.gz XAKNSKZHOLWYIM-WMZOPIPTSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475455 1023246503 /nfs/dbraw/zinc/24/65/03/1023246503.db2.gz XAKNSKZHOLWYIM-WMZOPIPTSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475455 1023246510 /nfs/dbraw/zinc/24/65/10/1023246510.db2.gz XAKNSKZHOLWYIM-WMZOPIPTSA-N 2 2 345.487 3.990 20 5 EHBDLP CCC[C@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000159143003 1026498821 /nfs/dbraw/zinc/49/88/21/1026498821.db2.gz NVXCAUHQZPHVGQ-IBGZPJMESA-N 2 2 349.475 3.527 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC000598998912 1033634857 /nfs/dbraw/zinc/63/48/57/1033634857.db2.gz ZCJFANUGNNSFPZ-ILCZHQDMSA-N 2 2 329.444 3.605 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC000598998912 1033634863 /nfs/dbraw/zinc/63/48/63/1033634863.db2.gz ZCJFANUGNNSFPZ-ILCZHQDMSA-N 2 2 329.444 3.605 20 5 EHBDLP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210000 1044160852 /nfs/dbraw/zinc/16/08/52/1044160852.db2.gz BQBYPBXYTWTOGL-SJLPKXTDSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210000 1044160855 /nfs/dbraw/zinc/16/08/55/1044160855.db2.gz BQBYPBXYTWTOGL-SJLPKXTDSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210000 1044160860 /nfs/dbraw/zinc/16/08/60/1044160860.db2.gz BQBYPBXYTWTOGL-SJLPKXTDSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210000 1044160863 /nfs/dbraw/zinc/16/08/63/1044160863.db2.gz BQBYPBXYTWTOGL-SJLPKXTDSA-N 2 2 331.460 3.681 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCn2cc(C)[nH+]c21 ZINC000344857158 1044528085 /nfs/dbraw/zinc/52/80/85/1044528085.db2.gz LQMJXTKGTXCPDI-DZXKJOIRSA-N 2 2 340.427 3.670 20 5 EHBDLP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872033037 1137566723 /nfs/dbraw/zinc/56/67/23/1137566723.db2.gz AYNNCZPWEFRYRL-GFCCVEGCSA-N 2 2 349.381 3.785 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000872069473 1137569395 /nfs/dbraw/zinc/56/93/95/1137569395.db2.gz QADFZBFWZUHFSL-HLIUYOAVSA-N 2 2 349.500 3.984 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425502 1032812627 /nfs/dbraw/zinc/81/26/27/1032812627.db2.gz HBDGRRYFCBHDGL-FUHWJXTLSA-N 2 2 331.460 3.682 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CCC[C@H]([C@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425502 1032812629 /nfs/dbraw/zinc/81/26/29/1032812629.db2.gz HBDGRRYFCBHDGL-FUHWJXTLSA-N 2 2 331.460 3.682 20 5 EHBDLP C[C@@H]([NH3+])[C@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077298 1025497481 /nfs/dbraw/zinc/49/74/81/1025497481.db2.gz VKAZDDPBVQESRX-CXAGYDPISA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@@H]([NH3+])[C@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077298 1025497485 /nfs/dbraw/zinc/49/74/85/1025497485.db2.gz VKAZDDPBVQESRX-CXAGYDPISA-N 2 2 329.400 3.557 20 5 EHBDLP Cc1c([C@H](C)[NH2+]Cc2ccc(-n3cc[nH+]c3)cc2)cccc1[N+](=O)[O-] ZINC000158414756 1026449936 /nfs/dbraw/zinc/44/99/36/1026449936.db2.gz BSTQTWPMVMMZKH-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP C[C@@]1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC[NH2+]C1 ZINC000423338930 1028372441 /nfs/dbraw/zinc/37/24/41/1028372441.db2.gz LFFWKPYINQUKJN-VQTJNVASSA-N 2 2 339.439 3.664 20 5 EHBDLP Cc1c([C@@H](C)[NH2+][C@H](Cn2cc[nH+]c2)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000765251226 1127588485 /nfs/dbraw/zinc/58/84/85/1127588485.db2.gz MXILNQPPUJXVMP-RHSMWYFYSA-N 2 2 330.432 3.865 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]Cc1ccccc1Cn1cc[nH+]c1 ZINC000338711794 1128733466 /nfs/dbraw/zinc/73/34/66/1128733466.db2.gz BOKOGGWIWFWHEU-WEVVVXLNSA-N 2 2 348.406 3.643 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000255641247 1129169066 /nfs/dbraw/zinc/16/90/66/1129169066.db2.gz WKYNLOMPHWPJDJ-BHSKVQTESA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000255641247 1129169068 /nfs/dbraw/zinc/16/90/68/1129169068.db2.gz WKYNLOMPHWPJDJ-BHSKVQTESA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000255641247 1129169071 /nfs/dbraw/zinc/16/90/71/1129169071.db2.gz WKYNLOMPHWPJDJ-BHSKVQTESA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000255641247 1129169074 /nfs/dbraw/zinc/16/90/74/1129169074.db2.gz WKYNLOMPHWPJDJ-BHSKVQTESA-N 2 2 341.455 3.557 20 5 EHBDLP CC(C)[N@H+](C1CC[NH+](C)CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911753 1131917782 /nfs/dbraw/zinc/91/77/82/1131917782.db2.gz FRFPFYKIEAZMRD-GOSISDBHSA-N 2 2 345.487 3.647 20 5 EHBDLP CC(C)[N@@H+](C1CC[NH+](C)CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911753 1131917788 /nfs/dbraw/zinc/91/77/88/1131917788.db2.gz FRFPFYKIEAZMRD-GOSISDBHSA-N 2 2 345.487 3.647 20 5 EHBDLP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476108 1136096490 /nfs/dbraw/zinc/09/64/90/1136096490.db2.gz FLYYLAUNFFWELN-NSHDSACASA-N 2 2 346.258 3.723 20 5 EHBDLP CC[N@H+]1CCC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476108 1136096493 /nfs/dbraw/zinc/09/64/93/1136096493.db2.gz FLYYLAUNFFWELN-NSHDSACASA-N 2 2 346.258 3.723 20 5 EHBDLP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000340283535 1016857576 /nfs/dbraw/zinc/85/75/76/1016857576.db2.gz YTWMDWGSDRCURK-IEBWSBKVSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@H+]1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000340283535 1016857589 /nfs/dbraw/zinc/85/75/89/1016857589.db2.gz YTWMDWGSDRCURK-IEBWSBKVSA-N 2 2 325.412 3.520 20 5 EHBDLP [NH3+][C@H](C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000414842979 1017232275 /nfs/dbraw/zinc/23/22/75/1017232275.db2.gz ZXVIWHXCRVTCEP-BHIYHBOVSA-N 2 2 339.439 3.596 20 5 EHBDLP CCC[NH+]1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602586683 1032986823 /nfs/dbraw/zinc/98/68/23/1032986823.db2.gz MNEYZQCZIYGJHM-UHFFFAOYSA-N 2 2 345.365 3.578 20 5 EHBDLP CC(C)(C)[C@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783598630 1027714945 /nfs/dbraw/zinc/71/49/45/1027714945.db2.gz MMXLLPNWDGNMOP-HNNXBMFYSA-N 2 2 336.823 3.649 20 5 EHBDLP C[C@@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000268738974 1028332163 /nfs/dbraw/zinc/33/21/63/1028332163.db2.gz OXPIEQQLWAEQGB-MRXNPFEDSA-N 2 2 339.439 3.910 20 5 EHBDLP CC[NH2+][C@H](C)C[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423390897 1028404997 /nfs/dbraw/zinc/40/49/97/1028404997.db2.gz WLOQRHHONNYCPT-CHWSQXEVSA-N 2 2 333.457 3.972 20 5 EHBDLP Cc1c[nH+]ccc1OC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000447074758 1029922322 /nfs/dbraw/zinc/92/23/22/1029922322.db2.gz CNWPIXYDUCTNKQ-UHFFFAOYSA-N 2 2 341.411 3.650 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000598992026 1033644939 /nfs/dbraw/zinc/64/49/39/1033644939.db2.gz JQPCZTQHQCRJDA-JHTBKMLMSA-N 2 2 329.444 3.605 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H]1CC[N@H+]1C1CCCCC1 ZINC000598992026 1033644949 /nfs/dbraw/zinc/64/49/49/1033644949.db2.gz JQPCZTQHQCRJDA-JHTBKMLMSA-N 2 2 329.444 3.605 20 5 EHBDLP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000599661302 1034091129 /nfs/dbraw/zinc/09/11/29/1034091129.db2.gz SPBGNWAFCVRGIV-UHFFFAOYSA-N 2 2 345.418 3.818 20 5 EHBDLP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000599661302 1034091142 /nfs/dbraw/zinc/09/11/42/1034091142.db2.gz SPBGNWAFCVRGIV-UHFFFAOYSA-N 2 2 345.418 3.818 20 5 EHBDLP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390419 1035434518 /nfs/dbraw/zinc/43/45/18/1035434518.db2.gz XJCHAXOGYFCURI-FGTMMUONSA-N 2 2 329.444 3.534 20 5 EHBDLP CC1(C)C[C@H]([NH2+][C@@H]2CC[N@H+]3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390419 1035434520 /nfs/dbraw/zinc/43/45/20/1035434520.db2.gz XJCHAXOGYFCURI-FGTMMUONSA-N 2 2 329.444 3.534 20 5 EHBDLP C[NH+](C)C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000091670253 1128777359 /nfs/dbraw/zinc/77/73/59/1128777359.db2.gz GWOIXMPWIZYODZ-UHFFFAOYSA-N 2 2 345.468 3.849 20 5 EHBDLP C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000114481255 1129149579 /nfs/dbraw/zinc/14/95/79/1129149579.db2.gz KATFEKYZIGUCFL-UHFFFAOYSA-N 2 2 339.439 3.691 20 5 EHBDLP C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000114481255 1129149581 /nfs/dbraw/zinc/14/95/81/1129149581.db2.gz KATFEKYZIGUCFL-UHFFFAOYSA-N 2 2 339.439 3.691 20 5 EHBDLP CC(C)c1ccc([C@H]([NH3+])C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951843 1136850904 /nfs/dbraw/zinc/85/09/04/1136850904.db2.gz BCKFXLQUZIRPPA-FZKQIMNGSA-N 2 2 342.443 3.651 20 5 EHBDLP [NH3+]C1(C[NH2+]Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 ZINC000904451092 1032059063 /nfs/dbraw/zinc/05/90/63/1032059063.db2.gz VPPPLSRZRDNUFR-UHFFFAOYSA-N 2 2 347.802 3.621 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCNc1cccc[nH+]1 ZINC000468625115 1018498539 /nfs/dbraw/zinc/49/85/39/1018498539.db2.gz KEUYTFKWTKAFCY-SSZFMOIBSA-N 2 2 340.427 3.875 20 5 EHBDLP CCC[C@H]([NH2+]CCc1cn2c([nH+]1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000152784630 1026717851 /nfs/dbraw/zinc/71/78/51/1026717851.db2.gz GIFBWJLVFAOQNE-SFHVURJKSA-N 2 2 342.443 3.801 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000255641277 1129168627 /nfs/dbraw/zinc/16/86/27/1129168627.db2.gz WKYNLOMPHWPJDJ-OPXCAZNSSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000255641277 1129168630 /nfs/dbraw/zinc/16/86/30/1129168630.db2.gz WKYNLOMPHWPJDJ-OPXCAZNSSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000255641277 1129168634 /nfs/dbraw/zinc/16/86/34/1129168634.db2.gz WKYNLOMPHWPJDJ-OPXCAZNSSA-N 2 2 341.455 3.557 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000255641277 1129168638 /nfs/dbraw/zinc/16/86/38/1129168638.db2.gz WKYNLOMPHWPJDJ-OPXCAZNSSA-N 2 2 341.455 3.557 20 5 EHBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096510 1129399748 /nfs/dbraw/zinc/39/97/48/1129399748.db2.gz XUPBLFHDHOYJRW-CRAIPNDOSA-N 2 2 349.475 3.544 20 5 EHBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096510 1129399752 /nfs/dbraw/zinc/39/97/52/1129399752.db2.gz XUPBLFHDHOYJRW-CRAIPNDOSA-N 2 2 349.475 3.544 20 5 EHBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096510 1129399756 /nfs/dbraw/zinc/39/97/56/1129399756.db2.gz XUPBLFHDHOYJRW-CRAIPNDOSA-N 2 2 349.475 3.544 20 5 EHBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096510 1129399760 /nfs/dbraw/zinc/39/97/60/1129399760.db2.gz XUPBLFHDHOYJRW-CRAIPNDOSA-N 2 2 349.475 3.544 20 5 EHBDLP O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCCCn3cc[nH+]c3)o2)c1 ZINC001177442828 1133067254 /nfs/dbraw/zinc/06/72/54/1133067254.db2.gz WFGVSCIDPJKCJT-UHFFFAOYSA-N 2 2 340.383 3.621 20 5 EHBDLP CC(C)(C)[C@H](Cn1cc[nH+]c1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774133925 1133620728 /nfs/dbraw/zinc/62/07/28/1133620728.db2.gz JRHLCGWLNROLLS-MSOLQXFVSA-N 2 2 342.443 3.873 20 5 EHBDLP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000866238594 1137337913 /nfs/dbraw/zinc/33/79/13/1137337913.db2.gz PZLWRYNNLCRIBK-GUYCJALGSA-N 2 2 348.422 3.566 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000093563705 1138238854 /nfs/dbraw/zinc/23/88/54/1138238854.db2.gz IDEGDDWVSWEWHK-KRZKXXONSA-N 2 2 329.444 3.558 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000093563705 1138238855 /nfs/dbraw/zinc/23/88/55/1138238855.db2.gz IDEGDDWVSWEWHK-KRZKXXONSA-N 2 2 329.444 3.558 20 5 EHBDLP C[C@@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414961249 1017361426 /nfs/dbraw/zinc/36/14/26/1017361426.db2.gz VNQUGHPWCOGUIA-WFASDCNBSA-N 2 2 331.441 3.553 20 5 EHBDLP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548010022 1018197966 /nfs/dbraw/zinc/19/79/66/1018197966.db2.gz BSXIIFICMOXOGP-WMLDXEAASA-N 2 2 340.427 3.678 20 5 EHBDLP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548010022 1018197969 /nfs/dbraw/zinc/19/79/69/1018197969.db2.gz BSXIIFICMOXOGP-WMLDXEAASA-N 2 2 340.427 3.678 20 5 EHBDLP CC(C)(C)[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783598631 1027721368 /nfs/dbraw/zinc/72/13/68/1027721368.db2.gz MMXLLPNWDGNMOP-OAHLLOKOSA-N 2 2 336.823 3.649 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000595023878 1033617106 /nfs/dbraw/zinc/61/71/06/1033617106.db2.gz ZDYMKGXOENHQBS-JKSUJKDBSA-N 2 2 349.475 3.622 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000595023878 1033617112 /nfs/dbraw/zinc/61/71/12/1033617112.db2.gz ZDYMKGXOENHQBS-JKSUJKDBSA-N 2 2 349.475 3.622 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599073559 1033713812 /nfs/dbraw/zinc/71/38/12/1033713812.db2.gz KDKIHOYVMLLXSO-CRAIPNDOSA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC000599073559 1033713823 /nfs/dbraw/zinc/71/38/23/1033713823.db2.gz KDKIHOYVMLLXSO-CRAIPNDOSA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-n2cc[nH+]c2)cc1 ZINC000344065279 1043199435 /nfs/dbraw/zinc/19/94/35/1043199435.db2.gz OBJVQTAIQINSQQ-OAHLLOKOSA-N 2 2 336.395 3.674 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000765252146 1127589151 /nfs/dbraw/zinc/58/91/51/1127589151.db2.gz RFQBMHXEUQVFIR-RHSMWYFYSA-N 2 2 330.432 3.865 20 5 EHBDLP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C ZINC000093644279 1138239439 /nfs/dbraw/zinc/23/94/39/1138239439.db2.gz QVJALBYKUFALHM-HUUCEWRRSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000093644279 1138239440 /nfs/dbraw/zinc/23/94/40/1138239440.db2.gz QVJALBYKUFALHM-HUUCEWRRSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[NH+]1C ZINC000093644279 1138239441 /nfs/dbraw/zinc/23/94/41/1138239441.db2.gz QVJALBYKUFALHM-HUUCEWRRSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[NH+]1C ZINC000093644279 1138239442 /nfs/dbraw/zinc/23/94/42/1138239442.db2.gz QVJALBYKUFALHM-HUUCEWRRSA-N 2 2 343.427 3.769 20 5 EHBDLP C[NH2+]CCC[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000415124879 1017586916 /nfs/dbraw/zinc/58/69/16/1017586916.db2.gz CVVPJXUSPSCVGQ-UHFFFAOYSA-N 2 2 347.390 3.568 20 5 EHBDLP C[NH2+]CCC[N@@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000415124879 1017586925 /nfs/dbraw/zinc/58/69/25/1017586925.db2.gz CVVPJXUSPSCVGQ-UHFFFAOYSA-N 2 2 347.390 3.568 20 5 EHBDLP C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548336455 1022376447 /nfs/dbraw/zinc/37/64/47/1022376447.db2.gz JTMBQUVGXPWYQY-LSDHHAIUSA-N 2 2 340.427 3.678 20 5 EHBDLP C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548336455 1022376463 /nfs/dbraw/zinc/37/64/63/1022376463.db2.gz JTMBQUVGXPWYQY-LSDHHAIUSA-N 2 2 340.427 3.678 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC000598998910 1033634381 /nfs/dbraw/zinc/63/43/81/1033634381.db2.gz ZCJFANUGNNSFPZ-FERCGXDMSA-N 2 2 329.444 3.605 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC000598998910 1033634390 /nfs/dbraw/zinc/63/43/90/1033634390.db2.gz ZCJFANUGNNSFPZ-FERCGXDMSA-N 2 2 329.444 3.605 20 5 EHBDLP O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(CCCn2cc[nH+]c2)CC1 ZINC000595425736 1033795272 /nfs/dbraw/zinc/79/52/72/1033795272.db2.gz LYRACRCNKOMOBW-UHFFFAOYSA-N 2 2 346.406 3.623 20 5 EHBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)CCC2 ZINC000378180722 1038149319 /nfs/dbraw/zinc/14/93/19/1038149319.db2.gz AHQOCJHQLSNDQH-HUUCEWRRSA-N 2 2 328.416 3.636 20 5 EHBDLP C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-n2cc[nH+]c2)cc1 ZINC000344065278 1043199530 /nfs/dbraw/zinc/19/95/30/1043199530.db2.gz OBJVQTAIQINSQQ-HNNXBMFYSA-N 2 2 336.395 3.674 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]Cc1ccccc1Cn1cc[nH+]c1 ZINC000338711793 1128733653 /nfs/dbraw/zinc/73/36/53/1128733653.db2.gz BOKOGGWIWFWHEU-UITAMQMPSA-N 2 2 348.406 3.643 20 5 EHBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001173213772 1132014692 /nfs/dbraw/zinc/01/46/92/1132014692.db2.gz KEYXXHCJYUDARP-HNNXBMFYSA-N 2 2 336.395 3.501 20 5 EHBDLP CC[C@@H]([NH3+])C[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414975828 1017369032 /nfs/dbraw/zinc/36/90/32/1017369032.db2.gz HEPHNNCBFMRQKC-CYBMUJFWSA-N 2 2 349.818 3.867 20 5 EHBDLP C[C@@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423178619 1028248420 /nfs/dbraw/zinc/24/84/20/1028248420.db2.gz CEWQDLKJGBPAFE-CHWSQXEVSA-N 2 2 331.441 3.726 20 5 EHBDLP CCc1ccc([C@H]([NH2+][C@@H]2CCC[C@@H]([NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423375034 1028413449 /nfs/dbraw/zinc/41/34/49/1028413449.db2.gz IPIWAEXTGNMUPC-SPYBWZPUSA-N 2 2 343.427 3.699 20 5 EHBDLP Cc1c[nH+]ccc1OC1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000429725055 1030381006 /nfs/dbraw/zinc/38/10/06/1030381006.db2.gz RCGGVOXGIVNJJE-UHFFFAOYSA-N 2 2 341.411 3.650 20 5 EHBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1c[nH+]cc1-c1ccc(C[NH3+])cc1 ZINC001173230657 1132009590 /nfs/dbraw/zinc/00/95/90/1132009590.db2.gz SSMBTKSOMAOPQP-CQSZACIVSA-N 2 2 336.395 3.721 20 5 EHBDLP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@@H+]1C ZINC000130639206 1138466269 /nfs/dbraw/zinc/46/62/69/1138466269.db2.gz ORYPXUNXPRKABX-PBHICJAKSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C ZINC000130639206 1138466271 /nfs/dbraw/zinc/46/62/71/1138466271.db2.gz ORYPXUNXPRKABX-PBHICJAKSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[NH+]1C ZINC000130639206 1138466272 /nfs/dbraw/zinc/46/62/72/1138466272.db2.gz ORYPXUNXPRKABX-PBHICJAKSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[NH+]1C ZINC000130639206 1138466275 /nfs/dbraw/zinc/46/62/75/1138466275.db2.gz ORYPXUNXPRKABX-PBHICJAKSA-N 2 2 343.427 3.769 20 5 EHBDLP O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCc3[nH+]c[nH]c3C2)c2ccccc2)c1 ZINC000377799747 1018393467 /nfs/dbraw/zinc/39/34/67/1018393467.db2.gz YWSRMZCRZGKJLG-OXJNMPFZSA-N 2 2 348.406 3.554 20 5 EHBDLP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595016107 1033610185 /nfs/dbraw/zinc/61/01/85/1033610185.db2.gz QCDDBVVNQWRCLN-AWEZNQCLSA-N 2 2 335.448 3.519 20 5 EHBDLP CCc1ccc([C@@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000596653455 1034330439 /nfs/dbraw/zinc/33/04/39/1034330439.db2.gz KLZFWECNQNNRGW-MJGOQNOKSA-N 2 2 345.443 3.803 20 5 EHBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000532538076 1037565649 /nfs/dbraw/zinc/56/56/49/1037565649.db2.gz XLAUKQLNFHMHDJ-CABCVRRESA-N 2 2 328.416 3.636 20 5 EHBDLP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-n2cc[nH+]c2)cc1 ZINC001173213775 1132015425 /nfs/dbraw/zinc/01/54/25/1132015425.db2.gz KEYXXHCJYUDARP-OAHLLOKOSA-N 2 2 336.395 3.501 20 5 EHBDLP O=[N+]([O-])c1ccc(CC[NH2+]CC[NH+]2CCC3(CCCCC3)CC2)cc1 ZINC001181196433 1133465356 /nfs/dbraw/zinc/46/53/56/1133465356.db2.gz OIVXXOPHFZIYQZ-UHFFFAOYSA-N 2 2 345.487 3.773 20 5 EHBDLP CC(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951847 1136851176 /nfs/dbraw/zinc/85/11/76/1136851176.db2.gz BCKFXLQUZIRPPA-SCLBCKFNSA-N 2 2 342.443 3.651 20 5 EHBDLP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279948 1016849106 /nfs/dbraw/zinc/84/91/06/1016849106.db2.gz RQJIRDKWDPAXNH-IEBWSBKVSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@H+]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279948 1016849116 /nfs/dbraw/zinc/84/91/16/1016849116.db2.gz RQJIRDKWDPAXNH-IEBWSBKVSA-N 2 2 325.412 3.520 20 5 EHBDLP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000237675199 1036852447 /nfs/dbraw/zinc/85/24/47/1036852447.db2.gz VBXYIYBWMWBLBH-CYBMUJFWSA-N 2 2 325.840 3.602 20 5 EHBDLP C[C@@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000237675199 1036852471 /nfs/dbraw/zinc/85/24/71/1036852471.db2.gz VBXYIYBWMWBLBH-CYBMUJFWSA-N 2 2 325.840 3.602 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1[N+](=O)[O-] ZINC000093597657 1129595459 /nfs/dbraw/zinc/59/54/59/1129595459.db2.gz KFJUTCWZINSJEH-KRWDZBQOSA-N 2 2 331.460 3.636 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1[N+](=O)[O-] ZINC000093597657 1129595462 /nfs/dbraw/zinc/59/54/62/1129595462.db2.gz KFJUTCWZINSJEH-KRWDZBQOSA-N 2 2 331.460 3.636 20 5 EHBDLP Cc1cc(N[C@H]2CCN(c3cccc[nH+]3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302092074 1129767650 /nfs/dbraw/zinc/76/76/50/1129767650.db2.gz QAAYOFWGKYLXGO-AWEZNQCLSA-N 2 2 349.394 3.537 20 5 EHBDLP Cc1cc(NCCc2cn3ccccc3[nH+]2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302183791 1129771730 /nfs/dbraw/zinc/77/17/30/1129771730.db2.gz OPKPKIRTKGAURN-UHFFFAOYSA-N 2 2 347.378 3.754 20 5 EHBDLP CC[C@@H]([NH2+]CCCCNc1cccc[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000162899138 1129911062 /nfs/dbraw/zinc/91/10/62/1129911062.db2.gz RJEIKEOGVMMPND-QGZVFWFLSA-N 2 2 328.416 3.923 20 5 EHBDLP C[C@H](C[NH+]1CCC(C)CC1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913494 1131919093 /nfs/dbraw/zinc/91/90/93/1131919093.db2.gz WJEOTRIREBCRGR-APWZRJJASA-N 2 2 345.487 3.552 20 5 EHBDLP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCCNc1cccc[nH+]1 ZINC000866255898 1137339977 /nfs/dbraw/zinc/33/99/77/1137339977.db2.gz DDNCMLCZHFASSQ-CQSZACIVSA-N 2 2 346.406 3.542 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000872024722 1137565628 /nfs/dbraw/zinc/56/56/28/1137565628.db2.gz DMSVBAHCYGUJDE-IHRRRGAJSA-N 2 2 335.473 3.594 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000872024722 1137565629 /nfs/dbraw/zinc/56/56/29/1137565629.db2.gz DMSVBAHCYGUJDE-IHRRRGAJSA-N 2 2 335.473 3.594 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H](Cn1cc[nH+]c1)c1ccccc1 ZINC000883387723 1137859120 /nfs/dbraw/zinc/85/91/20/1137859120.db2.gz CUTYDKJKPWUWIJ-RBUKOAKNSA-N 2 2 348.406 3.810 20 5 EHBDLP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000269111780 1141067726 /nfs/dbraw/zinc/06/77/26/1141067726.db2.gz XWHZYXGWXCPAJD-UHFFFAOYSA-N 2 2 325.840 3.553 20 5 EHBDLP CC(C)[NH+]1CCC([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000269111780 1141067734 /nfs/dbraw/zinc/06/77/34/1141067734.db2.gz XWHZYXGWXCPAJD-UHFFFAOYSA-N 2 2 325.840 3.553 20 5 EHBDLP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279940 1016849927 /nfs/dbraw/zinc/84/99/27/1016849927.db2.gz RQJIRDKWDPAXNH-HKUYNNGSSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279940 1016849937 /nfs/dbraw/zinc/84/99/37/1016849937.db2.gz RQJIRDKWDPAXNH-HKUYNNGSSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@@H+]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000340283534 1016858284 /nfs/dbraw/zinc/85/82/84/1016858284.db2.gz YTWMDWGSDRCURK-HKUYNNGSSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@H+]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000340283534 1016858298 /nfs/dbraw/zinc/85/82/98/1016858298.db2.gz YTWMDWGSDRCURK-HKUYNNGSSA-N 2 2 325.412 3.520 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(Cn2cc[nH+]c2)cc1 ZINC000521460596 1025397617 /nfs/dbraw/zinc/39/76/17/1025397617.db2.gz GJJMWARHYMZHKT-IBGZPJMESA-N 2 2 348.406 3.617 20 5 EHBDLP C[C@@H]([NH3+])[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077307 1025497391 /nfs/dbraw/zinc/49/73/91/1025497391.db2.gz VKAZDDPBVQESRX-DYVFJYSZSA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@@H]([NH3+])[C@@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077307 1025497402 /nfs/dbraw/zinc/49/74/02/1025497402.db2.gz VKAZDDPBVQESRX-DYVFJYSZSA-N 2 2 329.400 3.557 20 5 EHBDLP Cc1c(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000237801591 1027705806 /nfs/dbraw/zinc/70/58/06/1027705806.db2.gz KQRINANKLQOLIS-UHFFFAOYSA-N 2 2 339.439 3.657 20 5 EHBDLP CCc1ccc([C@H]([NH2+]CC[C@@H]([NH3+])C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000596653452 1034329423 /nfs/dbraw/zinc/32/94/23/1034329423.db2.gz KLZFWECNQNNRGW-IEBWSBKVSA-N 2 2 345.443 3.803 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1-n1cc[nH+]c1 ZINC000152241799 1036204507 /nfs/dbraw/zinc/20/45/07/1036204507.db2.gz LPWIBCFNBDYASN-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000539531022 1036887775 /nfs/dbraw/zinc/88/77/75/1036887775.db2.gz OYEIKQQHERQRTO-HUUCEWRRSA-N 2 2 325.478 3.647 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CC[N@@H+](C2CCCC2)C1)C1CC1 ZINC000153682499 1121581766 /nfs/dbraw/zinc/58/17/66/1121581766.db2.gz OPGAJSYCQGAFOS-PKOBYXMFSA-N 2 2 343.471 3.522 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CC[N@H+](C2CCCC2)C1)C1CC1 ZINC000153682499 1121581769 /nfs/dbraw/zinc/58/17/69/1121581769.db2.gz OPGAJSYCQGAFOS-PKOBYXMFSA-N 2 2 343.471 3.522 20 5 EHBDLP CC(C)(C)C[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903025 1131885457 /nfs/dbraw/zinc/88/54/57/1131885457.db2.gz DCOFKCSMMRVBIO-ROUUACIJSA-N 2 2 345.487 3.552 20 5 EHBDLP CC(C)(C)C[N@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903025 1131885467 /nfs/dbraw/zinc/88/54/67/1131885467.db2.gz DCOFKCSMMRVBIO-ROUUACIJSA-N 2 2 345.487 3.552 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000850424805 1136256590 /nfs/dbraw/zinc/25/65/90/1136256590.db2.gz HMQWRFRQCMUZLW-CXAGYDPISA-N 2 2 346.431 3.565 20 5 EHBDLP C[C@@H]([NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872023185 1137565344 /nfs/dbraw/zinc/56/53/44/1137565344.db2.gz CZOGVNCIGOVAAH-DOMZBBRYSA-N 2 2 334.395 3.696 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425503 1032812477 /nfs/dbraw/zinc/81/24/77/1032812477.db2.gz HBDGRRYFCBHDGL-SJLPKXTDSA-N 2 2 331.460 3.682 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425503 1032812494 /nfs/dbraw/zinc/81/24/94/1032812494.db2.gz HBDGRRYFCBHDGL-SJLPKXTDSA-N 2 2 331.460 3.682 20 5 EHBDLP CCOc1ccc([C@@H](C)[NH2+][C@@H](C[NH3+])C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263495 1028301421 /nfs/dbraw/zinc/30/14/21/1028301421.db2.gz ONIYCTQSCNLKDS-CJNGLKHVSA-N 2 2 335.448 3.552 20 5 EHBDLP C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCC(C)CC1 ZINC000481971124 1030141175 /nfs/dbraw/zinc/14/11/75/1030141175.db2.gz FZJNZOJECPVUPP-VQIMIIECSA-N 2 2 345.487 3.626 20 5 EHBDLP O=[N+]([O-])c1cccc([C@@H]([NH2+]CCC[NH+]2CCCC2)c2ccccc2)c1 ZINC000180017258 1035193537 /nfs/dbraw/zinc/19/35/37/1035193537.db2.gz NYKVTYUEDHFRPR-FQEVSTJZSA-N 2 2 339.439 3.760 20 5 EHBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000532538077 1037566602 /nfs/dbraw/zinc/56/66/02/1037566602.db2.gz XLAUKQLNFHMHDJ-GJZGRUSLSA-N 2 2 328.416 3.636 20 5 EHBDLP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721973 1038490979 /nfs/dbraw/zinc/49/09/79/1038490979.db2.gz QIJMBFDBRUZRJO-KRWDZBQOSA-N 2 2 333.476 3.882 20 5 EHBDLP CCC[N@@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721973 1038490981 /nfs/dbraw/zinc/49/09/81/1038490981.db2.gz QIJMBFDBRUZRJO-KRWDZBQOSA-N 2 2 333.476 3.882 20 5 EHBDLP CCC[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721973 1038490983 /nfs/dbraw/zinc/49/09/83/1038490983.db2.gz QIJMBFDBRUZRJO-KRWDZBQOSA-N 2 2 333.476 3.882 20 5 EHBDLP CCC[NH+](C)C[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721973 1038490989 /nfs/dbraw/zinc/49/09/89/1038490989.db2.gz QIJMBFDBRUZRJO-KRWDZBQOSA-N 2 2 333.476 3.882 20 5 EHBDLP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721974 1038491107 /nfs/dbraw/zinc/49/11/07/1038491107.db2.gz QIJMBFDBRUZRJO-QGZVFWFLSA-N 2 2 333.476 3.882 20 5 EHBDLP CCC[N@@H+](C)C[C@H]1CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721974 1038491110 /nfs/dbraw/zinc/49/11/10/1038491110.db2.gz QIJMBFDBRUZRJO-QGZVFWFLSA-N 2 2 333.476 3.882 20 5 EHBDLP CCC[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721974 1038491113 /nfs/dbraw/zinc/49/11/13/1038491113.db2.gz QIJMBFDBRUZRJO-QGZVFWFLSA-N 2 2 333.476 3.882 20 5 EHBDLP CCC[NH+](C)C[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721974 1038491118 /nfs/dbraw/zinc/49/11/18/1038491118.db2.gz QIJMBFDBRUZRJO-QGZVFWFLSA-N 2 2 333.476 3.882 20 5 EHBDLP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCCNc1cccc[nH+]1)CCC2 ZINC000192812499 1039030570 /nfs/dbraw/zinc/03/05/70/1039030570.db2.gz OWLRLZGOJFCMJZ-GOSISDBHSA-N 2 2 340.427 3.849 20 5 EHBDLP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000512170713 1043580245 /nfs/dbraw/zinc/58/02/45/1043580245.db2.gz UFVVWLHTVIXYCM-GOSISDBHSA-N 2 2 331.460 3.539 20 5 EHBDLP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000512170713 1043580252 /nfs/dbraw/zinc/58/02/52/1043580252.db2.gz UFVVWLHTVIXYCM-GOSISDBHSA-N 2 2 331.460 3.539 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(-n2cc[nH+]c2)cc1 ZINC000765357700 1127601056 /nfs/dbraw/zinc/60/10/56/1127601056.db2.gz CEGHVNWIDSGYDN-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)cs1 ZINC000282180656 1128037283 /nfs/dbraw/zinc/03/72/83/1128037283.db2.gz VTYMTMUMFTVEAU-CQSZACIVSA-N 2 2 346.456 3.569 20 5 EHBDLP O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)cs1 ZINC000282180656 1128037288 /nfs/dbraw/zinc/03/72/88/1128037288.db2.gz VTYMTMUMFTVEAU-CQSZACIVSA-N 2 2 346.456 3.569 20 5 EHBDLP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000340283536 1016859233 /nfs/dbraw/zinc/85/92/33/1016859233.db2.gz YTWMDWGSDRCURK-MJGOQNOKSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@H+]1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000340283536 1016859252 /nfs/dbraw/zinc/85/92/52/1016859252.db2.gz YTWMDWGSDRCURK-MJGOQNOKSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703464 1018569678 /nfs/dbraw/zinc/56/96/78/1018569678.db2.gz AVXHJTUINJHSDS-AWEZNQCLSA-N 2 2 325.840 3.554 20 5 EHBDLP C[N@@H+](CC[C@@H]1CCCC[NH+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703464 1018569687 /nfs/dbraw/zinc/56/96/87/1018569687.db2.gz AVXHJTUINJHSDS-AWEZNQCLSA-N 2 2 325.840 3.554 20 5 EHBDLP C[NH+](CC[C@@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703464 1018569697 /nfs/dbraw/zinc/56/96/97/1018569697.db2.gz AVXHJTUINJHSDS-AWEZNQCLSA-N 2 2 325.840 3.554 20 5 EHBDLP C[NH+](CC[C@@H]1CCCC[N@H+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703464 1018569703 /nfs/dbraw/zinc/56/97/03/1018569703.db2.gz AVXHJTUINJHSDS-AWEZNQCLSA-N 2 2 325.840 3.554 20 5 EHBDLP C[N@H+](Cc1ccccc1)CC(C)(C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000379660977 1019052185 /nfs/dbraw/zinc/05/21/85/1019052185.db2.gz BBNHRURAZHLBAC-UHFFFAOYSA-N 2 2 341.455 3.638 20 5 EHBDLP C[N@@H+](Cc1ccccc1)CC(C)(C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000379660977 1019052200 /nfs/dbraw/zinc/05/22/00/1019052200.db2.gz BBNHRURAZHLBAC-UHFFFAOYSA-N 2 2 341.455 3.638 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425504 1032811744 /nfs/dbraw/zinc/81/17/44/1032811744.db2.gz HBDGRRYFCBHDGL-WMZOPIPTSA-N 2 2 331.460 3.682 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425504 1032811760 /nfs/dbraw/zinc/81/17/60/1032811760.db2.gz HBDGRRYFCBHDGL-WMZOPIPTSA-N 2 2 331.460 3.682 20 5 EHBDLP C[C@@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423178620 1028246717 /nfs/dbraw/zinc/24/67/17/1028246717.db2.gz CEWQDLKJGBPAFE-OLZOCXBDSA-N 2 2 331.441 3.726 20 5 EHBDLP C[C@]1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC[NH2+]C1 ZINC000423338928 1028372121 /nfs/dbraw/zinc/37/21/21/1028372121.db2.gz LFFWKPYINQUKJN-PMACEKPBSA-N 2 2 339.439 3.664 20 5 EHBDLP O=[N+]([O-])c1cccc([C@H]([NH2+]CCC[NH+]2CCCC2)c2ccccc2)c1 ZINC000180017274 1035193733 /nfs/dbraw/zinc/19/37/33/1035193733.db2.gz NYKVTYUEDHFRPR-HXUWFJFHSA-N 2 2 339.439 3.760 20 5 EHBDLP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180155431 1035920453 /nfs/dbraw/zinc/92/04/53/1035920453.db2.gz FJFVBIMQLOFCHF-JXFKEZNVSA-N 2 2 339.439 3.616 20 5 EHBDLP CC[N@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180155431 1035920462 /nfs/dbraw/zinc/92/04/62/1035920462.db2.gz FJFVBIMQLOFCHF-JXFKEZNVSA-N 2 2 339.439 3.616 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000765252148 1127589266 /nfs/dbraw/zinc/58/92/66/1127589266.db2.gz RFQBMHXEUQVFIR-WMLDXEAASA-N 2 2 330.432 3.865 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000765252150 1127589272 /nfs/dbraw/zinc/58/92/72/1127589272.db2.gz RFQBMHXEUQVFIR-YOEHRIQHSA-N 2 2 330.432 3.865 20 5 EHBDLP C[C@@H]([NH2+]Cc1ccc(Cn2cc[nH+]c2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173316607 1130205310 /nfs/dbraw/zinc/20/53/10/1130205310.db2.gz YJUXMNCGNUFARK-OAHLLOKOSA-N 2 2 336.395 3.690 20 5 EHBDLP Cc1[nH]c(C2CC[NH+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000886659477 1138109871 /nfs/dbraw/zinc/10/98/71/1138109871.db2.gz NJPKUZUAFUPNJC-UHFFFAOYSA-N 2 2 348.834 3.968 20 5 EHBDLP CC1(C)[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000415030530 1017429509 /nfs/dbraw/zinc/42/95/09/1017429509.db2.gz COXYKCGXUIHCRH-INIZCTEOSA-N 2 2 331.441 3.553 20 5 EHBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCn3cc[nH+]c3)s2)cc1 ZINC000102419170 1018524409 /nfs/dbraw/zinc/52/44/09/1018524409.db2.gz RDXSIMCJLQSGHC-UHFFFAOYSA-N 2 2 342.424 3.700 20 5 EHBDLP CC1(C)C[C@H]([NH2+][C@H]2CC[N@@H+]3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390418 1019258607 /nfs/dbraw/zinc/25/86/07/1019258607.db2.gz XJCHAXOGYFCURI-BZSNNMDCSA-N 2 2 329.444 3.534 20 5 EHBDLP CC1(C)C[C@H]([NH2+][C@H]2CC[N@H+]3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390418 1019258610 /nfs/dbraw/zinc/25/86/10/1019258610.db2.gz XJCHAXOGYFCURI-BZSNNMDCSA-N 2 2 329.444 3.534 20 5 EHBDLP O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c1 ZINC000281881085 1025633370 /nfs/dbraw/zinc/63/33/70/1025633370.db2.gz AJDVYKRUQGYTBW-INIZCTEOSA-N 2 2 340.427 3.507 20 5 EHBDLP O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c1 ZINC000281881085 1025633391 /nfs/dbraw/zinc/63/33/91/1025633391.db2.gz AJDVYKRUQGYTBW-INIZCTEOSA-N 2 2 340.427 3.507 20 5 EHBDLP Cc1ccc([C@@H](C)[NH2+]C2CCN(c3cccc[nH+]3)CC2)cc1[N+](=O)[O-] ZINC000121344420 1027212187 /nfs/dbraw/zinc/21/21/87/1027212187.db2.gz MYITZVFQDUVVPG-OAHLLOKOSA-N 2 2 340.427 3.618 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]([NH3+])c1ccccc1 ZINC000423231336 1028296152 /nfs/dbraw/zinc/29/61/52/1028296152.db2.gz ATJJXOJRWLWFCJ-CVEARBPZSA-N 2 2 345.468 3.755 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000595023876 1033615724 /nfs/dbraw/zinc/61/57/24/1033615724.db2.gz ZDYMKGXOENHQBS-HZPDHXFCSA-N 2 2 349.475 3.622 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000595023876 1033615736 /nfs/dbraw/zinc/61/57/36/1033615736.db2.gz ZDYMKGXOENHQBS-HZPDHXFCSA-N 2 2 349.475 3.622 20 5 EHBDLP C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110237 1037322651 /nfs/dbraw/zinc/32/26/51/1037322651.db2.gz QCZWISMDYHIKNP-SFHVURJKSA-N 2 2 339.439 3.549 20 5 EHBDLP C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076110237 1037322670 /nfs/dbraw/zinc/32/26/70/1037322670.db2.gz QCZWISMDYHIKNP-SFHVURJKSA-N 2 2 339.439 3.549 20 5 EHBDLP C[NH+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076110237 1037322690 /nfs/dbraw/zinc/32/26/90/1037322690.db2.gz QCZWISMDYHIKNP-SFHVURJKSA-N 2 2 339.439 3.549 20 5 EHBDLP C[NH+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000076110237 1037322709 /nfs/dbraw/zinc/32/27/09/1037322709.db2.gz QCZWISMDYHIKNP-SFHVURJKSA-N 2 2 339.439 3.549 20 5 EHBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)CCC2 ZINC000378180723 1038149963 /nfs/dbraw/zinc/14/99/63/1038149963.db2.gz AHQOCJHQLSNDQH-LSDHHAIUSA-N 2 2 328.416 3.636 20 5 EHBDLP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCCNc1cccc[nH+]1)CCC2 ZINC000192812515 1039031248 /nfs/dbraw/zinc/03/12/48/1039031248.db2.gz OWLRLZGOJFCMJZ-SFHVURJKSA-N 2 2 340.427 3.849 20 5 EHBDLP C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000480613162 1039755430 /nfs/dbraw/zinc/75/54/30/1039755430.db2.gz MMCWZXDCVREWJW-GJYPPUQNSA-N 2 2 345.487 3.626 20 5 EHBDLP C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000480613162 1039755451 /nfs/dbraw/zinc/75/54/51/1039755451.db2.gz MMCWZXDCVREWJW-GJYPPUQNSA-N 2 2 345.487 3.626 20 5 EHBDLP C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@@H+]1CCC[C@@H](C)C1 ZINC000480613164 1039756460 /nfs/dbraw/zinc/75/64/60/1039756460.db2.gz MMCWZXDCVREWJW-GPMSIDNRSA-N 2 2 345.487 3.626 20 5 EHBDLP C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCC[C@@H](C)C1 ZINC000480613164 1039756483 /nfs/dbraw/zinc/75/64/83/1039756483.db2.gz MMCWZXDCVREWJW-GPMSIDNRSA-N 2 2 345.487 3.626 20 5 EHBDLP O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000491059242 1040896614 /nfs/dbraw/zinc/89/66/14/1040896614.db2.gz RYJXJSZQTRMDQP-SFHVURJKSA-N 2 2 331.460 3.683 20 5 EHBDLP O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000491059242 1040896627 /nfs/dbraw/zinc/89/66/27/1040896627.db2.gz RYJXJSZQTRMDQP-SFHVURJKSA-N 2 2 331.460 3.683 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCn2cc(C)[nH+]c21 ZINC000344857149 1044526464 /nfs/dbraw/zinc/52/64/64/1044526464.db2.gz LQMJXTKGTXCPDI-CRPZLVSXSA-N 2 2 340.427 3.670 20 5 EHBDLP C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272245303 1121128227 /nfs/dbraw/zinc/12/82/27/1121128227.db2.gz XDIIOAJLVWRAAS-WMLDXEAASA-N 2 2 345.468 3.657 20 5 EHBDLP C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000272245303 1121128232 /nfs/dbraw/zinc/12/82/32/1121128232.db2.gz XDIIOAJLVWRAAS-WMLDXEAASA-N 2 2 345.468 3.657 20 5 EHBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096508 1129399879 /nfs/dbraw/zinc/39/98/79/1129399879.db2.gz XUPBLFHDHOYJRW-QAPCUYQASA-N 2 2 349.475 3.544 20 5 EHBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096508 1129399882 /nfs/dbraw/zinc/39/98/82/1129399882.db2.gz XUPBLFHDHOYJRW-QAPCUYQASA-N 2 2 349.475 3.544 20 5 EHBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096508 1129399885 /nfs/dbraw/zinc/39/98/85/1129399885.db2.gz XUPBLFHDHOYJRW-QAPCUYQASA-N 2 2 349.475 3.544 20 5 EHBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096508 1129399888 /nfs/dbraw/zinc/39/98/88/1129399888.db2.gz XUPBLFHDHOYJRW-QAPCUYQASA-N 2 2 349.475 3.544 20 5 EHBDLP C[C@@H]([NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872023186 1137565458 /nfs/dbraw/zinc/56/54/58/1137565458.db2.gz CZOGVNCIGOVAAH-IUODEOHRSA-N 2 2 334.395 3.696 20 5 EHBDLP CCc1ccccc1[C@H]([NH3+])C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415070021 1017502202 /nfs/dbraw/zinc/50/22/02/1017502202.db2.gz UEUAZGFSCJSEAB-DNVCBOLYSA-N 2 2 341.455 3.768 20 5 EHBDLP Cc1c(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475454 1023246846 /nfs/dbraw/zinc/24/68/46/1023246846.db2.gz XAKNSKZHOLWYIM-SJLPKXTDSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475454 1023246855 /nfs/dbraw/zinc/24/68/55/1023246855.db2.gz XAKNSKZHOLWYIM-SJLPKXTDSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475454 1023246870 /nfs/dbraw/zinc/24/68/70/1023246870.db2.gz XAKNSKZHOLWYIM-SJLPKXTDSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475454 1023246882 /nfs/dbraw/zinc/24/68/82/1023246882.db2.gz XAKNSKZHOLWYIM-SJLPKXTDSA-N 2 2 345.487 3.990 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000504900448 1029027118 /nfs/dbraw/zinc/02/71/18/1029027118.db2.gz YDVQJCLQMRLQPN-PMPSAXMXSA-N 2 2 349.500 3.682 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000504900448 1029027131 /nfs/dbraw/zinc/02/71/31/1029027131.db2.gz YDVQJCLQMRLQPN-PMPSAXMXSA-N 2 2 349.500 3.682 20 5 EHBDLP Cc1c([C@H](C)[NH2+]Cc2ccccc2-n2cc[nH+]c2)cccc1[N+](=O)[O-] ZINC000152241973 1029833745 /nfs/dbraw/zinc/83/37/45/1029833745.db2.gz VFNZTLKEVVUTHF-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594520387 1033429216 /nfs/dbraw/zinc/42/92/16/1033429216.db2.gz OCCPLGCGJVBRNV-AYBZRNKSSA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594520387 1033429224 /nfs/dbraw/zinc/42/92/24/1033429224.db2.gz OCCPLGCGJVBRNV-AYBZRNKSSA-N 2 2 331.460 3.522 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCCCNc1cccc[nH+]1 ZINC000595040892 1033660581 /nfs/dbraw/zinc/66/05/81/1033660581.db2.gz PKFUEUXXZDMLKC-AWEZNQCLSA-N 2 2 344.415 3.541 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491057613 1040896439 /nfs/dbraw/zinc/89/64/39/1040896439.db2.gz DTARVUOLCHBQOH-QGZVFWFLSA-N 2 2 331.460 3.683 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491057613 1040896455 /nfs/dbraw/zinc/89/64/55/1040896455.db2.gz DTARVUOLCHBQOH-QGZVFWFLSA-N 2 2 331.460 3.683 20 5 EHBDLP O=[N+]([O-])c1cccc(C[NH+]2CCC(c3[nH+]cc4n3CCCC4)CC2)c1 ZINC000278888564 1042841743 /nfs/dbraw/zinc/84/17/43/1042841743.db2.gz NYSHXAPOMYWOCY-UHFFFAOYSA-N 2 2 340.427 3.507 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000872018664 1137564965 /nfs/dbraw/zinc/56/49/65/1137564965.db2.gz OGQFIDCFFDMDCM-GFCCVEGCSA-N 2 2 335.473 3.594 20 5 EHBDLP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190852 1018988901 /nfs/dbraw/zinc/98/89/01/1018988901.db2.gz MNHFIYNNJLNKRB-QFBILLFUSA-N 2 2 339.439 3.595 20 5 EHBDLP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190852 1018988910 /nfs/dbraw/zinc/98/89/10/1018988910.db2.gz MNHFIYNNJLNKRB-QFBILLFUSA-N 2 2 339.439 3.595 20 5 EHBDLP C[C@]1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC[NH2+]C1 ZINC000423338929 1028373967 /nfs/dbraw/zinc/37/39/67/1028373967.db2.gz LFFWKPYINQUKJN-UXHICEINSA-N 2 2 339.439 3.664 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000598998913 1033635229 /nfs/dbraw/zinc/63/52/29/1033635229.db2.gz ZCJFANUGNNSFPZ-LSSBLYJVSA-N 2 2 329.444 3.605 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000598998913 1033635241 /nfs/dbraw/zinc/63/52/41/1033635241.db2.gz ZCJFANUGNNSFPZ-LSSBLYJVSA-N 2 2 329.444 3.605 20 5 EHBDLP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000237505955 1034853326 /nfs/dbraw/zinc/85/33/26/1034853326.db2.gz VBXYIYBWMWBLBH-ZDUSSCGKSA-N 2 2 325.840 3.602 20 5 EHBDLP C[C@H]1CCCC[N@H+]1CCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000237505955 1034853333 /nfs/dbraw/zinc/85/33/33/1034853333.db2.gz VBXYIYBWMWBLBH-ZDUSSCGKSA-N 2 2 325.840 3.602 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC([NH+]2CCCC2)CC1 ZINC000470174504 1038468629 /nfs/dbraw/zinc/46/86/29/1038468629.db2.gz LKOIBKHNXXCDEU-DTQAZKPQSA-N 2 2 329.444 3.558 20 5 EHBDLP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180507344 1124019354 /nfs/dbraw/zinc/01/93/54/1124019354.db2.gz QFCLJLXJDVBIHZ-UZLBHIALSA-N 2 2 339.439 3.616 20 5 EHBDLP C[N@H+]1CCC[C@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180507344 1124019359 /nfs/dbraw/zinc/01/93/59/1124019359.db2.gz QFCLJLXJDVBIHZ-UZLBHIALSA-N 2 2 339.439 3.616 20 5 EHBDLP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000768214969 1133113572 /nfs/dbraw/zinc/11/35/72/1133113572.db2.gz KFOVVESDAZPOGS-UHFFFAOYSA-N 2 2 347.846 3.942 20 5 EHBDLP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000768214969 1133113576 /nfs/dbraw/zinc/11/35/76/1133113576.db2.gz KFOVVESDAZPOGS-UHFFFAOYSA-N 2 2 347.846 3.942 20 5 EHBDLP CC[N@@H+](CCC[NH+]1CCCC1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809750194 1135885807 /nfs/dbraw/zinc/88/58/07/1135885807.db2.gz QNZQQYKPPCMIPV-UHFFFAOYSA-N 2 2 325.840 3.556 20 5 EHBDLP CC[N@H+](CCC[NH+]1CCCC1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809750194 1135885804 /nfs/dbraw/zinc/88/58/04/1135885804.db2.gz QNZQQYKPPCMIPV-UHFFFAOYSA-N 2 2 325.840 3.556 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000811474567 1136096468 /nfs/dbraw/zinc/09/64/68/1136096468.db2.gz LVQMHQZRVZDYEH-STQMWFEESA-N 2 2 344.242 3.618 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000811474567 1136096470 /nfs/dbraw/zinc/09/64/70/1136096470.db2.gz LVQMHQZRVZDYEH-STQMWFEESA-N 2 2 344.242 3.618 20 5 EHBDLP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476038 1136096556 /nfs/dbraw/zinc/09/65/56/1136096556.db2.gz WKFSFKPNLSHIIS-LLVKDONJSA-N 2 2 346.258 3.723 20 5 EHBDLP CCC[N@H+]1CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476038 1136096560 /nfs/dbraw/zinc/09/65/60/1136096560.db2.gz WKFSFKPNLSHIIS-LLVKDONJSA-N 2 2 346.258 3.723 20 5 EHBDLP CC(C)[C@@H]([NH3+])C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414805411 1017207584 /nfs/dbraw/zinc/20/75/84/1017207584.db2.gz YKQKDGFMPIDYBT-HNNXBMFYSA-N 2 2 337.807 3.581 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1[N+](=O)[O-] ZINC000092072746 1032763579 /nfs/dbraw/zinc/76/35/79/1032763579.db2.gz KEAMYLBHTGPGTP-HNNXBMFYSA-N 2 2 328.416 3.821 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CCC[C@H](c3[nH]cc[nH+]3)C2)cc1[N+](=O)[O-] ZINC000092072746 1032763592 /nfs/dbraw/zinc/76/35/92/1032763592.db2.gz KEAMYLBHTGPGTP-HNNXBMFYSA-N 2 2 328.416 3.821 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000595032287 1033652445 /nfs/dbraw/zinc/65/24/45/1033652445.db2.gz MCIYFACWUPUEPL-CABCVRRESA-N 2 2 335.448 3.519 20 5 EHBDLP C[C@H]([NH2+]C1CC[NH+](Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000122129240 1035594660 /nfs/dbraw/zinc/59/46/60/1035594660.db2.gz OKVNABLJFOSDOT-INIZCTEOSA-N 2 2 339.439 3.910 20 5 EHBDLP Cc1c(C[NH2+][C@@H](C)c2cccc(-n3cc[nH+]c3)c2)cccc1[N+](=O)[O-] ZINC000180645838 1037036022 /nfs/dbraw/zinc/03/60/22/1037036022.db2.gz HHVWGSZXOVECPZ-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555298 1133155634 /nfs/dbraw/zinc/15/56/34/1133155634.db2.gz PTUBEMVHGYPQCN-TZMCWYRMSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[N@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555298 1133155636 /nfs/dbraw/zinc/15/56/36/1133155636.db2.gz PTUBEMVHGYPQCN-TZMCWYRMSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[NH+]1CC[C@@H]([N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555298 1133155639 /nfs/dbraw/zinc/15/56/39/1133155639.db2.gz PTUBEMVHGYPQCN-TZMCWYRMSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[NH+]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555298 1133155642 /nfs/dbraw/zinc/15/56/42/1133155642.db2.gz PTUBEMVHGYPQCN-TZMCWYRMSA-N 2 2 325.840 3.553 20 5 EHBDLP C[NH+](C)CC1CC[NH+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809936088 1135902378 /nfs/dbraw/zinc/90/23/78/1135902378.db2.gz QRLPZJLKEVXVPY-UHFFFAOYSA-N 2 2 346.258 3.675 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000850424808 1136256543 /nfs/dbraw/zinc/25/65/43/1136256543.db2.gz HMQWRFRQCMUZLW-SUMWQHHRSA-N 2 2 346.431 3.565 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000872069474 1137569456 /nfs/dbraw/zinc/56/94/56/1137569456.db2.gz QADFZBFWZUHFSL-VQCLRJIVSA-N 2 2 349.500 3.984 20 5 EHBDLP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@@H+]1C ZINC000130655966 1138467473 /nfs/dbraw/zinc/46/74/73/1138467473.db2.gz LBYVWKSJWUEBNM-GOEBONIOSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@H+]1C ZINC000130655966 1138467475 /nfs/dbraw/zinc/46/74/75/1138467475.db2.gz LBYVWKSJWUEBNM-GOEBONIOSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@H]([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[NH+]1C ZINC000130655966 1138467477 /nfs/dbraw/zinc/46/74/77/1138467477.db2.gz LBYVWKSJWUEBNM-GOEBONIOSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[NH+]1C ZINC000130655966 1138467479 /nfs/dbraw/zinc/46/74/79/1138467479.db2.gz LBYVWKSJWUEBNM-GOEBONIOSA-N 2 2 343.427 3.769 20 5 EHBDLP CC[C@H]([NH3+])C[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414975830 1017368886 /nfs/dbraw/zinc/36/88/86/1017368886.db2.gz HEPHNNCBFMRQKC-ZDUSSCGKSA-N 2 2 349.818 3.867 20 5 EHBDLP C[C@@H]([NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[C@H](C)[NH3+] ZINC000415014164 1017408642 /nfs/dbraw/zinc/40/86/42/1017408642.db2.gz LOHVRPDQLHDFHK-NWDGAFQWSA-N 2 2 349.818 3.866 20 5 EHBDLP C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548010020 1018198256 /nfs/dbraw/zinc/19/82/56/1018198256.db2.gz BSXIIFICMOXOGP-PBHICJAKSA-N 2 2 340.427 3.678 20 5 EHBDLP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548010020 1018198268 /nfs/dbraw/zinc/19/82/68/1018198268.db2.gz BSXIIFICMOXOGP-PBHICJAKSA-N 2 2 340.427 3.678 20 5 EHBDLP CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC[N@H+](C)C1CCCCC1 ZINC000509601217 1021546778 /nfs/dbraw/zinc/54/67/78/1021546778.db2.gz OGDPMSLDZRSQBT-UHFFFAOYSA-N 2 2 349.475 3.738 20 5 EHBDLP CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC000509601217 1021546785 /nfs/dbraw/zinc/54/67/85/1021546785.db2.gz OGDPMSLDZRSQBT-UHFFFAOYSA-N 2 2 349.475 3.738 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2[nH]cc[nH+]2)CC1 ZINC000347355958 1025700346 /nfs/dbraw/zinc/70/03/46/1025700346.db2.gz JUXCZMKUAAHYHB-KAMYIIQDSA-N 2 2 326.400 3.601 20 5 EHBDLP Cc1ccc(C[NH+]2CCC(Oc3cc[nH+]cc3C)CC2)cc1[N+](=O)[O-] ZINC000447100155 1029937758 /nfs/dbraw/zinc/93/77/58/1029937758.db2.gz TWXZMUVTVRXAFL-UHFFFAOYSA-N 2 2 341.411 3.650 20 5 EHBDLP C[N@@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC000598973343 1033618748 /nfs/dbraw/zinc/61/87/48/1033618748.db2.gz WHVICIUZGFIXBE-CYBMUJFWSA-N 2 2 345.365 3.576 20 5 EHBDLP C[N@H+]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC000598973343 1033618757 /nfs/dbraw/zinc/61/87/57/1033618757.db2.gz WHVICIUZGFIXBE-CYBMUJFWSA-N 2 2 345.365 3.576 20 5 EHBDLP CC1(C)C[C@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000479514585 1040332282 /nfs/dbraw/zinc/33/22/82/1040332282.db2.gz JXPURABHHBTMRP-KJXMEXGPSA-N 2 2 343.471 3.924 20 5 EHBDLP C[C@@H]([NH3+])[C@@H](C)[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000415014166 1017409672 /nfs/dbraw/zinc/40/96/72/1017409672.db2.gz LOHVRPDQLHDFHK-VXGBXAGGSA-N 2 2 349.818 3.866 20 5 EHBDLP O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCc3[nH+]c[nH]c3C2)c2ccccc2)c1 ZINC000377799748 1018394269 /nfs/dbraw/zinc/39/42/69/1018394269.db2.gz YWSRMZCRZGKJLG-OXQOHEQNSA-N 2 2 348.406 3.554 20 5 EHBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@@H]1CCCc3ccc([N+](=O)[O-])cc31)CCC2 ZINC000365738211 1018620691 /nfs/dbraw/zinc/62/06/91/1018620691.db2.gz RRIMYWVMTNRJSQ-CRAIPNDOSA-N 2 2 340.427 3.644 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCC[N@@H+]1C1CC1 ZINC000434789379 1024426542 /nfs/dbraw/zinc/42/65/42/1024426542.db2.gz MKTLNDCRAKGUNQ-ILCZHQDMSA-N 2 2 329.444 3.605 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCC[N@H+]1C1CC1 ZINC000434789379 1024426550 /nfs/dbraw/zinc/42/65/50/1024426550.db2.gz MKTLNDCRAKGUNQ-ILCZHQDMSA-N 2 2 329.444 3.605 20 5 EHBDLP O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1 ZINC000281881090 1025632455 /nfs/dbraw/zinc/63/24/55/1025632455.db2.gz AJDVYKRUQGYTBW-MRXNPFEDSA-N 2 2 340.427 3.507 20 5 EHBDLP O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1 ZINC000281881090 1025632465 /nfs/dbraw/zinc/63/24/65/1025632465.db2.gz AJDVYKRUQGYTBW-MRXNPFEDSA-N 2 2 340.427 3.507 20 5 EHBDLP CCc1ccc([C@H]([NH2+][C@H]2CCC[C@@H]([NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423375036 1028413154 /nfs/dbraw/zinc/41/31/54/1028413154.db2.gz IPIWAEXTGNMUPC-ZRGWGRIASA-N 2 2 343.427 3.699 20 5 EHBDLP C[C@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000153673267 1028555996 /nfs/dbraw/zinc/55/59/96/1028555996.db2.gz KOEJXIZSDLLPNI-ZDUSSCGKSA-N 2 2 340.358 3.770 20 5 EHBDLP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000479580436 1040402563 /nfs/dbraw/zinc/40/25/63/1040402563.db2.gz QSSJEZJXFHXEJE-GOSISDBHSA-N 2 2 331.460 3.539 20 5 EHBDLP CC1CC[NH+](C[C@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000479580436 1040402578 /nfs/dbraw/zinc/40/25/78/1040402578.db2.gz QSSJEZJXFHXEJE-GOSISDBHSA-N 2 2 331.460 3.539 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000542703458 1128548948 /nfs/dbraw/zinc/54/89/48/1128548948.db2.gz NREBROWZIHKNCX-ZWKOTPCHSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC[C@@H](C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000542703458 1128548952 /nfs/dbraw/zinc/54/89/52/1128548952.db2.gz NREBROWZIHKNCX-ZWKOTPCHSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000542703458 1128548955 /nfs/dbraw/zinc/54/89/55/1128548955.db2.gz NREBROWZIHKNCX-ZWKOTPCHSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCC[C@@H]2C)C1 ZINC000542703458 1128548961 /nfs/dbraw/zinc/54/89/61/1128548961.db2.gz NREBROWZIHKNCX-ZWKOTPCHSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cccc1[N+](=O)[O-] ZINC000303207313 1129827652 /nfs/dbraw/zinc/82/76/52/1129827652.db2.gz QEDOPMFMFPZUGM-SFHVURJKSA-N 2 2 345.487 3.991 20 5 EHBDLP Cc1c(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cccc1[N+](=O)[O-] ZINC000303207313 1129827654 /nfs/dbraw/zinc/82/76/54/1129827654.db2.gz QEDOPMFMFPZUGM-SFHVURJKSA-N 2 2 345.487 3.991 20 5 EHBDLP CCC[NH+]1CCC([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1 ZINC000872018102 1137564703 /nfs/dbraw/zinc/56/47/03/1137564703.db2.gz IKDVWUOQOBXKAW-ZDUSSCGKSA-N 2 2 337.489 3.842 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000872025908 1137565931 /nfs/dbraw/zinc/56/59/31/1137565931.db2.gz VOPZPBHVDHVLST-ZDUSSCGKSA-N 2 2 349.500 3.842 20 5 EHBDLP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000536696703 1032156575 /nfs/dbraw/zinc/15/65/75/1032156575.db2.gz FLLPFZSONCFIIE-KRWDZBQOSA-N 2 2 333.476 3.882 20 5 EHBDLP CC[NH+](CC)C[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000536696703 1032156583 /nfs/dbraw/zinc/15/65/83/1032156583.db2.gz FLLPFZSONCFIIE-KRWDZBQOSA-N 2 2 333.476 3.882 20 5 EHBDLP [NH3+][C@H](C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000414842982 1017233198 /nfs/dbraw/zinc/23/31/98/1017233198.db2.gz ZXVIWHXCRVTCEP-UHOSZYNNSA-N 2 2 339.439 3.596 20 5 EHBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)CCC2 ZINC000377837606 1018454856 /nfs/dbraw/zinc/45/48/56/1018454856.db2.gz PADPXEUYJWROBJ-MRXNPFEDSA-N 2 2 342.443 3.890 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000182970068 1019860538 /nfs/dbraw/zinc/86/05/38/1019860538.db2.gz QJIXSGDGBJIGTC-HZPDHXFCSA-N 2 2 342.443 3.652 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1 ZINC000182970068 1019860550 /nfs/dbraw/zinc/86/05/50/1019860550.db2.gz QJIXSGDGBJIGTC-HZPDHXFCSA-N 2 2 342.443 3.652 20 5 EHBDLP Cc1c(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475452 1023246303 /nfs/dbraw/zinc/24/63/03/1023246303.db2.gz XAKNSKZHOLWYIM-AEFFLSMTSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[NH+]2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475452 1023246310 /nfs/dbraw/zinc/24/63/10/1023246310.db2.gz XAKNSKZHOLWYIM-AEFFLSMTSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475452 1023246317 /nfs/dbraw/zinc/24/63/17/1023246317.db2.gz XAKNSKZHOLWYIM-AEFFLSMTSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1c(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475452 1023246324 /nfs/dbraw/zinc/24/63/24/1023246324.db2.gz XAKNSKZHOLWYIM-AEFFLSMTSA-N 2 2 345.487 3.990 20 5 EHBDLP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)[N@H+](C)C1CC1 ZINC000504899157 1029027305 /nfs/dbraw/zinc/02/73/05/1029027305.db2.gz BLUJULSVVANRKO-KGLIPLIRSA-N 2 2 337.489 3.538 20 5 EHBDLP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)[N@@H+](C)C1CC1 ZINC000504899157 1029027320 /nfs/dbraw/zinc/02/73/20/1029027320.db2.gz BLUJULSVVANRKO-KGLIPLIRSA-N 2 2 337.489 3.538 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(Nc2cccc[nH+]2)CC1 ZINC000540911776 1036003912 /nfs/dbraw/zinc/00/39/12/1036003912.db2.gz NLYBIIVDAIHLSH-HNNXBMFYSA-N 2 2 340.427 3.936 20 5 EHBDLP C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(-n2cc[nH+]c2)c1 ZINC000180662555 1037052375 /nfs/dbraw/zinc/05/23/75/1037052375.db2.gz HBQKZSHTYOOIGS-HNNXBMFYSA-N 2 2 336.395 3.674 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000542703449 1128549039 /nfs/dbraw/zinc/54/90/39/1128549039.db2.gz NREBROWZIHKNCX-MSOLQXFVSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC[C@H](C[N@@H+]2CCCC[C@H]2C)C1 ZINC000542703449 1128549041 /nfs/dbraw/zinc/54/90/41/1128549041.db2.gz NREBROWZIHKNCX-MSOLQXFVSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000542703449 1128549044 /nfs/dbraw/zinc/54/90/44/1128549044.db2.gz NREBROWZIHKNCX-MSOLQXFVSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](C[NH+]2CCCC[C@H]2C)C1 ZINC000542703449 1128549046 /nfs/dbraw/zinc/54/90/46/1128549046.db2.gz NREBROWZIHKNCX-MSOLQXFVSA-N 2 2 345.487 3.990 20 5 EHBDLP CC(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1[N+](=O)[O-] ZINC000093597656 1129595124 /nfs/dbraw/zinc/59/51/24/1129595124.db2.gz KFJUTCWZINSJEH-QGZVFWFLSA-N 2 2 331.460 3.636 20 5 EHBDLP CC(C)c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1[N+](=O)[O-] ZINC000093597656 1129595127 /nfs/dbraw/zinc/59/51/27/1129595127.db2.gz KFJUTCWZINSJEH-QGZVFWFLSA-N 2 2 331.460 3.636 20 5 EHBDLP CC(C)(C)[C@@H](Cn1cc[nH+]c1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774133928 1133620748 /nfs/dbraw/zinc/62/07/48/1133620748.db2.gz JRHLCGWLNROLLS-ZWKOTPCHSA-N 2 2 342.443 3.873 20 5 EHBDLP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086667 1137570550 /nfs/dbraw/zinc/57/05/50/1137570550.db2.gz BNHWWAMYWLCMDV-ZFWWWQNUSA-N 2 2 335.423 3.507 20 5 EHBDLP C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086667 1137570551 /nfs/dbraw/zinc/57/05/51/1137570551.db2.gz BNHWWAMYWLCMDV-ZFWWWQNUSA-N 2 2 335.423 3.507 20 5 EHBDLP C[C@H]([NH3+])[C@H](C)[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000415014165 1017408931 /nfs/dbraw/zinc/40/89/31/1017408931.db2.gz LOHVRPDQLHDFHK-RYUDHWBXSA-N 2 2 349.818 3.866 20 5 EHBDLP C[N@H+](CCCn1cc[nH+]c1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290364595 1018536313 /nfs/dbraw/zinc/53/63/13/1018536313.db2.gz HAPHZXYCBVFHSC-UHFFFAOYSA-N 2 2 340.383 3.573 20 5 EHBDLP C[N@@H+](CCCn1cc[nH+]c1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290364595 1018536325 /nfs/dbraw/zinc/53/63/25/1018536325.db2.gz HAPHZXYCBVFHSC-UHFFFAOYSA-N 2 2 340.383 3.573 20 5 EHBDLP C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548336454 1022376087 /nfs/dbraw/zinc/37/60/87/1022376087.db2.gz JTMBQUVGXPWYQY-HUUCEWRRSA-N 2 2 340.427 3.678 20 5 EHBDLP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548336454 1022376105 /nfs/dbraw/zinc/37/61/05/1022376105.db2.gz JTMBQUVGXPWYQY-HUUCEWRRSA-N 2 2 340.427 3.678 20 5 EHBDLP [NH3+]C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCCC1 ZINC000594739253 1033510946 /nfs/dbraw/zinc/51/09/46/1033510946.db2.gz QTCAWNQSUDKFHZ-UHFFFAOYSA-N 2 2 349.818 3.869 20 5 EHBDLP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209998 1044161098 /nfs/dbraw/zinc/16/10/98/1044161098.db2.gz BQBYPBXYTWTOGL-FUHWJXTLSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@H]1CCCC[N@H+]1C[C@@H]1CCC[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209998 1044161107 /nfs/dbraw/zinc/16/11/07/1044161107.db2.gz BQBYPBXYTWTOGL-FUHWJXTLSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209998 1044161111 /nfs/dbraw/zinc/16/11/11/1044161111.db2.gz BQBYPBXYTWTOGL-FUHWJXTLSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@H]1CCCC[NH+]1C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209998 1044161117 /nfs/dbraw/zinc/16/11/17/1044161117.db2.gz BQBYPBXYTWTOGL-FUHWJXTLSA-N 2 2 331.460 3.681 20 5 EHBDLP C[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000338716179 1128745440 /nfs/dbraw/zinc/74/54/40/1128745440.db2.gz MWLAMBRYZXEFTA-ZDUSSCGKSA-N 2 2 342.424 3.698 20 5 EHBDLP C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-n2cc[nH+]c2)cs1 ZINC000338954958 1136512804 /nfs/dbraw/zinc/51/28/04/1136512804.db2.gz RXIVBXFCCJPWNG-UHFFFAOYSA-N 2 2 342.424 3.517 20 5 EHBDLP C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-n2cc[nH+]c2)cs1 ZINC000338954958 1136512806 /nfs/dbraw/zinc/51/28/06/1136512806.db2.gz RXIVBXFCCJPWNG-UHFFFAOYSA-N 2 2 342.424 3.517 20 5 EHBDLP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@@H+]1C ZINC000130655748 1138467395 /nfs/dbraw/zinc/46/73/95/1138467395.db2.gz LBYVWKSJWUEBNM-GDBMZVCRSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@H]([NH+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@H+]1C ZINC000130655748 1138467397 /nfs/dbraw/zinc/46/73/97/1138467397.db2.gz LBYVWKSJWUEBNM-GDBMZVCRSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@H]([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[NH+]1C ZINC000130655748 1138467399 /nfs/dbraw/zinc/46/73/99/1138467399.db2.gz LBYVWKSJWUEBNM-GDBMZVCRSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@H]([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[NH+]1C ZINC000130655748 1138467401 /nfs/dbraw/zinc/46/74/01/1138467401.db2.gz LBYVWKSJWUEBNM-GDBMZVCRSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316592 1018159499 /nfs/dbraw/zinc/15/94/99/1018159499.db2.gz CQFSGVYEVSFNEH-PBHICJAKSA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316592 1018159509 /nfs/dbraw/zinc/15/95/09/1018159509.db2.gz CQFSGVYEVSFNEH-PBHICJAKSA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316592 1018159518 /nfs/dbraw/zinc/15/95/18/1018159518.db2.gz CQFSGVYEVSFNEH-PBHICJAKSA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316592 1018159528 /nfs/dbraw/zinc/15/95/28/1018159528.db2.gz CQFSGVYEVSFNEH-PBHICJAKSA-N 2 2 343.427 3.627 20 5 EHBDLP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2-n2cc[nH+]c2)cc1[N+](=O)[O-] ZINC000152234976 1029802952 /nfs/dbraw/zinc/80/29/52/1029802952.db2.gz LVBXDOKODQBNNV-OAHLLOKOSA-N 2 2 336.395 3.940 20 5 EHBDLP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599073560 1033715174 /nfs/dbraw/zinc/71/51/74/1033715174.db2.gz KDKIHOYVMLLXSO-MAUKXSAKSA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[N@H+]1C1CCCC1 ZINC000599073560 1033715189 /nfs/dbraw/zinc/71/51/89/1033715189.db2.gz KDKIHOYVMLLXSO-MAUKXSAKSA-N 2 2 331.460 3.522 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000255210931 1129046194 /nfs/dbraw/zinc/04/61/94/1129046194.db2.gz IDEGDDWVSWEWHK-GNJLHFKMSA-N 2 2 329.444 3.558 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000255210931 1129046195 /nfs/dbraw/zinc/04/61/95/1129046195.db2.gz IDEGDDWVSWEWHK-GNJLHFKMSA-N 2 2 329.444 3.558 20 5 EHBDLP C[N@H+]1CCCC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000862481995 1137146446 /nfs/dbraw/zinc/14/64/46/1137146446.db2.gz CFEWSYSUCVMEJH-LLVKDONJSA-N 2 2 346.258 3.723 20 5 EHBDLP C[N@@H+]1CCCC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000862481995 1137146445 /nfs/dbraw/zinc/14/64/45/1137146445.db2.gz CFEWSYSUCVMEJH-LLVKDONJSA-N 2 2 346.258 3.723 20 5 EHBDLP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCCNc1cccc[nH+]1 ZINC000866255885 1137340115 /nfs/dbraw/zinc/34/01/15/1137340115.db2.gz DDNCMLCZHFASSQ-AWEZNQCLSA-N 2 2 346.406 3.542 20 5 EHBDLP CC[C@@H]([NH2+]C1CCN(c2cccc[nH+]2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000121359630 1027331015 /nfs/dbraw/zinc/33/10/15/1027331015.db2.gz VPFRYAARLUZHMG-GOSISDBHSA-N 2 2 340.427 3.700 20 5 EHBDLP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423246329 1028305819 /nfs/dbraw/zinc/30/58/19/1028305819.db2.gz ZDHNCBILQWSZOZ-STQMWFEESA-N 2 2 331.441 3.726 20 5 EHBDLP O=[N+]([O-])c1cccc([C@@H]([NH2+]CCCn2cc[nH+]c2)c2ccccc2)c1 ZINC000179963792 1035095669 /nfs/dbraw/zinc/09/56/69/1035095669.db2.gz BWPUXWHXTTXJFX-IBGZPJMESA-N 2 2 336.395 3.561 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CC[N@@H+](C2CCCC2)C1 ZINC000468656246 1038397133 /nfs/dbraw/zinc/39/71/33/1038397133.db2.gz TZECUIVPKGFSDV-JMPLCFMRSA-N 2 2 329.444 3.605 20 5 EHBDLP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CC[N@H+](C2CCCC2)C1 ZINC000468656246 1038397140 /nfs/dbraw/zinc/39/71/40/1038397140.db2.gz TZECUIVPKGFSDV-JMPLCFMRSA-N 2 2 329.444 3.605 20 5 EHBDLP O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCC[NH+]1CCCCC1 ZINC000811473211 1136095435 /nfs/dbraw/zinc/09/54/35/1136095435.db2.gz YLFKJVGUKLKLKW-UHFFFAOYSA-N 2 2 346.258 3.867 20 5 EHBDLP C[C@H]([NH2+][C@H](Cn1cc[nH+]c1)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872023188 1137565364 /nfs/dbraw/zinc/56/53/64/1137565364.db2.gz CZOGVNCIGOVAAH-SWLSCSKDSA-N 2 2 334.395 3.696 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCCn1cc[nH+]c1 ZINC000872023516 1137565604 /nfs/dbraw/zinc/56/56/04/1137565604.db2.gz IFULKMVADLFPJQ-CYBMUJFWSA-N 2 2 334.445 3.644 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000872045786 1137567542 /nfs/dbraw/zinc/56/75/42/1137567542.db2.gz BIPUMCZYQOSUJH-CYBMUJFWSA-N 2 2 337.489 3.840 20 5 EHBDLP C[C@]1(C[NH2+]Cc2ccccc2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC000311216155 1016392039 /nfs/dbraw/zinc/39/20/39/1016392039.db2.gz RVNBSEBBQMFLNT-HXUWFJFHSA-N 2 2 339.439 3.597 20 5 EHBDLP C[C@]1(C[NH2+]Cc2ccccc2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1 ZINC000311216155 1016392055 /nfs/dbraw/zinc/39/20/55/1016392055.db2.gz RVNBSEBBQMFLNT-HXUWFJFHSA-N 2 2 339.439 3.597 20 5 EHBDLP C[C@H]1C[N@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316600 1018144606 /nfs/dbraw/zinc/14/46/06/1018144606.db2.gz CQFSGVYEVSFNEH-YOEHRIQHSA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@H]1C[N@@H+](C)CC[C@@H]1[NH+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316600 1018144621 /nfs/dbraw/zinc/14/46/21/1018144621.db2.gz CQFSGVYEVSFNEH-YOEHRIQHSA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@H]1C[NH+](C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316600 1018144629 /nfs/dbraw/zinc/14/46/29/1018144629.db2.gz CQFSGVYEVSFNEH-YOEHRIQHSA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@H]1C[NH+](C)CC[C@@H]1[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316600 1018144636 /nfs/dbraw/zinc/14/46/36/1018144636.db2.gz CQFSGVYEVSFNEH-YOEHRIQHSA-N 2 2 343.427 3.627 20 5 EHBDLP C[NH+](C)CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000237101691 1019327967 /nfs/dbraw/zinc/32/79/67/1019327967.db2.gz XQHDVZNGLRCTTJ-UHFFFAOYSA-N 2 2 337.807 3.550 20 5 EHBDLP O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(-n3cc[nH+]c3)cs2)c(Cl)c1 ZINC000341556213 1022308887 /nfs/dbraw/zinc/30/88/87/1022308887.db2.gz SFGMGVFSUAPIGF-UHFFFAOYSA-N 2 2 348.815 3.785 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccccc1Cn1cc[nH+]c1 ZINC000574530521 1033276045 /nfs/dbraw/zinc/27/60/45/1033276045.db2.gz BORYFPCPGXLAQG-IBGZPJMESA-N 2 2 348.406 3.617 20 5 EHBDLP C[N@@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC000598973346 1033618705 /nfs/dbraw/zinc/61/87/05/1033618705.db2.gz WHVICIUZGFIXBE-ZDUSSCGKSA-N 2 2 345.365 3.576 20 5 EHBDLP C[N@H+]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC000598973346 1033618716 /nfs/dbraw/zinc/61/87/16/1033618716.db2.gz WHVICIUZGFIXBE-ZDUSSCGKSA-N 2 2 345.365 3.576 20 5 EHBDLP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000512170714 1043580182 /nfs/dbraw/zinc/58/01/82/1043580182.db2.gz UFVVWLHTVIXYCM-SFHVURJKSA-N 2 2 331.460 3.539 20 5 EHBDLP CC1CC[NH+](C[C@@H]2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000512170714 1043580192 /nfs/dbraw/zinc/58/01/92/1043580192.db2.gz UFVVWLHTVIXYCM-SFHVURJKSA-N 2 2 331.460 3.539 20 5 EHBDLP Cc1c([C@H](C)[NH2+][C@H](Cn2cc[nH+]c2)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000765251228 1127588492 /nfs/dbraw/zinc/58/84/92/1127588492.db2.gz MXILNQPPUJXVMP-WMLDXEAASA-N 2 2 330.432 3.865 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245528183 1130230468 /nfs/dbraw/zinc/23/04/68/1130230468.db2.gz QJIXSGDGBJIGTC-CVEARBPZSA-N 2 2 342.443 3.652 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245528183 1130230474 /nfs/dbraw/zinc/23/04/74/1130230474.db2.gz QJIXSGDGBJIGTC-CVEARBPZSA-N 2 2 342.443 3.652 20 5 EHBDLP CC(C)(C)C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903024 1131884926 /nfs/dbraw/zinc/88/49/26/1131884926.db2.gz DCOFKCSMMRVBIO-MSOLQXFVSA-N 2 2 345.487 3.552 20 5 EHBDLP CC(C)(C)C[N@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903024 1131884935 /nfs/dbraw/zinc/88/49/35/1131884935.db2.gz DCOFKCSMMRVBIO-MSOLQXFVSA-N 2 2 345.487 3.552 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC[NH+](C2CC2)CC1 ZINC000872018665 1137564827 /nfs/dbraw/zinc/56/48/27/1137564827.db2.gz OGQFIDCFFDMDCM-LBPRGKRZSA-N 2 2 335.473 3.594 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000872025907 1137565959 /nfs/dbraw/zinc/56/59/59/1137565959.db2.gz VOPZPBHVDHVLST-CYBMUJFWSA-N 2 2 349.500 3.842 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000872076607 1137569988 /nfs/dbraw/zinc/56/99/88/1137569988.db2.gz OCKAUYOBVUEJJG-RLAWYHOSSA-N 2 2 335.473 3.593 20 5 EHBDLP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000872076607 1137569989 /nfs/dbraw/zinc/56/99/89/1137569989.db2.gz OCKAUYOBVUEJJG-RLAWYHOSSA-N 2 2 335.473 3.593 20 5 EHBDLP Cc1[nH]c(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3Cl)CC2)[nH+]c1C ZINC000886665671 1138111438 /nfs/dbraw/zinc/11/14/38/1138111438.db2.gz DMFQNYBNYZLARV-UHFFFAOYSA-N 2 2 348.834 3.968 20 5 EHBDLP C[C@H]1C[N@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316598 1018147025 /nfs/dbraw/zinc/14/70/25/1018147025.db2.gz CQFSGVYEVSFNEH-WMLDXEAASA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@H]1C[N@@H+](C)CC[C@H]1[NH+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316598 1018147032 /nfs/dbraw/zinc/14/70/32/1018147032.db2.gz CQFSGVYEVSFNEH-WMLDXEAASA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@H]1C[NH+](C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316598 1018147044 /nfs/dbraw/zinc/14/70/44/1018147044.db2.gz CQFSGVYEVSFNEH-WMLDXEAASA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@H]1C[NH+](C)CC[C@H]1[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316598 1018147051 /nfs/dbraw/zinc/14/70/51/1018147051.db2.gz CQFSGVYEVSFNEH-WMLDXEAASA-N 2 2 343.427 3.627 20 5 EHBDLP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190851 1018989390 /nfs/dbraw/zinc/98/93/90/1018989390.db2.gz MNHFIYNNJLNKRB-LPHOPBHVSA-N 2 2 339.439 3.595 20 5 EHBDLP C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000398190851 1018989400 /nfs/dbraw/zinc/98/94/00/1018989400.db2.gz MNHFIYNNJLNKRB-LPHOPBHVSA-N 2 2 339.439 3.595 20 5 EHBDLP C[C@H]([NH3+])[C@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077329 1025497053 /nfs/dbraw/zinc/49/70/53/1025497053.db2.gz VKAZDDPBVQESRX-SUMWQHHRSA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@H]([NH3+])[C@H]1CCCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077329 1025497063 /nfs/dbraw/zinc/49/70/63/1025497063.db2.gz VKAZDDPBVQESRX-SUMWQHHRSA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423246326 1028307204 /nfs/dbraw/zinc/30/72/04/1028307204.db2.gz ZDHNCBILQWSZOZ-CHWSQXEVSA-N 2 2 331.441 3.726 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)[N@H+](C)C1CC1 ZINC000504899159 1029027792 /nfs/dbraw/zinc/02/77/92/1029027792.db2.gz BLUJULSVVANRKO-ZIAGYGMSSA-N 2 2 337.489 3.538 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)[N@@H+](C)C1CC1 ZINC000504899159 1029027804 /nfs/dbraw/zinc/02/78/04/1029027804.db2.gz BLUJULSVVANRKO-ZIAGYGMSSA-N 2 2 337.489 3.538 20 5 EHBDLP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2-n2cc[nH+]c2)cc1[N+](=O)[O-] ZINC000152235065 1029802708 /nfs/dbraw/zinc/80/27/08/1029802708.db2.gz LVBXDOKODQBNNV-HNNXBMFYSA-N 2 2 336.395 3.940 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000598992028 1033645295 /nfs/dbraw/zinc/64/52/95/1033645295.db2.gz JQPCZTQHQCRJDA-XOWYPZSQSA-N 2 2 329.444 3.605 20 5 EHBDLP O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1CC[N@H+]1C1CCCCC1 ZINC000598992028 1033645304 /nfs/dbraw/zinc/64/53/04/1033645304.db2.gz JQPCZTQHQCRJDA-XOWYPZSQSA-N 2 2 329.444 3.605 20 5 EHBDLP CC(C)[NH2+]CCC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000591577296 1037515817 /nfs/dbraw/zinc/51/58/17/1037515817.db2.gz MULQTVPQRGEWFU-LJQANCHMSA-N 2 2 327.428 3.662 20 5 EHBDLP CC(C)c1ccc(C[NH+]2CCC(n3cc[nH+]c3)CC2)cc1[N+](=O)[O-] ZINC000092648688 1129555131 /nfs/dbraw/zinc/55/51/31/1129555131.db2.gz VACKDIKCNGCUDJ-UHFFFAOYSA-N 2 2 328.416 3.752 20 5 EHBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444202 1130208518 /nfs/dbraw/zinc/20/85/18/1130208518.db2.gz XUPBLFHDHOYJRW-YJBOKZPZSA-N 2 2 349.475 3.544 20 5 EHBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444202 1130208523 /nfs/dbraw/zinc/20/85/23/1130208523.db2.gz XUPBLFHDHOYJRW-YJBOKZPZSA-N 2 2 349.475 3.544 20 5 EHBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444202 1130208529 /nfs/dbraw/zinc/20/85/29/1130208529.db2.gz XUPBLFHDHOYJRW-YJBOKZPZSA-N 2 2 349.475 3.544 20 5 EHBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444202 1130208532 /nfs/dbraw/zinc/20/85/32/1130208532.db2.gz XUPBLFHDHOYJRW-YJBOKZPZSA-N 2 2 349.475 3.544 20 5 EHBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1c[nH+]cc1-c1ccc(C[NH3+])cc1 ZINC001173230656 1132009700 /nfs/dbraw/zinc/00/97/00/1132009700.db2.gz SSMBTKSOMAOPQP-AWEZNQCLSA-N 2 2 336.395 3.721 20 5 EHBDLP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086663 1137570577 /nfs/dbraw/zinc/57/05/77/1137570577.db2.gz BNHWWAMYWLCMDV-DZGCQCFKSA-N 2 2 335.423 3.507 20 5 EHBDLP C[C@H]([NH2+]C[C@H]1CCC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086663 1137570578 /nfs/dbraw/zinc/57/05/78/1137570578.db2.gz BNHWWAMYWLCMDV-DZGCQCFKSA-N 2 2 335.423 3.507 20 5 EHBDLP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@@H+]1C ZINC000130656186 1138467645 /nfs/dbraw/zinc/46/76/45/1138467645.db2.gz LBYVWKSJWUEBNM-ZBFHGGJFSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@H+]1C ZINC000130656186 1138467647 /nfs/dbraw/zinc/46/76/47/1138467647.db2.gz LBYVWKSJWUEBNM-ZBFHGGJFSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[NH+]1C ZINC000130656186 1138467649 /nfs/dbraw/zinc/46/76/49/1138467649.db2.gz LBYVWKSJWUEBNM-ZBFHGGJFSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[NH+]1C ZINC000130656186 1138467652 /nfs/dbraw/zinc/46/76/52/1138467652.db2.gz LBYVWKSJWUEBNM-ZBFHGGJFSA-N 2 2 343.427 3.769 20 5 EHBDLP Cc1c(CN(c2cccc[nH+]2)[C@H]2CC[C@H]([NH3+])CC2)cccc1[N+](=O)[O-] ZINC000895116068 1024530988 /nfs/dbraw/zinc/53/09/88/1024530988.db2.gz RJPBPMWMLFSMFO-QAQDUYKDSA-N 2 2 340.427 3.575 20 5 EHBDLP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897980987 1033276145 /nfs/dbraw/zinc/27/61/45/1033276145.db2.gz HMYHCNYBUPHXSY-QINSGFPZSA-N 2 2 329.444 3.605 20 5 EHBDLP C[C@@H]([NH2+]Cc1ccc(-n2cc[nH+]c2)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000153673379 1028556260 /nfs/dbraw/zinc/55/62/60/1028556260.db2.gz KOEJXIZSDLLPNI-CYBMUJFWSA-N 2 2 340.358 3.770 20 5 EHBDLP C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCC(C)CC1 ZINC000481971115 1030141636 /nfs/dbraw/zinc/14/16/36/1030141636.db2.gz FZJNZOJECPVUPP-LPHOPBHVSA-N 2 2 345.487 3.626 20 5 EHBDLP C[C@H]([NH2+]CC12CC(C1)C[NH2+]2)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000596655887 1034330501 /nfs/dbraw/zinc/33/05/01/1034330501.db2.gz ZDMPELIFBZGXLF-ZVLZOBCMSA-N 2 2 343.452 3.726 20 5 EHBDLP Cc1cn2c([nH+]1)[C@@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000532538078 1037565612 /nfs/dbraw/zinc/56/56/12/1037565612.db2.gz XLAUKQLNFHMHDJ-HUUCEWRRSA-N 2 2 328.416 3.636 20 5 EHBDLP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CC([NH+]3CCCCC3)C1)CCCC2 ZINC000417328098 1039675427 /nfs/dbraw/zinc/67/54/27/1039675427.db2.gz HYHZWDWLIICTKV-OUNSHVDWSA-N 2 2 343.471 3.969 20 5 EHBDLP O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000491059239 1040896765 /nfs/dbraw/zinc/89/67/65/1040896765.db2.gz RYJXJSZQTRMDQP-GOSISDBHSA-N 2 2 331.460 3.683 20 5 EHBDLP O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000491059239 1040896779 /nfs/dbraw/zinc/89/67/79/1040896779.db2.gz RYJXJSZQTRMDQP-GOSISDBHSA-N 2 2 331.460 3.683 20 5 EHBDLP C[C@H]([NH2+]CCn1cc[nH+]c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000155630299 1129653856 /nfs/dbraw/zinc/65/38/56/1129653856.db2.gz KSTSISSNHNADKS-ZDUSSCGKSA-N 2 2 342.424 3.871 20 5 EHBDLP C[C@H](C[NH+]1CCC(C)CC1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913500 1131919438 /nfs/dbraw/zinc/91/94/38/1131919438.db2.gz WJEOTRIREBCRGR-VQIMIIECSA-N 2 2 345.487 3.552 20 5 EHBDLP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000809738939 1135883671 /nfs/dbraw/zinc/88/36/71/1135883671.db2.gz QFSMWEHRFCQHGE-UHFFFAOYSA-N 2 2 347.846 3.942 20 5 EHBDLP C[NH+](C)Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000809738939 1135883675 /nfs/dbraw/zinc/88/36/75/1135883675.db2.gz QFSMWEHRFCQHGE-UHFFFAOYSA-N 2 2 347.846 3.942 20 5 EHBDLP CC(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951850 1136850896 /nfs/dbraw/zinc/85/08/96/1136850896.db2.gz BCKFXLQUZIRPPA-UGSOOPFHSA-N 2 2 342.443 3.651 20 5 EHBDLP CC(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951841 1136851079 /nfs/dbraw/zinc/85/10/79/1136851079.db2.gz BCKFXLQUZIRPPA-ACJLOTCBSA-N 2 2 342.443 3.651 20 5 EHBDLP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279958 1016849167 /nfs/dbraw/zinc/84/91/67/1016849167.db2.gz RQJIRDKWDPAXNH-PKOBYXMFSA-N 2 2 325.412 3.520 20 5 EHBDLP C[N@H+]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279958 1016849180 /nfs/dbraw/zinc/84/91/80/1016849180.db2.gz RQJIRDKWDPAXNH-PKOBYXMFSA-N 2 2 325.412 3.520 20 5 EHBDLP CC1(C)[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000415030532 1017429924 /nfs/dbraw/zinc/42/99/24/1017429924.db2.gz COXYKCGXUIHCRH-MRXNPFEDSA-N 2 2 331.441 3.553 20 5 EHBDLP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548010023 1018197487 /nfs/dbraw/zinc/19/74/87/1018197487.db2.gz BSXIIFICMOXOGP-YOEHRIQHSA-N 2 2 340.427 3.678 20 5 EHBDLP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](n2c[nH+]c3c2CCCC3)C1 ZINC000548010023 1018197492 /nfs/dbraw/zinc/19/74/92/1018197492.db2.gz BSXIIFICMOXOGP-YOEHRIQHSA-N 2 2 340.427 3.678 20 5 EHBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@H]1CCCc3ccc([N+](=O)[O-])cc31)CCC2 ZINC000365738215 1018621043 /nfs/dbraw/zinc/62/10/43/1018621043.db2.gz RRIMYWVMTNRJSQ-YJBOKZPZSA-N 2 2 340.427 3.644 20 5 EHBDLP CC(C)[C@H]([NH3+])C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414802270 1033067812 /nfs/dbraw/zinc/06/78/12/1033067812.db2.gz VJYBTVYDTFGZNJ-MRXNPFEDSA-N 2 2 347.390 3.599 20 5 EHBDLP C[C@H]([NH2+][C@@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423178621 1028248886 /nfs/dbraw/zinc/24/88/86/1028248886.db2.gz CEWQDLKJGBPAFE-QWHCGFSZSA-N 2 2 331.441 3.726 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCCNc1cccc[nH+]1 ZINC000162874003 1042602688 /nfs/dbraw/zinc/60/26/88/1042602688.db2.gz MIBFZZAIZDYIIA-HNNXBMFYSA-N 2 2 328.416 3.841 20 5 EHBDLP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000536696705 1032157417 /nfs/dbraw/zinc/15/74/17/1032157417.db2.gz FLLPFZSONCFIIE-QGZVFWFLSA-N 2 2 333.476 3.882 20 5 EHBDLP CC[NH+](CC)C[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000536696705 1032157423 /nfs/dbraw/zinc/15/74/23/1032157423.db2.gz FLLPFZSONCFIIE-QGZVFWFLSA-N 2 2 333.476 3.882 20 5 EHBDLP CC(C)[C@@H]([NH3+])C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414802268 1017204999 /nfs/dbraw/zinc/20/49/99/1017204999.db2.gz VJYBTVYDTFGZNJ-INIZCTEOSA-N 2 2 347.390 3.599 20 5 EHBDLP CC(C)[C@H]([NH3+])C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414805412 1017207243 /nfs/dbraw/zinc/20/72/43/1017207243.db2.gz YKQKDGFMPIDYBT-OAHLLOKOSA-N 2 2 337.807 3.581 20 5 EHBDLP CCc1ccccc1[C@@H]([NH3+])C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415070023 1017504066 /nfs/dbraw/zinc/50/40/66/1017504066.db2.gz UEUAZGFSCJSEAB-KXBFYZLASA-N 2 2 341.455 3.768 20 5 EHBDLP Cc1c(C[NH2+][C@H](C)c2ccc(-n3cc[nH+]c3)cc2)cccc1[N+](=O)[O-] ZINC000327712687 1023106652 /nfs/dbraw/zinc/10/66/52/1023106652.db2.gz ZUPBHXYEWCOAQH-OAHLLOKOSA-N 2 2 336.395 3.940 20 5 EHBDLP C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@@H+]1CCCC[C@H]1C ZINC000480622394 1034658192 /nfs/dbraw/zinc/65/81/92/1034658192.db2.gz XYWCUHSQXJTGRH-GPMSIDNRSA-N 2 2 345.487 3.768 20 5 EHBDLP C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCCC[C@H]1C ZINC000480622394 1034658201 /nfs/dbraw/zinc/65/82/01/1034658201.db2.gz XYWCUHSQXJTGRH-GPMSIDNRSA-N 2 2 345.487 3.768 20 5 EHBDLP CCOc1ccc([C@H](C)[NH2+]CCCNc2cccc[nH+]2)cc1[N+](=O)[O-] ZINC000154158370 1129535729 /nfs/dbraw/zinc/53/57/29/1129535729.db2.gz UMMDFEYUONECJT-AWEZNQCLSA-N 2 2 344.415 3.541 20 5 EHBDLP Cc1ccc(C[NH2+][C@H](C)c2cccc(-n3cc[nH+]c3)c2)cc1[N+](=O)[O-] ZINC000742391434 1131714897 /nfs/dbraw/zinc/71/48/97/1131714897.db2.gz HYVNGRXIUUBPQO-OAHLLOKOSA-N 2 2 336.395 3.940 20 5 EHBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555295 1133155582 /nfs/dbraw/zinc/15/55/82/1133155582.db2.gz PTUBEMVHGYPQCN-JSGCOSHPSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555295 1133155586 /nfs/dbraw/zinc/15/55/86/1133155586.db2.gz PTUBEMVHGYPQCN-JSGCOSHPSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555295 1133155590 /nfs/dbraw/zinc/15/55/90/1133155590.db2.gz PTUBEMVHGYPQCN-JSGCOSHPSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555295 1133155593 /nfs/dbraw/zinc/15/55/93/1133155593.db2.gz PTUBEMVHGYPQCN-JSGCOSHPSA-N 2 2 325.840 3.553 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000850424807 1136256321 /nfs/dbraw/zinc/25/63/21/1136256321.db2.gz HMQWRFRQCMUZLW-GUYCJALGSA-N 2 2 346.431 3.565 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H](Cn1cc[nH+]c1)c1ccccc1 ZINC000883387722 1137858995 /nfs/dbraw/zinc/85/89/95/1137858995.db2.gz CUTYDKJKPWUWIJ-OALUTQOASA-N 2 2 348.406 3.810 20 5 EHBDLP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1-n1cc[nH+]c1)CCC2 ZINC000192727146 1140548166 /nfs/dbraw/zinc/54/81/66/1140548166.db2.gz AYOCYGCCRLZCSX-LJQANCHMSA-N 2 2 348.406 3.948 20 5 EHBDLP CC1(C)[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000415039975 1017445021 /nfs/dbraw/zinc/44/50/21/1017445021.db2.gz NVTQXQHCQWFZRK-MRXNPFEDSA-N 2 2 331.441 3.553 20 5 EHBDLP C[C@@H]([NH3+])[C@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113921 1025521409 /nfs/dbraw/zinc/52/14/09/1025521409.db2.gz SPCNAGMJLLIOHY-CXAGYDPISA-N 2 2 329.400 3.557 20 5 EHBDLP C[C@@H]([NH3+])[C@H]1CCCC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113921 1025521418 /nfs/dbraw/zinc/52/14/18/1025521418.db2.gz SPCNAGMJLLIOHY-CXAGYDPISA-N 2 2 329.400 3.557 20 5 EHBDLP CCC([NH3+])(CC)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423287761 1028326234 /nfs/dbraw/zinc/32/62/34/1028326234.db2.gz OJRLQXHMLZDCRT-GOSISDBHSA-N 2 2 327.428 3.791 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594520388 1033429906 /nfs/dbraw/zinc/42/99/06/1033429906.db2.gz OCCPLGCGJVBRNV-HHXXYDBFSA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000594520388 1033429918 /nfs/dbraw/zinc/42/99/18/1033429918.db2.gz OCCPLGCGJVBRNV-HHXXYDBFSA-N 2 2 331.460 3.522 20 5 EHBDLP Cc1[nH+]ccn1-c1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000089512119 1033752335 /nfs/dbraw/zinc/75/23/35/1033752335.db2.gz ILQJQSPNHWITLG-CQSZACIVSA-N 2 2 336.395 3.940 20 5 EHBDLP C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@@H+]1CCCC[C@H]1C ZINC000480622392 1034672727 /nfs/dbraw/zinc/67/27/27/1034672727.db2.gz XYWCUHSQXJTGRH-GJYPPUQNSA-N 2 2 345.487 3.768 20 5 EHBDLP C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[N@H+]1CCCC[C@H]1C ZINC000480622392 1034672739 /nfs/dbraw/zinc/67/27/39/1034672739.db2.gz XYWCUHSQXJTGRH-GJYPPUQNSA-N 2 2 345.487 3.768 20 5 EHBDLP Cc1cn2c([nH+]1)[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)CCC2 ZINC000378180720 1038150064 /nfs/dbraw/zinc/15/00/64/1038150064.db2.gz AHQOCJHQLSNDQH-CABCVRRESA-N 2 2 328.416 3.636 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491057612 1040898262 /nfs/dbraw/zinc/89/82/62/1040898262.db2.gz DTARVUOLCHBQOH-KRWDZBQOSA-N 2 2 331.460 3.683 20 5 EHBDLP O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491057612 1040898273 /nfs/dbraw/zinc/89/82/73/1040898273.db2.gz DTARVUOLCHBQOH-KRWDZBQOSA-N 2 2 331.460 3.683 20 5 EHBDLP CC[C@H]([NH2+]CCCCNc1cccc[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000162899020 1129910886 /nfs/dbraw/zinc/91/08/86/1129910886.db2.gz RJEIKEOGVMMPND-KRWDZBQOSA-N 2 2 328.416 3.923 20 5 EHBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C1CCCC1)C1CC[NH+](C)CC1 ZINC001173238088 1132026706 /nfs/dbraw/zinc/02/67/06/1132026706.db2.gz MXBKHSMOVKBUDF-INIZCTEOSA-N 2 2 345.487 3.865 20 5 EHBDLP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C1CCCC1)C1CC[NH+](C)CC1 ZINC001173238088 1132026713 /nfs/dbraw/zinc/02/67/13/1132026713.db2.gz MXBKHSMOVKBUDF-INIZCTEOSA-N 2 2 345.487 3.865 20 5 EHBDLP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555297 1133155320 /nfs/dbraw/zinc/15/53/20/1133155320.db2.gz PTUBEMVHGYPQCN-OCCSQVGLSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[N@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555297 1133155325 /nfs/dbraw/zinc/15/53/25/1133155325.db2.gz PTUBEMVHGYPQCN-OCCSQVGLSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[NH+]1CC[C@H]([N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555297 1133155329 /nfs/dbraw/zinc/15/53/29/1133155329.db2.gz PTUBEMVHGYPQCN-OCCSQVGLSA-N 2 2 325.840 3.553 20 5 EHBDLP CC[NH+]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555297 1133155331 /nfs/dbraw/zinc/15/53/31/1133155331.db2.gz PTUBEMVHGYPQCN-OCCSQVGLSA-N 2 2 325.840 3.553 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H](Cn1cc[nH+]c1)c1ccccc1 ZINC000883387724 1137859020 /nfs/dbraw/zinc/85/90/20/1137859020.db2.gz CUTYDKJKPWUWIJ-RTBURBONSA-N 2 2 348.406 3.810 20 5 EHBDLP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C ZINC000093644282 1138239189 /nfs/dbraw/zinc/23/91/89/1138239189.db2.gz QVJALBYKUFALHM-GJZGRUSLSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000093644282 1138239191 /nfs/dbraw/zinc/23/91/91/1138239191.db2.gz QVJALBYKUFALHM-GJZGRUSLSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[NH+]1C ZINC000093644282 1138239192 /nfs/dbraw/zinc/23/91/92/1138239192.db2.gz QVJALBYKUFALHM-GJZGRUSLSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[NH+]1C ZINC000093644282 1138239194 /nfs/dbraw/zinc/23/91/94/1138239194.db2.gz QVJALBYKUFALHM-GJZGRUSLSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@@H+]1C ZINC000130656387 1138467354 /nfs/dbraw/zinc/46/73/54/1138467354.db2.gz LBYVWKSJWUEBNM-HOCLYGCPSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([NH+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@H+]1C ZINC000130656387 1138467356 /nfs/dbraw/zinc/46/73/56/1138467356.db2.gz LBYVWKSJWUEBNM-HOCLYGCPSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[NH+]1C ZINC000130656387 1138467359 /nfs/dbraw/zinc/46/73/59/1138467359.db2.gz LBYVWKSJWUEBNM-HOCLYGCPSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[NH+]1C ZINC000130656387 1138467362 /nfs/dbraw/zinc/46/73/62/1138467362.db2.gz LBYVWKSJWUEBNM-HOCLYGCPSA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@H]([NH2+][C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144923 1028205829 /nfs/dbraw/zinc/20/58/29/1028205829.db2.gz IITODWJQSXXXPY-POZUXBRTSA-N 2 2 325.412 3.739 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)[N@H+](C)C1CC1 ZINC000504899158 1029026620 /nfs/dbraw/zinc/02/66/20/1029026620.db2.gz BLUJULSVVANRKO-UONOGXRCSA-N 2 2 337.489 3.538 20 5 EHBDLP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)[N@@H+](C)C1CC1 ZINC000504899158 1029026633 /nfs/dbraw/zinc/02/66/33/1029026633.db2.gz BLUJULSVVANRKO-UONOGXRCSA-N 2 2 337.489 3.538 20 5 EHBDLP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000493233794 1036959379 /nfs/dbraw/zinc/95/93/79/1036959379.db2.gz UYHZXTBHFAACFG-BPAFIMBUSA-N 2 2 339.439 3.757 20 5 EHBDLP C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000493233794 1036959390 /nfs/dbraw/zinc/95/93/90/1036959390.db2.gz UYHZXTBHFAACFG-BPAFIMBUSA-N 2 2 339.439 3.757 20 5 EHBDLP O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(Cn2cc[nH+]c2)c1 ZINC000570986056 1041158045 /nfs/dbraw/zinc/15/80/45/1041158045.db2.gz ZHXFJEFEDQBOHG-IBGZPJMESA-N 2 2 348.406 3.617 20 5 EHBDLP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1[N+](=O)[O-] ZINC000512164289 1043546208 /nfs/dbraw/zinc/54/62/08/1043546208.db2.gz BYRFRQJXBVRYNS-IBGZPJMESA-N 2 2 345.487 3.847 20 5 EHBDLP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1[N+](=O)[O-] ZINC000512164289 1043546215 /nfs/dbraw/zinc/54/62/15/1043546215.db2.gz BYRFRQJXBVRYNS-IBGZPJMESA-N 2 2 345.487 3.847 20 5 EHBDLP Cc1ccc(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171371 1043610160 /nfs/dbraw/zinc/61/01/60/1043610160.db2.gz WWVGNJGPMVWXCJ-IEBWSBKVSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[NH+]2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171371 1043610163 /nfs/dbraw/zinc/61/01/63/1043610163.db2.gz WWVGNJGPMVWXCJ-IEBWSBKVSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[N@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171371 1043610165 /nfs/dbraw/zinc/61/01/65/1043610165.db2.gz WWVGNJGPMVWXCJ-IEBWSBKVSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171371 1043610166 /nfs/dbraw/zinc/61/01/66/1043610166.db2.gz WWVGNJGPMVWXCJ-IEBWSBKVSA-N 2 2 345.487 3.990 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000765252144 1127588896 /nfs/dbraw/zinc/58/88/96/1127588896.db2.gz RFQBMHXEUQVFIR-PBHICJAKSA-N 2 2 330.432 3.865 20 5 EHBDLP C[NH+](C)CCn1cc(Nc2ccc3[nH+]c4ccccc4cc3c2)cn1 ZINC001176449904 1132936930 /nfs/dbraw/zinc/93/69/30/1132936930.db2.gz WLIOFPQUWTYRHJ-UHFFFAOYSA-N 2 2 331.423 3.890 20 5 EHBDLP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000850444160 1136260011 /nfs/dbraw/zinc/26/00/11/1136260011.db2.gz XAEBBXZUPWPFMR-ZDUSSCGKSA-N 2 2 335.448 3.517 20 5 EHBDLP CC(C)[NH2+]C1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000179835284 1139787372 /nfs/dbraw/zinc/78/73/72/1139787372.db2.gz RVDQNDJAKIYBAQ-UHFFFAOYSA-N 2 2 343.427 3.817 20 5 EHBDLP Cc1ccc(CN(c2cccc[nH+]2)[C@H]2CC[C@H]([NH3+])CC2)cc1[N+](=O)[O-] ZINC000895112035 1024505123 /nfs/dbraw/zinc/50/51/23/1024505123.db2.gz SSCORKLRSFNFGB-QAQDUYKDSA-N 2 2 340.427 3.575 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594520389 1033429542 /nfs/dbraw/zinc/42/95/42/1033429542.db2.gz OCCPLGCGJVBRNV-SUMDDJOVSA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000594520389 1033429555 /nfs/dbraw/zinc/42/95/55/1033429555.db2.gz OCCPLGCGJVBRNV-SUMDDJOVSA-N 2 2 331.460 3.522 20 5 EHBDLP C[C@@H]([NH2+]CC12CC(C1)C[NH2+]2)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000596655886 1034330075 /nfs/dbraw/zinc/33/00/75/1034330075.db2.gz ZDMPELIFBZGXLF-WHENESEISA-N 2 2 343.452 3.726 20 5 EHBDLP CC(C)[NH2+]C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000179833410 1034737353 /nfs/dbraw/zinc/73/73/53/1034737353.db2.gz MGRXNXIRQPTRBI-UHFFFAOYSA-N 2 2 343.427 3.817 20 5 EHBDLP CC1(C)C[C@H]([NH2+][C@H]2CC[N@@H+]3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390420 1035434346 /nfs/dbraw/zinc/43/43/46/1035434346.db2.gz XJCHAXOGYFCURI-OKZBNKHCSA-N 2 2 329.444 3.534 20 5 EHBDLP CC1(C)C[C@H]([NH2+][C@H]2CC[N@H+]3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390420 1035434348 /nfs/dbraw/zinc/43/43/48/1035434348.db2.gz XJCHAXOGYFCURI-OKZBNKHCSA-N 2 2 329.444 3.534 20 5 EHBDLP CC1(C)C[C@@H]([NH2+]C2CC([NH+]3CCCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000479514584 1040332154 /nfs/dbraw/zinc/33/21/54/1040332154.db2.gz JXPURABHHBTMRP-GSQSYGFSSA-N 2 2 343.471 3.924 20 5 EHBDLP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000125225928 1041920706 /nfs/dbraw/zinc/92/07/06/1041920706.db2.gz HDFRGVNEAMHLNP-UHFFFAOYSA-N 2 2 343.427 3.771 20 5 EHBDLP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000125225928 1041920715 /nfs/dbraw/zinc/92/07/15/1041920715.db2.gz HDFRGVNEAMHLNP-UHFFFAOYSA-N 2 2 343.427 3.771 20 5 EHBDLP CC[NH+]1CCC([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000125250222 1041927164 /nfs/dbraw/zinc/92/71/64/1041927164.db2.gz VXPZCOQJPQPCPW-UHFFFAOYSA-N 2 2 343.427 3.771 20 5 EHBDLP CC[NH+]1CCC([N@@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000125250222 1041927175 /nfs/dbraw/zinc/92/71/75/1041927175.db2.gz VXPZCOQJPQPCPW-UHFFFAOYSA-N 2 2 343.427 3.771 20 5 EHBDLP Cc1c(C[NH2+][C@@H](Cn2cc[nH+]c2)c2ccccc2)cccc1[N+](=O)[O-] ZINC001197263914 1135667018 /nfs/dbraw/zinc/66/70/18/1135667018.db2.gz GBELDLXNYHIVNF-SFHVURJKSA-N 2 2 336.395 3.631 20 5 EHBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCCn3cc[nH+]c3)o2)cc1 ZINC001199648112 1135916866 /nfs/dbraw/zinc/91/68/66/1135916866.db2.gz DBDBYRIOPSVNNN-UHFFFAOYSA-N 2 2 340.383 3.621 20 5 EHBDLP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476039 1136096363 /nfs/dbraw/zinc/09/63/63/1136096363.db2.gz WKFSFKPNLSHIIS-NSHDSACASA-N 2 2 346.258 3.723 20 5 EHBDLP CCC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476039 1136096367 /nfs/dbraw/zinc/09/63/67/1136096367.db2.gz WKFSFKPNLSHIIS-NSHDSACASA-N 2 2 346.258 3.723 20 5 EHBDLP C[N@@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000862481997 1137146293 /nfs/dbraw/zinc/14/62/93/1137146293.db2.gz CFEWSYSUCVMEJH-NSHDSACASA-N 2 2 346.258 3.723 20 5 EHBDLP C[N@H+]1CCCC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000862481997 1137146294 /nfs/dbraw/zinc/14/62/94/1137146294.db2.gz CFEWSYSUCVMEJH-NSHDSACASA-N 2 2 346.258 3.723 20 5 EHBDLP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](Cn1cc[nH+]c1)C(C)(C)C ZINC000866238593 1137337901 /nfs/dbraw/zinc/33/79/01/1137337901.db2.gz PZLWRYNNLCRIBK-DYVFJYSZSA-N 2 2 348.422 3.566 20 5 EHBDLP C[C@H]([NH2+][C@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423178622 1028247487 /nfs/dbraw/zinc/24/74/87/1028247487.db2.gz CEWQDLKJGBPAFE-STQMWFEESA-N 2 2 331.441 3.726 20 5 EHBDLP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]([NH3+])c1ccccc1 ZINC000423231343 1028297314 /nfs/dbraw/zinc/29/73/14/1028297314.db2.gz ATJJXOJRWLWFCJ-JKSUJKDBSA-N 2 2 345.468 3.755 20 5 EHBDLP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000539531025 1036886592 /nfs/dbraw/zinc/88/65/92/1036886592.db2.gz OYEIKQQHERQRTO-LSDHHAIUSA-N 2 2 325.478 3.647 20 5 EHBDLP C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000493233796 1036958224 /nfs/dbraw/zinc/95/82/24/1036958224.db2.gz UYHZXTBHFAACFG-XFQXTVEOSA-N 2 2 339.439 3.757 20 5 EHBDLP C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000493233796 1036958233 /nfs/dbraw/zinc/95/82/33/1036958233.db2.gz UYHZXTBHFAACFG-XFQXTVEOSA-N 2 2 339.439 3.757 20 5 EHBDLP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCCNc1cccc[nH+]1 ZINC000162873905 1042603467 /nfs/dbraw/zinc/60/34/67/1042603467.db2.gz MIBFZZAIZDYIIA-OAHLLOKOSA-N 2 2 328.416 3.841 20 5 EHBDLP Cc1cc(NCCCCn2cc[nH+]c2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000326217833 1121150621 /nfs/dbraw/zinc/15/06/21/1121150621.db2.gz ZHWUOMVKPNSCSU-UHFFFAOYSA-N 2 2 325.372 3.540 20 5 EHBDLP CCC1([NH+]2CCC2)CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC001176234851 1132883189 /nfs/dbraw/zinc/88/31/89/1132883189.db2.gz JCYZTAAERRFJOP-MRXNPFEDSA-N 2 2 331.460 3.915 20 5 EHBDLP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC[NH+]3CCCCC3)o2)cc1 ZINC001177133023 1133033745 /nfs/dbraw/zinc/03/37/45/1133033745.db2.gz PNKQWPYFXKVPHM-UHFFFAOYSA-N 2 2 343.427 3.820 20 5 EHBDLP C[NH+](C)[C@H]1CCC[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811482898 1136091311 /nfs/dbraw/zinc/09/13/11/1136091311.db2.gz WQNMISQFJUQGPI-STQMWFEESA-N 2 2 346.258 3.864 20 5 EHBDLP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C ZINC000093644281 1138238895 /nfs/dbraw/zinc/23/88/95/1138238895.db2.gz QVJALBYKUFALHM-CABCVRRESA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@@H]([NH+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C ZINC000093644281 1138238898 /nfs/dbraw/zinc/23/88/98/1138238898.db2.gz QVJALBYKUFALHM-CABCVRRESA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[NH+]1C ZINC000093644281 1138238899 /nfs/dbraw/zinc/23/88/99/1138238899.db2.gz QVJALBYKUFALHM-CABCVRRESA-N 2 2 343.427 3.769 20 5 EHBDLP C[C@@H]1C[C@@H]([N@@H+](C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[NH+]1C ZINC000093644281 1138238900 /nfs/dbraw/zinc/23/89/00/1138238900.db2.gz QVJALBYKUFALHM-CABCVRRESA-N 2 2 343.427 3.769 20 5 EHBDLP