smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000246922487 1016083316 /nfs/dbraw/zinc/08/33/16/1016083316.db2.gz GOCYNTSAKDXIKP-QFBILLFUSA-N 2 0 345.487 3.626 20 5 EHBDRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548409 1026097156 /nfs/dbraw/zinc/09/71/56/1026097156.db2.gz MXZTZBHSYLMIPB-MSOLQXFVSA-N 2 0 331.460 3.649 20 5 EHBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422920459 1028074992 /nfs/dbraw/zinc/07/49/92/1028074992.db2.gz MCZFEYLKIRYUEW-HSALFYBXSA-N 2 0 345.487 3.818 20 5 EHBDRP O=[N+]([O-])c1cccc([C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2ccccc2)c1 ZINC000423263103 1028302115 /nfs/dbraw/zinc/30/21/15/1028302115.db2.gz WNWHWDVTJMYDIR-OXJNMPFZSA-N 2 0 339.439 3.664 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CN)C1CCCC1 ZINC000423504703 1028469769 /nfs/dbraw/zinc/46/97/69/1028469769.db2.gz NUHVEZGIOZDESX-LSDHHAIUSA-N 2 0 337.489 3.573 20 5 EHBDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCN1C ZINC000525195851 1029738793 /nfs/dbraw/zinc/73/87/93/1029738793.db2.gz SQTLWCSNZPSIRZ-UONOGXRCSA-N 2 0 345.468 3.896 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417339960 1039687633 /nfs/dbraw/zinc/68/76/33/1039687633.db2.gz JDVXMWAUEHCBFO-SFHVURJKSA-N 2 0 331.460 3.684 20 5 EHBDRP C[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCCC1 ZINC000556063476 1122800370 /nfs/dbraw/zinc/80/03/70/1122800370.db2.gz HAYGKLLVMPHCNK-DNVCBOLYSA-N 2 0 331.460 3.684 20 5 EHBDRP CCOc1ccc([C@H](C)[NH2+]CCC2CC[NH+](CC)CC2)cc1[N+](=O)[O-] ZINC000154011581 1129528602 /nfs/dbraw/zinc/52/86/02/1129528602.db2.gz RWCWKPLNOIWALF-HNNXBMFYSA-N 2 0 349.475 3.766 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](Cc1ccccc1)C[C@@H](C)C[NH3+] ZINC001173220889 1132003952 /nfs/dbraw/zinc/00/39/52/1132003952.db2.gz HSRSGIVLFUZHAS-DLBZAZTESA-N 2 0 341.455 3.623 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC(C)(C)C[C@@](C)(C[NH3+])C1 ZINC001173234105 1132010296 /nfs/dbraw/zinc/01/02/96/1132010296.db2.gz MQHSADHVWXSZDQ-OGWOLHLISA-N 2 0 333.476 3.659 20 5 EHBDRP C[NH+]1CCC(CC[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811478308 1136096277 /nfs/dbraw/zinc/09/62/77/1136096277.db2.gz FXMATLLKNDHQQF-UHFFFAOYSA-N 2 0 346.258 3.723 20 5 EHBDRP CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[NH2+]CC1 ZINC000414720663 1017155111 /nfs/dbraw/zinc/15/51/11/1017155111.db2.gz ZIZSWXQVIAAIDN-OAHLLOKOSA-N 2 0 343.427 3.819 20 5 EHBDRP CC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]CC1 ZINC000414933303 1017339872 /nfs/dbraw/zinc/33/98/72/1017339872.db2.gz DOMUOJZNTFEFCI-UHFFFAOYSA-N 2 0 331.441 3.555 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC[C@@H]3CCC[NH2+]3)s2)cc1 ZINC000414967750 1017358951 /nfs/dbraw/zinc/35/89/51/1017358951.db2.gz HJLRMCPTJLZHSW-OAHLLOKOSA-N 2 0 345.468 3.945 20 5 EHBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000415042433 1017448168 /nfs/dbraw/zinc/44/81/68/1017448168.db2.gz QVKDTVVMTQYJGS-OLZOCXBDSA-N 2 0 331.441 3.540 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@@H]2CCC[NH2+]C2)s1 ZINC000414846739 1024091109 /nfs/dbraw/zinc/09/11/09/1024091109.db2.gz VAPQCLZIPUXGMZ-AWEZNQCLSA-N 2 0 345.468 3.803 20 5 EHBDRP C[C@@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371218 1024856126 /nfs/dbraw/zinc/85/61/26/1024856126.db2.gz LYFSNRFNLKWPGL-VXGBXAGGSA-N 2 0 349.818 3.677 20 5 EHBDRP [NH3+][C@@H]1C[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000422915003 1028048907 /nfs/dbraw/zinc/04/89/07/1028048907.db2.gz AFEQBXDCYLHTAI-RTBURBONSA-N 2 0 325.412 3.652 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)s1 ZINC000591281889 1037320565 /nfs/dbraw/zinc/32/05/65/1037320565.db2.gz RYDKVGMVMGXSFQ-KRWDZBQOSA-N 2 0 343.452 3.555 20 5 EHBDRP C[C@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[NH+](C)C ZINC000491595644 1037575324 /nfs/dbraw/zinc/57/53/24/1037575324.db2.gz CDVYCOQPSXPJTF-CYBMUJFWSA-N 2 0 333.457 3.611 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417358000 1039719867 /nfs/dbraw/zinc/71/98/67/1039719867.db2.gz HIUQUHHQQKWJLM-BEFAXECRSA-N 2 0 331.460 3.684 20 5 EHBDRP Cc1cc(N2CC[NH+](C3CCCC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302211957 1129773729 /nfs/dbraw/zinc/77/37/29/1129773729.db2.gz YWHWMEOYKGAUBZ-UHFFFAOYSA-N 2 0 340.427 3.516 20 5 EHBDRP CC[NH+](CC)CCCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900724 1131883834 /nfs/dbraw/zinc/88/38/34/1131883834.db2.gz YRJXXVPLHSNAPG-GOSISDBHSA-N 2 0 333.476 3.554 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001173218769 1132003677 /nfs/dbraw/zinc/00/36/77/1132003677.db2.gz MBJLVOFIEZMPKN-CQSZACIVSA-N 2 0 333.476 3.767 20 5 EHBDRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173222113 1132004673 /nfs/dbraw/zinc/00/46/73/1132004673.db2.gz ULWHDTRFBSDGGE-ZLPCBKJTSA-N 2 0 333.476 3.768 20 5 EHBDRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788538975 1134139538 /nfs/dbraw/zinc/13/95/38/1134139538.db2.gz JAJIHOQDKYHSLF-OWCLPIDISA-N 2 0 348.491 3.586 20 5 EHBDRP O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000815150689 1136562890 /nfs/dbraw/zinc/56/28/90/1136562890.db2.gz DNUXMYBSPULGDO-UHFFFAOYSA-N 2 0 325.840 3.604 20 5 EHBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000865765586 1137309969 /nfs/dbraw/zinc/30/99/69/1137309969.db2.gz BLHCWQQKMNZFOO-UHFFFAOYSA-N 2 0 325.840 3.601 20 5 EHBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCCCC12CC[NH2+]CC2 ZINC000873232749 1137594563 /nfs/dbraw/zinc/59/45/63/1137594563.db2.gz KLXWYCYHKLOKKA-LZCIBIBXSA-N 2 0 329.444 3.510 20 5 EHBDRP C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-n2ccnc2)cs1 ZINC000348674980 1141564752 /nfs/dbraw/zinc/56/47/52/1141564752.db2.gz PDNAATNUNFLCES-UHFFFAOYSA-N 2 0 342.424 3.517 20 5 EHBDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCN1C ZINC000525195849 1029739711 /nfs/dbraw/zinc/73/97/11/1029739711.db2.gz SQTLWCSNZPSIRZ-KBPBESRZSA-N 2 0 345.468 3.896 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000470172459 1038426212 /nfs/dbraw/zinc/42/62/12/1038426212.db2.gz XABKJRCBHAUGGU-VBKFSLOCSA-N 2 0 331.460 3.803 20 5 EHBDRP CC1(C)C[C@H](N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170624 1040960347 /nfs/dbraw/zinc/96/03/47/1040960347.db2.gz YGOJIYJMFHWIAY-LBTNJELSSA-N 2 0 329.444 3.534 20 5 EHBDRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131945 1123165399 /nfs/dbraw/zinc/16/53/99/1123165399.db2.gz BTHPXNWILXEPAA-AEFFLSMTSA-N 2 0 339.439 3.768 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001173224814 1132004999 /nfs/dbraw/zinc/00/49/99/1132004999.db2.gz PDZWTEQGXUFXNM-HNNXBMFYSA-N 2 0 331.460 3.509 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000872080580 1137570224 /nfs/dbraw/zinc/57/02/24/1137570224.db2.gz SAXKBCUIYZKLLD-IYXRBSQSSA-N 2 0 337.489 3.840 20 5 EHBDRP Cc1c(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000873007955 1137587882 /nfs/dbraw/zinc/58/78/82/1137587882.db2.gz BASROSBUHNGMOH-UHFFFAOYSA-N 2 0 339.439 3.789 20 5 EHBDRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000873257258 1137595578 /nfs/dbraw/zinc/59/55/78/1137595578.db2.gz GJCIKYFGQSGZRC-AVGNSLFASA-N 2 0 331.441 3.711 20 5 EHBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414999201 1017380091 /nfs/dbraw/zinc/38/00/91/1017380091.db2.gz JBBACTZXKDXSCI-UONOGXRCSA-N 2 0 345.468 3.930 20 5 EHBDRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000415029191 1017423712 /nfs/dbraw/zinc/42/37/12/1017423712.db2.gz ZVVPOXMYQKDZMP-HNNXBMFYSA-N 2 0 342.443 3.580 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592491867 1032928304 /nfs/dbraw/zinc/92/83/04/1032928304.db2.gz MQIAAEHXGPLPSC-BBWFWOEESA-N 2 0 331.460 3.676 20 5 EHBDRP CCC[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000447572054 1030291475 /nfs/dbraw/zinc/29/14/75/1030291475.db2.gz MQZKIHHHJKHLOF-LJQANCHMSA-N 2 0 331.460 3.900 20 5 EHBDRP O=[N+]([O-])c1ccc(C[NH2+]CCCCC[NH+]2CCCCC2)cc1Cl ZINC000761519753 1037098403 /nfs/dbraw/zinc/09/84/03/1037098403.db2.gz HMPRBTJBLGKJCR-UHFFFAOYSA-N 2 0 339.867 3.994 20 5 EHBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000236856541 1044763504 /nfs/dbraw/zinc/76/35/04/1044763504.db2.gz PWXUKQJWOZRQPA-CYBMUJFWSA-N 2 0 327.856 3.848 20 5 EHBDRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900961 1131884264 /nfs/dbraw/zinc/88/42/64/1131884264.db2.gz HWRZXGJUXDCXJK-VQIMIIECSA-N 2 0 345.487 3.696 20 5 EHBDRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909652 1131916803 /nfs/dbraw/zinc/91/68/03/1131916803.db2.gz UTFRZSUOMSHIGI-MOXGXCLJSA-N 2 0 345.487 3.551 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001173226550 1132006279 /nfs/dbraw/zinc/00/62/79/1132006279.db2.gz KJSGJZPSVPNKMY-HKUYNNGSSA-N 2 0 345.487 3.866 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001173226560 1132007122 /nfs/dbraw/zinc/00/71/22/1132007122.db2.gz KJSGJZPSVPNKMY-PKOBYXMFSA-N 2 0 345.487 3.866 20 5 EHBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000866216200 1137335737 /nfs/dbraw/zinc/33/57/37/1137335737.db2.gz QTGRDCCQUVTXMW-GFCCVEGCSA-N 2 0 337.439 3.564 20 5 EHBDRP CC(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000414785337 1017198654 /nfs/dbraw/zinc/19/86/54/1017198654.db2.gz SMSWCTHUKXSGKG-DLBZAZTESA-N 2 0 331.460 3.540 20 5 EHBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000415030747 1017429448 /nfs/dbraw/zinc/42/94/48/1017429448.db2.gz GBUICSJKXMPRSO-OCCSQVGLSA-N 2 0 331.441 3.540 20 5 EHBDRP CC[NH+]1CCC(CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000326384949 1022084800 /nfs/dbraw/zinc/08/48/00/1022084800.db2.gz ZKCLHAKMNFKWMG-UHFFFAOYSA-N 2 0 328.416 3.595 20 5 EHBDRP Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000521847964 1025718301 /nfs/dbraw/zinc/71/83/01/1025718301.db2.gz CHPUTPHEIWYELX-HOCLYGCPSA-N 2 0 340.427 3.514 20 5 EHBDRP [NH3+][C@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000423036615 1028144348 /nfs/dbraw/zinc/14/43/48/1028144348.db2.gz ATJNWJJHZIOVDD-HOTGVXAUSA-N 2 0 331.803 3.525 20 5 EHBDRP CC1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[NH2+]CC1 ZINC000423320540 1028349301 /nfs/dbraw/zinc/34/93/01/1028349301.db2.gz FLUKCLNYWRGSFT-LJQANCHMSA-N 2 0 339.439 3.664 20 5 EHBDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423398887 1028412001 /nfs/dbraw/zinc/41/20/01/1028412001.db2.gz PDHVOOPINYJCKS-KCQAQPDRSA-N 2 0 345.468 3.972 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000504926268 1029072021 /nfs/dbraw/zinc/07/20/21/1029072021.db2.gz HEYVYOIKRBTDGY-OWCLPIDISA-N 2 0 349.500 3.682 20 5 EHBDRP CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c1CC[NH2+]C2 ZINC000595890271 1034020760 /nfs/dbraw/zinc/02/07/60/1034020760.db2.gz DSYBUAXYBKZXHV-UHFFFAOYSA-N 2 0 339.439 3.651 20 5 EHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596096621 1034078064 /nfs/dbraw/zinc/07/80/64/1034078064.db2.gz VMEDWXJMCQELRH-AEFFLSMTSA-N 2 0 345.487 3.628 20 5 EHBDRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000571642409 1035577231 /nfs/dbraw/zinc/57/72/31/1035577231.db2.gz NPSDMDOCVUUESQ-HKUYNNGSSA-N 2 0 339.439 3.555 20 5 EHBDRP Cc1c([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150541 1037622320 /nfs/dbraw/zinc/62/23/20/1037622320.db2.gz FURLWNZUSZQCEC-IAGOWNOFSA-N 2 0 333.476 3.922 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCC2 ZINC000417316063 1039653817 /nfs/dbraw/zinc/65/38/17/1039653817.db2.gz ALXZOZWYIFVVTO-FQEVSTJZSA-N 2 0 343.471 3.826 20 5 EHBDRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136451 1123167550 /nfs/dbraw/zinc/16/75/50/1123167550.db2.gz IWCAWLSRKOURNS-WMZOPIPTSA-N 2 0 339.439 3.768 20 5 EHBDRP CCC[N@H+](C)C[C@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000302204129 1129772855 /nfs/dbraw/zinc/77/28/55/1129772855.db2.gz WFVSFYLXCDFDCK-OAHLLOKOSA-N 2 0 342.443 3.620 20 5 EHBDRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898096 1131882943 /nfs/dbraw/zinc/88/29/43/1131882943.db2.gz GLFZXTSBNDPMNM-QGZVFWFLSA-N 2 0 345.487 3.823 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C2CC[NH+](C)CC2)CC1 ZINC001173226073 1132006922 /nfs/dbraw/zinc/00/69/22/1132006922.db2.gz HKKOOVCOEFHBFZ-MRXNPFEDSA-N 2 0 345.487 3.580 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177294668 1133047125 /nfs/dbraw/zinc/04/71/25/1133047125.db2.gz ONJUDYXXJUPIEV-QUHJONEVSA-N 2 0 345.487 3.956 20 5 EHBDRP CCOc1ccc([C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000866517452 1137360928 /nfs/dbraw/zinc/36/09/28/1137360928.db2.gz ZJWFBEGGHQTAIO-ASFAAARLSA-N 2 0 349.475 3.907 20 5 EHBDRP C[C@@H]([NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000873269072 1137595780 /nfs/dbraw/zinc/59/57/80/1137595780.db2.gz LMONGAQKTNDBAB-FOIQADDNSA-N 2 0 339.439 3.662 20 5 EHBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000415030748 1017429354 /nfs/dbraw/zinc/42/93/54/1017429354.db2.gz GBUICSJKXMPRSO-TZMCWYRMSA-N 2 0 331.441 3.540 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000507442110 1021280112 /nfs/dbraw/zinc/28/01/12/1021280112.db2.gz MXQOEKBMZQKRHC-AEFFLSMTSA-N 2 0 345.487 3.628 20 5 EHBDRP Cc1c(CN2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475453 1023246772 /nfs/dbraw/zinc/24/67/72/1023246772.db2.gz XAKNSKZHOLWYIM-FUHWJXTLSA-N 2 0 345.487 3.990 20 5 EHBDRP CC(C)[N@H+](C)Cc1cccc(CNCc2csc([N+](=O)[O-])c2)c1 ZINC000236666918 1035038383 /nfs/dbraw/zinc/03/83/83/1035038383.db2.gz RREKFKYNVJBVHW-UHFFFAOYSA-N 2 0 333.457 3.786 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CC34CC[NH2+]CC4)s2)cc1 ZINC000591281934 1037320914 /nfs/dbraw/zinc/32/09/14/1037320914.db2.gz XPRZWPKAKOWXMX-QGZVFWFLSA-N 2 0 343.452 3.555 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCC2 ZINC000417328257 1039672444 /nfs/dbraw/zinc/67/24/44/1039672444.db2.gz SFFPXTDINIHVMQ-FRQCXROJSA-N 2 0 329.444 3.579 20 5 EHBDRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000123285503 1040799833 /nfs/dbraw/zinc/79/98/33/1040799833.db2.gz KZKWPOPXTVQVTK-OXJNMPFZSA-N 2 0 345.487 3.770 20 5 EHBDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173351 1040994044 /nfs/dbraw/zinc/99/40/44/1040994044.db2.gz GHBAZFJDXQENIC-RDTXWAMCSA-N 2 0 331.460 3.639 20 5 EHBDRP Cc1ccc(CN2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171372 1043609955 /nfs/dbraw/zinc/60/99/55/1043609955.db2.gz WWVGNJGPMVWXCJ-MJGOQNOKSA-N 2 0 345.487 3.990 20 5 EHBDRP C[N@H+]1CC=C(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000494987435 1120923864 /nfs/dbraw/zinc/92/38/64/1120923864.db2.gz JGRYGNRJCFJAQX-FQEVSTJZSA-N 2 0 337.423 3.536 20 5 EHBDRP CCC[NH+]1CCC(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000122653819 1121117045 /nfs/dbraw/zinc/11/70/45/1121117045.db2.gz NDDCUGYPVKQUFE-LJQANCHMSA-N 2 0 345.487 3.628 20 5 EHBDRP CC1CC[NH+](C[C@@H]2CCCN(Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC000154755318 1129585122 /nfs/dbraw/zinc/58/51/22/1129585122.db2.gz ZKJRZTBMQNSNKY-KRWDZBQOSA-N 2 0 331.460 3.539 20 5 EHBDRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900958 1131884148 /nfs/dbraw/zinc/88/41/48/1131884148.db2.gz HWRZXGJUXDCXJK-APWZRJJASA-N 2 0 345.487 3.696 20 5 EHBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902126 1131885527 /nfs/dbraw/zinc/88/55/27/1131885527.db2.gz VQRNALKJSZXVBS-APWZRJJASA-N 2 0 347.503 3.942 20 5 EHBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000120890232 1137953290 /nfs/dbraw/zinc/95/32/90/1137953290.db2.gz AGIBQCTVKUHHJY-AWEZNQCLSA-N 2 0 345.418 3.955 20 5 EHBDRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000092856916 1138232262 /nfs/dbraw/zinc/23/22/62/1138232262.db2.gz FPVMNRGBHNOOQB-HNNXBMFYSA-N 2 0 340.427 3.557 20 5 EHBDRP CC(C)c1ccc(CN2CC[C@H](C[N@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697212 1032153890 /nfs/dbraw/zinc/15/38/90/1032153890.db2.gz GIRXXFUBWSKOFA-GOSISDBHSA-N 2 0 345.487 3.882 20 5 EHBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000415031561 1017433175 /nfs/dbraw/zinc/43/31/75/1017433175.db2.gz HCNAFCBRNBCKLY-VXGBXAGGSA-N 2 0 349.818 3.725 20 5 EHBDRP O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCCCNc1ccccn1 ZINC000892872486 1017622029 /nfs/dbraw/zinc/62/20/29/1017622029.db2.gz UEZMMJWNUPYVNV-UHFFFAOYSA-N 2 0 334.807 3.625 20 5 EHBDRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000592397468 1032770030 /nfs/dbraw/zinc/77/00/30/1032770030.db2.gz LQKDYFVZYYTCGJ-ZTNFWEORSA-N 2 0 339.439 3.591 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@]4(CC[NH2+]C4)C3)s2)cc1 ZINC000262107567 1019927434 /nfs/dbraw/zinc/92/74/34/1019927434.db2.gz WCNOCIJVANMVRP-SFHVURJKSA-N 2 0 343.452 3.509 20 5 EHBDRP CC(C)(C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C[NH+]1CCCC1 ZINC000477922037 1023571976 /nfs/dbraw/zinc/57/19/76/1023571976.db2.gz YOOKJHMPEMLNAI-GOSISDBHSA-N 2 0 345.487 3.628 20 5 EHBDRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423202079 1028270820 /nfs/dbraw/zinc/27/08/20/1028270820.db2.gz ALHMPRDMDCBAIC-KBPBESRZSA-N 2 0 345.468 3.974 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CN)C1CCCC1 ZINC000423504702 1028468960 /nfs/dbraw/zinc/46/89/60/1028468960.db2.gz NUHVEZGIOZDESX-HUUCEWRRSA-N 2 0 337.489 3.573 20 5 EHBDRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000599071669 1033711999 /nfs/dbraw/zinc/71/19/99/1033711999.db2.gz SFHPGSYSQCZAHC-AOIWGVFYSA-N 2 0 345.487 3.628 20 5 EHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000595102493 1037353927 /nfs/dbraw/zinc/35/39/27/1037353927.db2.gz IXDPSPRPIYKOOL-INIZCTEOSA-N 2 0 345.487 3.628 20 5 EHBDRP CCC[NH+]1CCC(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192826572 1039893788 /nfs/dbraw/zinc/89/37/88/1039893788.db2.gz GAQRSJICOKTIOU-IBGZPJMESA-N 2 0 331.460 3.684 20 5 EHBDRP C[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCCC1 ZINC000556063471 1122800451 /nfs/dbraw/zinc/80/04/51/1122800451.db2.gz HAYGKLLVMPHCNK-BEFAXECRSA-N 2 0 331.460 3.684 20 5 EHBDRP Cc1cc(NC2CC[NH+](CC3CC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000181460686 1124854843 /nfs/dbraw/zinc/85/48/43/1124854843.db2.gz LKRMQKFQNHQGFG-UHFFFAOYSA-N 2 0 340.427 3.738 20 5 EHBDRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444201 1130208701 /nfs/dbraw/zinc/20/87/01/1130208701.db2.gz XUPBLFHDHOYJRW-MAUKXSAKSA-N 2 0 349.475 3.544 20 5 EHBDRP CC[NH+](CC)C1CCC([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173222112 1132004432 /nfs/dbraw/zinc/00/44/32/1132004432.db2.gz ULWHDTRFBSDGGE-FAEJEUNOSA-N 2 0 333.476 3.768 20 5 EHBDRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788538973 1134139768 /nfs/dbraw/zinc/13/97/68/1134139768.db2.gz JAJIHOQDKYHSLF-OAGGEKHMSA-N 2 0 348.491 3.586 20 5 EHBDRP C[C@H]1C[C@@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@@H+]1C ZINC000130639358 1138466160 /nfs/dbraw/zinc/46/61/60/1138466160.db2.gz ORYPXUNXPRKABX-YOEHRIQHSA-N 2 0 343.427 3.769 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449233803 1032328569 /nfs/dbraw/zinc/32/85/69/1032328569.db2.gz NEFQQRHDNBOIIQ-NUJGCVRESA-N 2 0 345.487 3.768 20 5 EHBDRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000414805899 1017207252 /nfs/dbraw/zinc/20/72/52/1017207252.db2.gz BGNKDJZBGZAXOT-GJZGRUSLSA-N 2 0 327.428 3.725 20 5 EHBDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]1 ZINC000414952390 1017352530 /nfs/dbraw/zinc/35/25/30/1017352530.db2.gz QQRGAABWCLIUQZ-JSGCOSHPSA-N 2 0 331.441 3.553 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000415031560 1017432528 /nfs/dbraw/zinc/43/25/28/1017432528.db2.gz HCNAFCBRNBCKLY-RYUDHWBXSA-N 2 0 349.818 3.725 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC[NH2+]C3CC3)s2)cc1 ZINC000415067261 1017496966 /nfs/dbraw/zinc/49/69/66/1017496966.db2.gz KIZSMOGZMRIUML-UHFFFAOYSA-N 2 0 331.441 3.555 20 5 EHBDRP O=[N+]([O-])c1cccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000048562754 1023179896 /nfs/dbraw/zinc/17/98/96/1023179896.db2.gz QNJYQMLLRMJCNM-UHFFFAOYSA-N 2 0 331.460 3.683 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@H]3[NH2+]CC[C@H]3C2)s1 ZINC000427105299 1023217729 /nfs/dbraw/zinc/21/77/29/1023217729.db2.gz XHNPQKXHRIYAGJ-XJKSGUPXSA-N 2 0 343.452 3.507 20 5 EHBDRP C[C@@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371215 1024857581 /nfs/dbraw/zinc/85/75/81/1024857581.db2.gz LYFSNRFNLKWPGL-NEPJUHHUSA-N 2 0 349.818 3.677 20 5 EHBDRP C[C@@H]([NH2+]C1CC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423175433 1028245911 /nfs/dbraw/zinc/24/59/11/1028245911.db2.gz AJIUAFJTEWZBPD-GFCCVEGCSA-N 2 0 331.441 3.726 20 5 EHBDRP O=[N+]([O-])c1cccc([C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2ccccc2)c1 ZINC000423263105 1028300892 /nfs/dbraw/zinc/30/08/92/1028300892.db2.gz WNWHWDVTJMYDIR-UZLBHIALSA-N 2 0 339.439 3.664 20 5 EHBDRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000423289694 1028326392 /nfs/dbraw/zinc/32/63/92/1028326392.db2.gz BONIFYZXZZEDHF-UONOGXRCSA-N 2 0 343.427 3.864 20 5 EHBDRP CCOc1ccc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000421882311 1028885270 /nfs/dbraw/zinc/88/52/70/1028885270.db2.gz RWUOOYBSYSYTBK-JEYLPNPQSA-N 2 0 335.448 3.517 20 5 EHBDRP CC[NH+]1CCC(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192904045 1030015420 /nfs/dbraw/zinc/01/54/20/1030015420.db2.gz JATVVFHWBXHCER-LJQANCHMSA-N 2 0 331.460 3.684 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000595900797 1034026556 /nfs/dbraw/zinc/02/65/56/1034026556.db2.gz LNFMZPAGKPWGCM-NVXWUHKLSA-N 2 0 331.460 3.676 20 5 EHBDRP Cc1c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094861 1034079028 /nfs/dbraw/zinc/07/90/28/1034079028.db2.gz NQWOMVHQIHTQEW-NVXWUHKLSA-N 2 0 331.460 3.676 20 5 EHBDRP Cc1c([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150536 1037623161 /nfs/dbraw/zinc/62/31/61/1037623161.db2.gz FURLWNZUSZQCEC-DLBZAZTESA-N 2 0 333.476 3.922 20 5 EHBDRP CCOc1ccc([C@@H](C)[NH2+]CCC2CC[NH+](CC)CC2)cc1[N+](=O)[O-] ZINC000154011740 1129528214 /nfs/dbraw/zinc/52/82/14/1129528214.db2.gz RWCWKPLNOIWALF-OAHLLOKOSA-N 2 0 349.475 3.766 20 5 EHBDRP Cc1cc(N2CCC[C@@H]([NH+]3CCCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302167186 1129771276 /nfs/dbraw/zinc/77/12/76/1129771276.db2.gz LCXFBKGOJSEKIL-MRXNPFEDSA-N 2 0 340.427 3.516 20 5 EHBDRP CC(C)C[NH+]1CCC([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172901710 1131884579 /nfs/dbraw/zinc/88/45/79/1131884579.db2.gz JLHWSXIPFXNYPE-GOSISDBHSA-N 2 0 345.487 3.552 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCCCC[NH+]1CCCC1)CC2 ZINC001172913168 1131918831 /nfs/dbraw/zinc/91/88/31/1131918831.db2.gz UJRUFRFARRAYBE-LJQANCHMSA-N 2 0 345.487 3.698 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1CC[NH+](CC(C)(C)C)CC1 ZINC001173221183 1132004016 /nfs/dbraw/zinc/00/40/16/1132004016.db2.gz LGBQTMANUSELME-MRXNPFEDSA-N 2 0 347.503 3.874 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173220593 1132004465 /nfs/dbraw/zinc/00/44/65/1132004465.db2.gz DCJDBQFOAVTFQD-QGPMSJSTSA-N 2 0 331.460 3.650 20 5 EHBDRP C[C@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)N1CC[NH+](C)CC1 ZINC000105467023 1135948496 /nfs/dbraw/zinc/94/84/96/1135948496.db2.gz KBMDOFKVVZRDHU-GOSISDBHSA-N 2 0 347.506 3.719 20 5 EHBDRP CCC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cccc([N+](=O)[O-])c1 ZINC000817947750 1136849597 /nfs/dbraw/zinc/84/95/97/1136849597.db2.gz QAUYUMAFPUOJGX-IBGZPJMESA-N 2 0 327.428 3.727 20 5 EHBDRP C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215044 1137008090 /nfs/dbraw/zinc/00/80/90/1137008090.db2.gz VAQWOEPTCNPZRI-OAHLLOKOSA-N 2 0 327.428 3.849 20 5 EHBDRP CC(C)c1ccc(CN2CC[C@@H](C[N@H+](C)CC3CC3)C2)cc1[N+](=O)[O-] ZINC000536697214 1032154366 /nfs/dbraw/zinc/15/43/66/1032154366.db2.gz GIRXXFUBWSKOFA-SFHVURJKSA-N 2 0 345.487 3.882 20 5 EHBDRP [NH3+]CCC[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000415060691 1017489447 /nfs/dbraw/zinc/48/94/47/1017489447.db2.gz XHZLGPVIEADLRL-JGZYNSJSSA-N 2 0 325.412 3.678 20 5 EHBDRP CC[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1[NH3+] ZINC000592427623 1032816792 /nfs/dbraw/zinc/81/67/92/1032816792.db2.gz JFBZSKYVLDHTCJ-CZUORRHYSA-N 2 0 345.468 3.883 20 5 EHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000506851260 1022632196 /nfs/dbraw/zinc/63/21/96/1022632196.db2.gz MYFKNVDAPYAXCU-UHFFFAOYSA-N 2 0 333.476 3.847 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@@H]4[NH2+]CC[C@@H]4C3)s2)cc1 ZINC000427128683 1023237003 /nfs/dbraw/zinc/23/70/03/1023237003.db2.gz OQJAOUIRYFJEKE-PBHICJAKSA-N 2 0 343.452 3.507 20 5 EHBDRP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC[NH2+]CC1 ZINC000435383965 1024869198 /nfs/dbraw/zinc/86/91/98/1024869198.db2.gz KSKSPWDTYZYZQG-UHFFFAOYSA-N 2 0 331.441 3.507 20 5 EHBDRP CCOc1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000423289693 1028325610 /nfs/dbraw/zinc/32/56/10/1028325610.db2.gz BONIFYZXZZEDHF-KGLIPLIRSA-N 2 0 343.427 3.864 20 5 EHBDRP CC1(C)C[C@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c2cc([N+](=O)[O-])ccc21 ZINC000423418350 1028430685 /nfs/dbraw/zinc/43/06/85/1028430685.db2.gz HMEWVRWLFOYFMN-DEYYWGMASA-N 2 0 331.460 3.672 20 5 EHBDRP CCc1ccc([C@@H]([NH2+][C@H](C)CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423438986 1028447039 /nfs/dbraw/zinc/44/70/39/1028447039.db2.gz RWWVTGUBHYVZOG-KUHUBIRLSA-N 2 0 345.443 3.947 20 5 EHBDRP O=[N+]([O-])c1ccccc1CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000483717754 1031296208 /nfs/dbraw/zinc/29/62/08/1031296208.db2.gz YJMBCMWMGFQGJG-UHFFFAOYSA-N 2 0 331.460 3.524 20 5 EHBDRP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000595038402 1033657762 /nfs/dbraw/zinc/65/77/62/1033657762.db2.gz NKMBQONEHSFFEV-OAHLLOKOSA-N 2 0 335.448 3.520 20 5 EHBDRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cccc1[N+](=O)[O-] ZINC000595104221 1033690628 /nfs/dbraw/zinc/69/06/28/1033690628.db2.gz QWTQCKOSYPAUTL-OAHLLOKOSA-N 2 0 331.460 3.676 20 5 EHBDRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1[N+](=O)[O-] ZINC000595103956 1033692373 /nfs/dbraw/zinc/69/23/73/1033692373.db2.gz PMYWWOXXDGPDGC-OAHLLOKOSA-N 2 0 331.460 3.676 20 5 EHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc([N+](=O)[O-])c1C ZINC000609029865 1033984998 /nfs/dbraw/zinc/98/49/98/1033984998.db2.gz XSXMMBZOSLHWAQ-UHFFFAOYSA-N 2 0 341.455 3.987 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000596092475 1034077676 /nfs/dbraw/zinc/07/76/76/1034077676.db2.gz ANXVASDKIBDLBR-OXJNMPFZSA-N 2 0 343.471 3.684 20 5 EHBDRP CC1(C)C[C@@H]([NH2+]Cc2ccc3c[nH+]cn3c2)c2cc([N+](=O)[O-])ccc21 ZINC000414200618 1036023566 /nfs/dbraw/zinc/02/35/66/1036023566.db2.gz ZZPJZBGQCBASDN-GOSISDBHSA-N 2 0 336.395 3.755 20 5 EHBDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309056 1039663677 /nfs/dbraw/zinc/66/36/77/1039663677.db2.gz DFKABBOVOIVWRR-DNVCBOLYSA-N 2 0 331.460 3.684 20 5 EHBDRP O=[N+]([O-])c1ccc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000123128955 1128634107 /nfs/dbraw/zinc/63/41/07/1128634107.db2.gz VLIQBICLGYEBDR-UHFFFAOYSA-N 2 0 331.460 3.524 20 5 EHBDRP Cc1cc(NC[C@H]2CC[N@@H+](C(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000326334686 1121648819 /nfs/dbraw/zinc/64/88/19/1121648819.db2.gz IJIYDXWYDQBPOJ-CQSZACIVSA-N 2 0 328.416 3.594 20 5 EHBDRP C[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCCC1 ZINC000556063479 1122800638 /nfs/dbraw/zinc/80/06/38/1122800638.db2.gz HAYGKLLVMPHCNK-KXBFYZLASA-N 2 0 331.460 3.684 20 5 EHBDRP Cc1c([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cccc1[N+](=O)[O-] ZINC000123655895 1129541243 /nfs/dbraw/zinc/54/12/43/1129541243.db2.gz JAVMWAGMXAPFKF-HNNXBMFYSA-N 2 0 327.428 3.816 20 5 EHBDRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)[C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168998118 1132627370 /nfs/dbraw/zinc/62/73/70/1132627370.db2.gz ILULUGZIBZHFQP-VJANTYMQSA-N 2 0 337.508 3.584 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000468606008 1018017635 /nfs/dbraw/zinc/01/76/35/1018017635.db2.gz DXHPZVAWVQMDLH-MAUBAPBLSA-N 2 0 331.460 3.852 20 5 EHBDRP C[C@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000592397467 1032769800 /nfs/dbraw/zinc/76/98/00/1032769800.db2.gz LQKDYFVZYYTCGJ-CVAIRZPRSA-N 2 0 339.439 3.591 20 5 EHBDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]1 ZINC000414947339 1022970921 /nfs/dbraw/zinc/97/09/21/1022970921.db2.gz KSHWCMUUFSKSCW-CHWSQXEVSA-N 2 0 331.441 3.553 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000420311166 1027455610 /nfs/dbraw/zinc/45/56/10/1027455610.db2.gz GYRRKUNYFUJASP-MDYRTPRTSA-N 2 0 339.439 3.639 20 5 EHBDRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423241085 1028305051 /nfs/dbraw/zinc/30/50/51/1028305051.db2.gz CYCDYVUAKYUWRG-KBPBESRZSA-N 2 0 345.468 3.974 20 5 EHBDRP C[NH+](C)C1CCC([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000421371172 1028329263 /nfs/dbraw/zinc/32/92/63/1028329263.db2.gz KIZBFESAKCKVFL-JYPHPWERSA-N 2 0 345.487 3.768 20 5 EHBDRP Cc1cnccc1OC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278532795 1031261125 /nfs/dbraw/zinc/26/11/25/1031261125.db2.gz FGYQXWMEDMVSDY-HNNXBMFYSA-N 2 0 341.411 3.903 20 5 EHBDRP [NH3+]CC[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000904405542 1032020753 /nfs/dbraw/zinc/02/07/53/1032020753.db2.gz NJMVCYVNBAVRTE-LBPRGKRZSA-N 2 0 349.818 3.679 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](CC3CC3)CC1)CCC2 ZINC000595104281 1033692146 /nfs/dbraw/zinc/69/21/46/1033692146.db2.gz SDUHJCDWCSPSDQ-FQEVSTJZSA-N 2 0 343.471 3.684 20 5 EHBDRP CCC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc([N+](=O)[O-])c1 ZINC000593321508 1034646523 /nfs/dbraw/zinc/64/65/23/1034646523.db2.gz YEYIMXJKOHVLSZ-SFHVURJKSA-N 2 0 331.391 3.824 20 5 EHBDRP CN(Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109833 1037322897 /nfs/dbraw/zinc/32/28/97/1037322897.db2.gz WRKRLLLLXQNTMD-IBGZPJMESA-N 2 0 339.439 3.549 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCn2cc(C)nc21 ZINC000344857161 1044533564 /nfs/dbraw/zinc/53/35/64/1044533564.db2.gz LQMJXTKGTXCPDI-RKCSUWQLSA-N 2 0 340.427 3.670 20 5 EHBDRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000123223558 1128703308 /nfs/dbraw/zinc/70/33/08/1128703308.db2.gz BJJNWBCKALLZMR-OXQOHEQNSA-N 2 0 345.487 3.770 20 5 EHBDRP CC1CC[NH+](C[C@H]2CCCN(Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC000154755405 1129585096 /nfs/dbraw/zinc/58/50/96/1129585096.db2.gz ZKJRZTBMQNSNKY-QGZVFWFLSA-N 2 0 331.460 3.539 20 5 EHBDRP C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CC[NH+](C)CC1 ZINC000132211350 1129882381 /nfs/dbraw/zinc/88/23/81/1129882381.db2.gz LLZPQGIBUYZCSQ-UHFFFAOYSA-N 2 0 343.427 3.628 20 5 EHBDRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173229408 1132007715 /nfs/dbraw/zinc/00/77/15/1132007715.db2.gz ULWHDTRFBSDGGE-NXHRZFHOSA-N 2 0 333.476 3.768 20 5 EHBDRP COc1ccc(C[C@H](C)[NH+]2C(C)(C)CC([NH3+])CC2(C)C)c([N+](=O)[O-])c1 ZINC001170309760 1134754365 /nfs/dbraw/zinc/75/43/65/1134754365.db2.gz SNYSJPQPGHOYQN-ZDUSSCGKSA-N 2 0 349.475 3.515 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000872079459 1137570227 /nfs/dbraw/zinc/57/02/27/1137570227.db2.gz MYLGMJGGZDZBCE-KGLIPLIRSA-N 2 0 337.489 3.699 20 5 EHBDRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000415050589 1017459823 /nfs/dbraw/zinc/45/98/23/1017459823.db2.gz ISGMFVANTPTVAR-QGZVFWFLSA-N 2 0 333.819 3.818 20 5 EHBDRP CCc1ccccc1[C@@H](N)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415070020 1017502261 /nfs/dbraw/zinc/50/22/61/1017502261.db2.gz UEUAZGFSCJSEAB-BEFAXECRSA-N 2 0 341.455 3.768 20 5 EHBDRP C[NH+](C)C1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602697253 1033075694 /nfs/dbraw/zinc/07/56/94/1033075694.db2.gz JMKNKYWFHNPOOP-UHFFFAOYSA-N 2 0 345.365 3.576 20 5 EHBDRP CCOc1ccc([C@H](C)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1[N+](=O)[O-] ZINC000152630267 1026470836 /nfs/dbraw/zinc/47/08/36/1026470836.db2.gz NDVIXQUIKWNNEE-ZDUSSCGKSA-N 2 0 349.475 3.953 20 5 EHBDRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000423036616 1028144713 /nfs/dbraw/zinc/14/47/13/1028144713.db2.gz ATJNWJJHZIOVDD-HZPDHXFCSA-N 2 0 331.803 3.525 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000572887070 1028196884 /nfs/dbraw/zinc/19/68/84/1028196884.db2.gz JIYGWDOIXGOULX-UIRWJGRMSA-N 2 0 343.471 3.662 20 5 EHBDRP CCOc1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000423289692 1028327372 /nfs/dbraw/zinc/32/73/72/1028327372.db2.gz BONIFYZXZZEDHF-KBPBESRZSA-N 2 0 343.427 3.864 20 5 EHBDRP CC1(C)C[C@@H]([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c2cc([N+](=O)[O-])ccc21 ZINC000423418354 1028429974 /nfs/dbraw/zinc/42/99/74/1028429974.db2.gz HMEWVRWLFOYFMN-HBUWYVDXSA-N 2 0 331.460 3.672 20 5 EHBDRP CCc1ccc([C@H]([NH2+][C@H](C)CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423438984 1028446626 /nfs/dbraw/zinc/44/66/26/1028446626.db2.gz RWWVTGUBHYVZOG-AUUYWEPGSA-N 2 0 345.443 3.947 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423469607 1028456119 /nfs/dbraw/zinc/45/61/19/1028456119.db2.gz CUZDJXLVIAKQLR-HUUCEWRRSA-N 2 0 337.489 3.587 20 5 EHBDRP C[NH+](C)C1CCC([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000421879014 1028884322 /nfs/dbraw/zinc/88/43/22/1028884322.db2.gz OFMAPHIIDXOEAH-JRSKDTKFSA-N 2 0 331.460 3.780 20 5 EHBDRP CC1(C)CC([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC(C)(C)[NH2+]1 ZINC000192613501 1030767031 /nfs/dbraw/zinc/76/70/31/1030767031.db2.gz CWPLJUAUSIJMLX-QGZVFWFLSA-N 2 0 331.460 3.871 20 5 EHBDRP CC[N@H+](CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1)CC1CC1 ZINC000536142398 1030919783 /nfs/dbraw/zinc/91/97/83/1030919783.db2.gz WBXQAKPHLCORIL-UHFFFAOYSA-N 2 0 345.487 3.929 20 5 EHBDRP CC[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595102722 1033690607 /nfs/dbraw/zinc/69/06/07/1033690607.db2.gz JFYUXZRRUJQCHH-LJQANCHMSA-N 2 0 331.460 3.758 20 5 EHBDRP CCC[C@H]([NH2+]Cc1ccccc1C[NH2+]C)c1cccc([N+](=O)[O-])c1 ZINC000593322524 1034645282 /nfs/dbraw/zinc/64/52/82/1034645282.db2.gz NZKXXINEOUKYPY-IBGZPJMESA-N 2 0 327.428 3.945 20 5 EHBDRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898093 1131882717 /nfs/dbraw/zinc/88/27/17/1131882717.db2.gz GLFZXTSBNDPMNM-KRWDZBQOSA-N 2 0 345.487 3.823 20 5 EHBDRP CC(C)N(CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)C ZINC001172896659 1131901351 /nfs/dbraw/zinc/90/13/51/1131901351.db2.gz QLQWZNACYQPRQC-SFHVURJKSA-N 2 0 333.476 3.551 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173226147 1132006774 /nfs/dbraw/zinc/00/67/74/1132006774.db2.gz VBIXJVSMUJPJNL-ZTFGCOKTSA-N 2 0 331.460 3.508 20 5 EHBDRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173229409 1132007571 /nfs/dbraw/zinc/00/75/71/1132007571.db2.gz ULWHDTRFBSDGGE-RYQLBKOJSA-N 2 0 333.476 3.768 20 5 EHBDRP COc1ccc(C[C@@H](C)[N@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170322374 1134747783 /nfs/dbraw/zinc/74/77/83/1134747783.db2.gz FHTKAAKEZQGDQD-DJIMGWMZSA-N 2 0 349.475 3.515 20 5 EHBDRP O=[N+]([O-])c1ccc(C[NH2+]CCCCC[NH+]2CCCC2)cc1Cl ZINC000816644244 1136743905 /nfs/dbraw/zinc/74/39/05/1136743905.db2.gz GQVFHPNMGLMYFM-UHFFFAOYSA-N 2 0 325.840 3.604 20 5 EHBDRP CC1(C)[NH2+]CC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000415039974 1017444186 /nfs/dbraw/zinc/44/41/86/1017444186.db2.gz NVTQXQHCQWFZRK-INIZCTEOSA-N 2 0 331.441 3.553 20 5 EHBDRP O[C@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)C[NH+]1CCCC1 ZINC000051188021 1021624897 /nfs/dbraw/zinc/62/48/97/1021624897.db2.gz BLNJQFIGBPZFFT-LJQANCHMSA-N 2 0 334.463 3.539 20 5 EHBDRP Cc1cc(N2CC[C@H]([NH+]3CCCCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543975442 1024452646 /nfs/dbraw/zinc/45/26/46/1024452646.db2.gz OSPLZUGVRGNHDA-INIZCTEOSA-N 2 0 340.427 3.516 20 5 EHBDRP CCC[NH+]1CCC(Nc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000302164782 1026351617 /nfs/dbraw/zinc/35/16/17/1026351617.db2.gz KPXCHZHGCWAQOG-UHFFFAOYSA-N 2 0 328.416 3.738 20 5 EHBDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587022 1030321490 /nfs/dbraw/zinc/32/14/90/1030321490.db2.gz PWWBJURSHFAEKY-JXFKEZNVSA-N 2 0 345.487 3.930 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCCC[NH+]1CCCC1)CCC2 ZINC000340478020 1031025403 /nfs/dbraw/zinc/02/54/03/1031025403.db2.gz YNNOLZCZGYZSBY-LJQANCHMSA-N 2 0 331.460 3.828 20 5 EHBDRP O=[N+]([O-])c1cccc([C@@H]([NH2+]CCC2CC[NH2+]CC2)c2ccccc2)c1 ZINC000593321297 1034642939 /nfs/dbraw/zinc/64/29/39/1034642939.db2.gz HUOBUNIOSHBMOI-FQEVSTJZSA-N 2 0 339.439 3.664 20 5 EHBDRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000153592022 1128486151 /nfs/dbraw/zinc/48/61/51/1128486151.db2.gz KEGAUACTEVIIBU-OAHLLOKOSA-N 2 0 349.475 3.766 20 5 EHBDRP C[C@@H](CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCCC1 ZINC000543416020 1129475312 /nfs/dbraw/zinc/47/53/12/1129475312.db2.gz ICHLUNSTOGDQEH-QFBILLFUSA-N 2 0 345.487 3.770 20 5 EHBDRP [NH3+]CCC[N@H+](C1CCCCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899942 1131883841 /nfs/dbraw/zinc/88/38/41/1131883841.db2.gz QESPRYUDPBOKSC-LJQANCHMSA-N 2 0 345.487 3.826 20 5 EHBDRP [NH3+]CCC[C@@H]1CCCC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172904907 1131885970 /nfs/dbraw/zinc/88/59/70/1131885970.db2.gz GUDRRTXDURNVHV-LPHOPBHVSA-N 2 0 345.487 3.683 20 5 EHBDRP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000866517630 1137361102 /nfs/dbraw/zinc/36/11/02/1137361102.db2.gz KVKFNIFAUGDBAT-WRSVWVKZSA-N 2 0 335.448 3.517 20 5 EHBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCCCC12CC[NH2+]CC2 ZINC000873232750 1137594709 /nfs/dbraw/zinc/59/47/09/1137594709.db2.gz KLXWYCYHKLOKKA-SUQGKYDKSA-N 2 0 329.444 3.510 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873265005 1137595720 /nfs/dbraw/zinc/59/57/20/1137595720.db2.gz SEUQWJUGDNSUJT-JONQDZQNSA-N 2 0 349.500 3.586 20 5 EHBDRP C[C@H]([NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000873271894 1137595975 /nfs/dbraw/zinc/59/59/75/1137595975.db2.gz LMONGAQKTNDBAB-MGPUTAFESA-N 2 0 339.439 3.662 20 5 EHBDRP Cc1cc(N2CCC(C)([NH+]3CCC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000882963614 1137839935 /nfs/dbraw/zinc/83/99/35/1137839935.db2.gz DOCNPLSKMJJOEJ-UHFFFAOYSA-N 2 0 340.427 3.516 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@H]3CCC[NH2+]C3)s2)cc1 ZINC000414844077 1017234559 /nfs/dbraw/zinc/23/45/59/1017234559.db2.gz QYWTUNPFNOHSQW-CQSZACIVSA-N 2 0 345.468 3.803 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449233804 1032329211 /nfs/dbraw/zinc/32/92/11/1032329211.db2.gz NEFQQRHDNBOIIQ-RYRKJORJSA-N 2 0 345.487 3.768 20 5 EHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000052210063 1018869348 /nfs/dbraw/zinc/86/93/48/1018869348.db2.gz NWHRBBXVSSQNDU-UHFFFAOYSA-N 2 0 349.475 3.547 20 5 EHBDRP C[C@@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000261918143 1019717021 /nfs/dbraw/zinc/71/70/21/1019717021.db2.gz YIXNMTQWACCGRF-KRWDZBQOSA-N 2 0 349.818 3.679 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000507442115 1021279240 /nfs/dbraw/zinc/27/92/40/1021279240.db2.gz MXQOEKBMZQKRHC-WMZOPIPTSA-N 2 0 345.487 3.628 20 5 EHBDRP C[NH2+]CCC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000469846308 1024125261 /nfs/dbraw/zinc/12/52/61/1024125261.db2.gz KBAJYRFLKARDIU-UHFFFAOYSA-N 2 0 343.427 3.676 20 5 EHBDRP CCc1ccc([C@H]([NH2+]C2CCC([NH3+])CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423229142 1028292695 /nfs/dbraw/zinc/29/26/95/1028292695.db2.gz GMJHLLOOEWITMS-JFIBYHEFSA-N 2 0 343.427 3.699 20 5 EHBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000594508200 1033391231 /nfs/dbraw/zinc/39/12/31/1033391231.db2.gz BSUFLYMETKMLJU-UIAACRFSSA-N 2 0 339.439 3.614 20 5 EHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000595102708 1033691739 /nfs/dbraw/zinc/69/17/39/1033691739.db2.gz IXDPSPRPIYKOOL-MRXNPFEDSA-N 2 0 345.487 3.628 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595900214 1034026784 /nfs/dbraw/zinc/02/67/84/1034026784.db2.gz BERHXONURATMNX-WBVHZDCISA-N 2 0 331.460 3.676 20 5 EHBDRP [NH3+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000576227074 1041365763 /nfs/dbraw/zinc/36/57/63/1041365763.db2.gz GSCNENRNBSEPOP-GFCCVEGCSA-N 2 0 349.818 3.679 20 5 EHBDRP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272200551 1120561491 /nfs/dbraw/zinc/56/14/91/1120561491.db2.gz OLHZXCQAFXQZPP-QFBILLFUSA-N 2 0 339.439 3.595 20 5 EHBDRP CC[NH+](CC)C1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172918201 1131904128 /nfs/dbraw/zinc/90/41/28/1131904128.db2.gz YXVJFGYUSACLML-GOSISDBHSA-N 2 0 345.487 3.648 20 5 EHBDRP CCCC[NH+]1CCC(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173219596 1132003524 /nfs/dbraw/zinc/00/35/24/1132003524.db2.gz DSMSHCDFSYLIJJ-INIZCTEOSA-N 2 0 333.476 3.628 20 5 EHBDRP CCCC[NH+]1CCC([N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238744 1132027234 /nfs/dbraw/zinc/02/72/34/1132027234.db2.gz XFENHIRWJCVSFV-INIZCTEOSA-N 2 0 333.476 3.722 20 5 EHBDRP CC[NH+]1CCC(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001181880410 1133545547 /nfs/dbraw/zinc/54/55/47/1133545547.db2.gz VKIGIWXCYRYBES-GOSISDBHSA-N 2 0 331.460 3.506 20 5 EHBDRP Cc1c(C[N@H+](CC(C)C)CC2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC001197194479 1135657842 /nfs/dbraw/zinc/65/78/42/1135657842.db2.gz NBGYLADKVGWCHG-UHFFFAOYSA-N 2 0 333.476 3.703 20 5 EHBDRP C[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815586686 1136615070 /nfs/dbraw/zinc/61/50/70/1136615070.db2.gz OUVMETPGCSUMBK-ODIFPOPNSA-N 2 0 346.475 3.625 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000872079461 1137570173 /nfs/dbraw/zinc/57/01/73/1137570173.db2.gz MYLGMJGGZDZBCE-ZIAGYGMSSA-N 2 0 337.489 3.699 20 5 EHBDRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414974010 1017365212 /nfs/dbraw/zinc/36/52/12/1017365212.db2.gz NJWMUQGEAKZSIS-QGZVFWFLSA-N 2 0 345.468 3.801 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000415030746 1017430584 /nfs/dbraw/zinc/43/05/84/1017430584.db2.gz GBUICSJKXMPRSO-JSGCOSHPSA-N 2 0 331.441 3.540 20 5 EHBDRP [NH3+][C@H]1C[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000422915001 1028049831 /nfs/dbraw/zinc/04/98/31/1028049831.db2.gz AFEQBXDCYLHTAI-OALUTQOASA-N 2 0 325.412 3.652 20 5 EHBDRP CC1(C)C[C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2cc([N+](=O)[O-])ccc21 ZINC000423385993 1028402462 /nfs/dbraw/zinc/40/24/62/1028402462.db2.gz LPWAWQCAJMCWTI-LJQANCHMSA-N 2 0 337.423 3.710 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423469895 1028455002 /nfs/dbraw/zinc/45/50/02/1028455002.db2.gz LBUFAMQHTPZJIL-RRFJBIMHSA-N 2 0 337.489 3.573 20 5 EHBDRP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCC[NH2+]CC1 ZINC000414749165 1028495867 /nfs/dbraw/zinc/49/58/67/1028495867.db2.gz JYCTVCOWNKMGRM-OAHLLOKOSA-N 2 0 345.468 3.897 20 5 EHBDRP O=[N+]([O-])c1cccc([C@@H]([NH2+]CCC2=CC[NH2+]CC2)c2ccccc2)c1 ZINC000423546572 1028510377 /nfs/dbraw/zinc/51/03/77/1028510377.db2.gz ZBYCBNUNVCNSFB-FQEVSTJZSA-N 2 0 337.423 3.584 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000504926266 1029072478 /nfs/dbraw/zinc/07/24/78/1029072478.db2.gz HEYVYOIKRBTDGY-OAGGEKHMSA-N 2 0 349.500 3.682 20 5 EHBDRP [NH3+]CC[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000904405541 1032020433 /nfs/dbraw/zinc/02/04/33/1032020433.db2.gz NJMVCYVNBAVRTE-GFCCVEGCSA-N 2 0 349.818 3.679 20 5 EHBDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192831026 1040047331 /nfs/dbraw/zinc/04/73/31/1040047331.db2.gz UERRIUXWVZNHJE-HNAYVOBHSA-N 2 0 331.460 3.682 20 5 EHBDRP Cc1ccc(CN2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171373 1043610383 /nfs/dbraw/zinc/61/03/83/1043610383.db2.gz WWVGNJGPMVWXCJ-PKOBYXMFSA-N 2 0 345.487 3.990 20 5 EHBDRP C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C[NH+]1CCCCC1 ZINC000480901981 1120346903 /nfs/dbraw/zinc/34/69/03/1120346903.db2.gz UVIYWUKQCGIIAU-VQIMIIECSA-N 2 0 345.487 3.628 20 5 EHBDRP CC[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000175051581 1130400054 /nfs/dbraw/zinc/40/00/54/1130400054.db2.gz XRTFHQFLJXEWBJ-IBGZPJMESA-N 2 0 327.428 3.897 20 5 EHBDRP CC(C)[NH+]1CCC(C[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173228373 1132007842 /nfs/dbraw/zinc/00/78/42/1132007842.db2.gz VRWHKWQQZQSOAG-INIZCTEOSA-N 2 0 333.476 3.578 20 5 EHBDRP Cc1ccc(C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001168997178 1132627404 /nfs/dbraw/zinc/62/74/04/1132627404.db2.gz BVQVQDKQMNEPSY-UAFMIMERSA-N 2 0 345.487 3.512 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC001183257372 1133786402 /nfs/dbraw/zinc/78/64/02/1133786402.db2.gz YZLWJLXCNWMEGM-VKAVYKQESA-N 2 0 343.471 3.806 20 5 EHBDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000102423192 1135550667 /nfs/dbraw/zinc/55/06/67/1135550667.db2.gz CKXRLBMWKZJGNO-AWEZNQCLSA-N 2 0 345.468 3.755 20 5 EHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000866516266 1137360717 /nfs/dbraw/zinc/36/07/17/1137360717.db2.gz NWGUHEBJBHPRNL-DMKPSLHHSA-N 2 0 333.476 3.768 20 5 EHBDRP C[NH+](C)CCCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000263828229 1138375957 /nfs/dbraw/zinc/37/59/57/1138375957.db2.gz UDRYKILVYBMXPI-UHFFFAOYSA-N 2 0 333.457 3.755 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000449082277 1032173979 /nfs/dbraw/zinc/17/39/79/1032173979.db2.gz MDCYZVZSRODXPK-IAGOWNOFSA-N 2 0 333.476 3.628 20 5 EHBDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000459727988 1032433329 /nfs/dbraw/zinc/43/33/29/1032433329.db2.gz HWNZNTORTDNIQH-HNNXBMFYSA-N 2 0 343.427 3.676 20 5 EHBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000414930669 1017326100 /nfs/dbraw/zinc/32/61/00/1017326100.db2.gz TXVKHLAYCHGIDX-NWDGAFQWSA-N 2 0 349.818 3.868 20 5 EHBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000415017271 1017402177 /nfs/dbraw/zinc/40/21/77/1017402177.db2.gz RXCGIXNYQXKTSS-CYBMUJFWSA-N 2 0 333.457 3.930 20 5 EHBDRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423350394 1028382645 /nfs/dbraw/zinc/38/26/45/1028382645.db2.gz ZGHZQQMMTAQPFF-CYBMUJFWSA-N 2 0 343.452 3.894 20 5 EHBDRP C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCC[NH2+]CC1 ZINC000414749164 1028495886 /nfs/dbraw/zinc/49/58/86/1028495886.db2.gz JYCTVCOWNKMGRM-HNNXBMFYSA-N 2 0 345.468 3.897 20 5 EHBDRP CCOc1ccc([C@@H](C)NCCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504894987 1029040763 /nfs/dbraw/zinc/04/07/63/1029040763.db2.gz PXPUHKBCKIBBHX-JKSUJKDBSA-N 2 0 349.475 3.909 20 5 EHBDRP [NH3+]C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCC1 ZINC000594738118 1033510084 /nfs/dbraw/zinc/51/00/84/1033510084.db2.gz IAJQHUZKSXPTSR-UHFFFAOYSA-N 2 0 331.441 3.684 20 5 EHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596096624 1034077941 /nfs/dbraw/zinc/07/79/41/1034077941.db2.gz VMEDWXJMCQELRH-WMZOPIPTSA-N 2 0 345.487 3.628 20 5 EHBDRP C[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[NH+](C)C ZINC000491599682 1037578718 /nfs/dbraw/zinc/57/87/18/1037578718.db2.gz UHHGDNNIRCIVKR-ZDUSSCGKSA-N 2 0 333.457 3.611 20 5 EHBDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000175060298 1039150785 /nfs/dbraw/zinc/15/07/85/1039150785.db2.gz NNZDCWCPMVPHLB-HNNXBMFYSA-N 2 0 327.428 3.816 20 5 EHBDRP Cc1nccn1C[C@@H](C)C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314608 1039669918 /nfs/dbraw/zinc/66/99/18/1039669918.db2.gz RMKMAWOBCIGZOC-LIRRHRJNSA-N 2 0 342.443 3.793 20 5 EHBDRP [NH2+]=C(Nc1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)SCC[NH3+] ZINC001167915688 1040339673 /nfs/dbraw/zinc/33/96/73/1040339673.db2.gz WVWLCPQOKVSFOF-UHFFFAOYSA-N 2 0 348.453 3.785 20 5 EHBDRP [NH3+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000576227075 1041365800 /nfs/dbraw/zinc/36/58/00/1041365800.db2.gz GSCNENRNBSEPOP-LBPRGKRZSA-N 2 0 349.818 3.679 20 5 EHBDRP C[C@H](NCc1csc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272245305 1121133291 /nfs/dbraw/zinc/13/32/91/1121133291.db2.gz XDIIOAJLVWRAAS-YOEHRIQHSA-N 2 0 345.468 3.657 20 5 EHBDRP CC1([NH+]2CCC2)CCC([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000922848355 1129690807 /nfs/dbraw/zinc/69/08/07/1129690807.db2.gz SCPZYIPINQYJPF-QPJJXVBHSA-N 2 0 329.444 3.605 20 5 EHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[N@H+]1CCCC[C@H]1C ZINC001199336662 1135896040 /nfs/dbraw/zinc/89/60/40/1135896040.db2.gz UVWHQIQTQPTJJA-MRXNPFEDSA-N 2 0 333.476 3.956 20 5 EHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[N@H+]1CCCC[C@@H]1C ZINC001199336661 1135896115 /nfs/dbraw/zinc/89/61/15/1135896115.db2.gz UVWHQIQTQPTJJA-INIZCTEOSA-N 2 0 333.476 3.956 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000872059246 1137568743 /nfs/dbraw/zinc/56/87/43/1137568743.db2.gz CAFFKZNHYHHFGI-CYBMUJFWSA-N 2 0 337.489 3.699 20 5 EHBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414996525 1017377854 /nfs/dbraw/zinc/37/78/54/1017377854.db2.gz GLEXJJBMZJEOLN-UKRRQHHQSA-N 2 0 345.468 3.930 20 5 EHBDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000415030745 1017429420 /nfs/dbraw/zinc/42/94/20/1017429420.db2.gz GBUICSJKXMPRSO-GXTWGEPZSA-N 2 0 331.441 3.540 20 5 EHBDRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479918888 1026884490 /nfs/dbraw/zinc/88/44/90/1026884490.db2.gz WICPTAHVWFSSIU-VQIMIIECSA-N 2 0 345.487 3.770 20 5 EHBDRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423202080 1028269012 /nfs/dbraw/zinc/26/90/12/1028269012.db2.gz ALHMPRDMDCBAIC-KGLIPLIRSA-N 2 0 345.468 3.974 20 5 EHBDRP CCC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc([N+](=O)[O-])c1 ZINC000423361391 1028389943 /nfs/dbraw/zinc/38/99/43/1028389943.db2.gz RXHXAAKPXVFVRW-LJQANCHMSA-N 2 0 325.412 3.829 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423507638 1028471776 /nfs/dbraw/zinc/47/17/76/1028471776.db2.gz JXIZMKXHUKPUSI-MAUKXSAKSA-N 2 0 327.428 3.596 20 5 EHBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000594508199 1033391372 /nfs/dbraw/zinc/39/13/72/1033391372.db2.gz BSUFLYMETKMLJU-BEVDRBHNSA-N 2 0 339.439 3.614 20 5 EHBDRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068690 1033709270 /nfs/dbraw/zinc/70/92/70/1033709270.db2.gz CJHMXCIVKJMZTQ-KBXCAEBGSA-N 2 0 331.460 3.639 20 5 EHBDRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000599071670 1033711860 /nfs/dbraw/zinc/71/18/60/1033711860.db2.gz SFHPGSYSQCZAHC-LMMKCTJWSA-N 2 0 345.487 3.628 20 5 EHBDRP [NH3+]CC1(CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000593315727 1034634308 /nfs/dbraw/zinc/63/43/08/1034634308.db2.gz LGVRJIBHFOHAOG-UHFFFAOYSA-N 2 0 331.441 3.542 20 5 EHBDRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000571642414 1035578624 /nfs/dbraw/zinc/57/86/24/1035578624.db2.gz NPSDMDOCVUUESQ-MJGOQNOKSA-N 2 0 339.439 3.555 20 5 EHBDRP CC1(C)C[C@H](N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170623 1040961955 /nfs/dbraw/zinc/96/19/55/1040961955.db2.gz YGOJIYJMFHWIAY-IYOUNJFTSA-N 2 0 329.444 3.534 20 5 EHBDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173349 1040990999 /nfs/dbraw/zinc/99/09/99/1040990999.db2.gz GHBAZFJDXQENIC-KDOFPFPSSA-N 2 0 331.460 3.639 20 5 EHBDRP CCC[NH+]1CCC(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000122653656 1121117536 /nfs/dbraw/zinc/11/75/36/1121117536.db2.gz NDDCUGYPVKQUFE-IBGZPJMESA-N 2 0 345.487 3.628 20 5 EHBDRP CCC[N@@H+]1CC[C@@H](CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000302207310 1129772872 /nfs/dbraw/zinc/77/28/72/1129772872.db2.gz XJHPIQVARRZXLT-AWEZNQCLSA-N 2 0 328.416 3.595 20 5 EHBDRP CC[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000175051599 1130400212 /nfs/dbraw/zinc/40/02/12/1130400212.db2.gz XRTFHQFLJXEWBJ-LJQANCHMSA-N 2 0 327.428 3.897 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000872068804 1137569460 /nfs/dbraw/zinc/56/94/60/1137569460.db2.gz ZTPSEJBLLOPQFU-CYBMUJFWSA-N 2 0 349.500 3.842 20 5 EHBDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000246922508 1016083715 /nfs/dbraw/zinc/08/37/15/1016083715.db2.gz GOCYNTSAKDXIKP-VQIMIIECSA-N 2 0 345.487 3.626 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@H]3CC[NH2+]C3)o2)c(Cl)c1 ZINC000414834821 1017224957 /nfs/dbraw/zinc/22/49/57/1017224957.db2.gz QXVGRQVVVQXGAP-GFCCVEGCSA-N 2 0 349.818 3.597 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000468629503 1018530611 /nfs/dbraw/zinc/53/06/11/1018530611.db2.gz FDXSLNZJHGEFJZ-GANRHZMWSA-N 2 0 331.460 3.708 20 5 EHBDRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188760 1020546337 /nfs/dbraw/zinc/54/63/37/1020546337.db2.gz DKNFGLYDYGIMST-HLLBOEOZSA-N 2 0 331.460 3.898 20 5 EHBDRP CC[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000178038995 1021026742 /nfs/dbraw/zinc/02/67/42/1021026742.db2.gz LOUPBUDTVBBJBF-FCEWJHQRSA-N 2 0 349.475 3.525 20 5 EHBDRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414999199 1021467087 /nfs/dbraw/zinc/46/70/87/1021467087.db2.gz JBBACTZXKDXSCI-KBPBESRZSA-N 2 0 345.468 3.930 20 5 EHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000507123226 1023141571 /nfs/dbraw/zinc/14/15/71/1023141571.db2.gz XPNXBRFISFVFMN-UHFFFAOYSA-N 2 0 327.428 3.679 20 5 EHBDRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000423296148 1028355501 /nfs/dbraw/zinc/35/55/01/1028355501.db2.gz YJSKJBKSDTXAOL-ORAYPTAESA-N 2 0 325.412 3.782 20 5 EHBDRP C[N@H+](CCCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000453390729 1030233241 /nfs/dbraw/zinc/23/32/41/1030233241.db2.gz DIKWEKDPCBEZPB-GOSISDBHSA-N 2 0 331.460 3.781 20 5 EHBDRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095283 1034077742 /nfs/dbraw/zinc/07/77/42/1034077742.db2.gz OOSGJCXCQWEPIK-VQIMIIECSA-N 2 0 331.460 3.758 20 5 EHBDRP C[C@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000592395493 1037938695 /nfs/dbraw/zinc/93/86/95/1037938695.db2.gz CLFCZSMZUUSPLT-CVAIRZPRSA-N 2 0 339.439 3.591 20 5 EHBDRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417358005 1039718184 /nfs/dbraw/zinc/71/81/84/1039718184.db2.gz HIUQUHHQQKWJLM-HNAYVOBHSA-N 2 0 331.460 3.684 20 5 EHBDRP C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272200550 1120561514 /nfs/dbraw/zinc/56/15/14/1120561514.db2.gz OLHZXCQAFXQZPP-LPHOPBHVSA-N 2 0 339.439 3.595 20 5 EHBDRP CCC(CC)[NH+]1CCC([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173220826 1132004098 /nfs/dbraw/zinc/00/40/98/1132004098.db2.gz HCMYWBZEHNUSIP-HNNXBMFYSA-N 2 0 333.476 3.768 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C1CCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173220594 1132004190 /nfs/dbraw/zinc/00/41/90/1132004190.db2.gz DCJDBQFOAVTFQD-ZVZYQTTQSA-N 2 0 331.460 3.650 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001173232843 1132010885 /nfs/dbraw/zinc/01/08/85/1132010885.db2.gz IFTUMZWMXFCADK-VDGAXYAQSA-N 2 0 345.487 3.865 20 5 EHBDRP Cc1ccc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000809738819 1135883375 /nfs/dbraw/zinc/88/33/75/1135883375.db2.gz LJNKLVUDCWFITO-UHFFFAOYSA-N 2 0 327.428 3.597 20 5 EHBDRP C[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000105458876 1135948040 /nfs/dbraw/zinc/94/80/40/1135948040.db2.gz HPZYGTCHHLUAHZ-UHFFFAOYSA-N 2 0 345.468 3.755 20 5 EHBDRP O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)cc1Cl ZINC000873232324 1137594590 /nfs/dbraw/zinc/59/45/90/1137594590.db2.gz FHOSMTSCNRNLMF-INIZCTEOSA-N 2 0 337.851 3.650 20 5 EHBDRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000873255328 1137595488 /nfs/dbraw/zinc/59/54/88/1137595488.db2.gz GJCIKYFGQSGZRC-RWMBFGLXSA-N 2 0 331.441 3.711 20 5 EHBDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000120890084 1137953316 /nfs/dbraw/zinc/95/33/16/1137953316.db2.gz AGIBQCTVKUHHJY-CQSZACIVSA-N 2 0 345.418 3.955 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000449084113 1032139162 /nfs/dbraw/zinc/13/91/62/1032139162.db2.gz WPPJGDBYFZTHER-DLBZAZTESA-N 2 0 333.476 3.770 20 5 EHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415054954 1017478948 /nfs/dbraw/zinc/47/89/48/1017478948.db2.gz OFPDOIMPOXZVKW-APWZRJJASA-N 2 0 341.455 3.986 20 5 EHBDRP CC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1[NH3+] ZINC000592427621 1032816514 /nfs/dbraw/zinc/81/65/14/1032816514.db2.gz JFBZSKYVLDHTCJ-BBRMVZONSA-N 2 0 345.468 3.883 20 5 EHBDRP C[NH+](C)CC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000506911243 1022998535 /nfs/dbraw/zinc/99/85/35/1022998535.db2.gz WLRJJQWEVHUUJC-UHFFFAOYSA-N 2 0 343.427 3.628 20 5 EHBDRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000108427961 1023125844 /nfs/dbraw/zinc/12/58/44/1023125844.db2.gz NITYVFKZEREGIY-AWEZNQCLSA-N 2 0 345.468 3.755 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@H]4[NH2+]CC[C@@H]4C3)s2)cc1 ZINC000427128684 1023236694 /nfs/dbraw/zinc/23/66/94/1023236694.db2.gz OQJAOUIRYFJEKE-RHSMWYFYSA-N 2 0 343.452 3.507 20 5 EHBDRP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479918886 1026884379 /nfs/dbraw/zinc/88/43/79/1026884379.db2.gz WICPTAHVWFSSIU-LPHOPBHVSA-N 2 0 345.487 3.770 20 5 EHBDRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423202081 1028269857 /nfs/dbraw/zinc/26/98/57/1028269857.db2.gz ALHMPRDMDCBAIC-UONOGXRCSA-N 2 0 345.468 3.974 20 5 EHBDRP CCC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc([N+](=O)[O-])c1 ZINC000423361386 1028390293 /nfs/dbraw/zinc/39/02/93/1028390293.db2.gz RXHXAAKPXVFVRW-IBGZPJMESA-N 2 0 325.412 3.829 20 5 EHBDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423398888 1028413186 /nfs/dbraw/zinc/41/31/86/1028413186.db2.gz PDHVOOPINYJCKS-VNHYZAJKSA-N 2 0 345.468 3.972 20 5 EHBDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000442931118 1036741467 /nfs/dbraw/zinc/74/14/67/1036741467.db2.gz VCOPYSWMYBAUFL-CQSZACIVSA-N 2 0 345.468 3.884 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@H]3C1)CCCC2 ZINC000417328266 1039671085 /nfs/dbraw/zinc/67/10/85/1039671085.db2.gz SFFPXTDINIHVMQ-TXPKVOOTSA-N 2 0 329.444 3.579 20 5 EHBDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000566474628 1039768803 /nfs/dbraw/zinc/76/88/03/1039768803.db2.gz IDQPXRFVRWWLAH-CRAIPNDOSA-N 2 0 331.460 3.540 20 5 EHBDRP CC1CC[NH+](CCC[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172899247 1131882851 /nfs/dbraw/zinc/88/28/51/1131882851.db2.gz NAIKVZVTJJJGLW-LJQANCHMSA-N 2 0 345.487 3.554 20 5 EHBDRP CCCC[N@H+](C)CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899945 1131883815 /nfs/dbraw/zinc/88/38/15/1131883815.db2.gz QHZTZQNEJMBRMW-SFHVURJKSA-N 2 0 333.476 3.554 20 5 EHBDRP CCCC[NH+]1CCC(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173219597 1132002928 /nfs/dbraw/zinc/00/29/28/1132002928.db2.gz DSMSHCDFSYLIJJ-MRXNPFEDSA-N 2 0 333.476 3.628 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1CC[NH+](CC2CCC2)CC1 ZINC001173221523 1132004490 /nfs/dbraw/zinc/00/44/90/1132004490.db2.gz NRJIHROWEDVUGA-MRXNPFEDSA-N 2 0 345.487 3.628 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001173232838 1132010252 /nfs/dbraw/zinc/01/02/52/1132010252.db2.gz IFTUMZWMXFCADK-FFZOFVMBSA-N 2 0 345.487 3.865 20 5 EHBDRP C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1CCC[NH3+] ZINC000852759443 1136483967 /nfs/dbraw/zinc/48/39/67/1136483967.db2.gz OXWZESIHGMNFET-MLGOLLRUSA-N 2 0 325.840 3.588 20 5 EHBDRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000815586497 1136615213 /nfs/dbraw/zinc/61/52/13/1136615213.db2.gz KEKYFGRZROEWLH-OAHLLOKOSA-N 2 0 348.491 3.586 20 5 EHBDRP CCCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866250203 1137339133 /nfs/dbraw/zinc/33/91/33/1137339133.db2.gz WIGLTAGFASOXMK-AWEZNQCLSA-N 2 0 337.439 3.519 20 5 EHBDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1 ZINC000872034009 1137566652 /nfs/dbraw/zinc/56/66/52/1137566652.db2.gz KYDBAUKLGPAZET-ZDUSSCGKSA-N 2 0 337.489 3.699 20 5 EHBDRP C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000873269073 1137595759 /nfs/dbraw/zinc/59/57/59/1137595759.db2.gz LMONGAQKTNDBAB-QRWLVFNGSA-N 2 0 339.439 3.662 20 5 EHBDRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000415015581 1017399395 /nfs/dbraw/zinc/39/93/95/1017399395.db2.gz AWBXFYZWJYGEKK-ZDUSSCGKSA-N 2 0 347.390 3.743 20 5 EHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415054955 1017479381 /nfs/dbraw/zinc/47/93/81/1017479381.db2.gz OFPDOIMPOXZVKW-LPHOPBHVSA-N 2 0 341.455 3.986 20 5 EHBDRP [NH3+]CCC[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000415060690 1017489737 /nfs/dbraw/zinc/48/97/37/1017489737.db2.gz XHZLGPVIEADLRL-DBEXCURXSA-N 2 0 325.412 3.678 20 5 EHBDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000592439046 1032844334 /nfs/dbraw/zinc/84/43/34/1032844334.db2.gz YTLRXHSYSYLSJH-GHMZBOCLSA-N 2 0 337.807 3.724 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000507442113 1021280406 /nfs/dbraw/zinc/28/04/06/1021280406.db2.gz MXQOEKBMZQKRHC-SJLPKXTDSA-N 2 0 345.487 3.628 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000572887068 1028197483 /nfs/dbraw/zinc/19/74/83/1028197483.db2.gz JIYGWDOIXGOULX-BAILOTOSSA-N 2 0 343.471 3.662 20 5 EHBDRP O=[N+]([O-])c1cccc([C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2ccccc2)c1 ZINC000423263102 1028300345 /nfs/dbraw/zinc/30/03/45/1028300345.db2.gz WNWHWDVTJMYDIR-JXFKEZNVSA-N 2 0 339.439 3.664 20 5 EHBDRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000423295619 1028352011 /nfs/dbraw/zinc/35/20/11/1028352011.db2.gz XAIURTJHROQGMB-IFXJQAMLSA-N 2 0 339.439 3.725 20 5 EHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000159640876 1030304110 /nfs/dbraw/zinc/30/41/10/1030304110.db2.gz NTMCBWPIOXBGNG-AWEZNQCLSA-N 2 0 333.476 3.815 20 5 EHBDRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192616982 1030789678 /nfs/dbraw/zinc/78/96/78/1030789678.db2.gz VXUAMXMZNWDNLB-FQEVSTJZSA-N 2 0 339.439 3.824 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000595104713 1033691206 /nfs/dbraw/zinc/69/12/06/1033691206.db2.gz SHZOCZZRRJWJFL-HNNXBMFYSA-N 2 0 331.460 3.676 20 5 EHBDRP Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094862 1034080047 /nfs/dbraw/zinc/08/00/47/1034080047.db2.gz NQWOMVHQIHTQEW-RDJZCZTQSA-N 2 0 331.460 3.676 20 5 EHBDRP CCOc1cc(C[NH+]2CCC(C[NH+](CC)CC)CC2)ccc1[N+](=O)[O-] ZINC000492554619 1035996368 /nfs/dbraw/zinc/99/63/68/1035996368.db2.gz ADFQOKRICNHUOZ-UHFFFAOYSA-N 2 0 349.475 3.547 20 5 EHBDRP OC1CC[NH+](CCC[NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000238158787 1039501457 /nfs/dbraw/zinc/50/14/57/1039501457.db2.gz LMMYHTZDRAKGKT-UHFFFAOYSA-N 2 0 348.490 3.929 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCC[NH+]1CCCC1 ZINC000549875249 1040696955 /nfs/dbraw/zinc/69/69/55/1040696955.db2.gz IPLLQYFCGDEPCY-VKAVYKQESA-N 2 0 331.460 3.854 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433233664 1041122424 /nfs/dbraw/zinc/12/24/24/1041122424.db2.gz PKHXWGKKYALNRB-KRWDZBQOSA-N 2 0 331.460 3.639 20 5 EHBDRP C[C@@H](NCc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272245301 1121133448 /nfs/dbraw/zinc/13/34/48/1121133448.db2.gz XDIIOAJLVWRAAS-RHSMWYFYSA-N 2 0 345.468 3.657 20 5 EHBDRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136478 1123167215 /nfs/dbraw/zinc/16/72/15/1123167215.db2.gz IWCAWLSRKOURNS-SJLPKXTDSA-N 2 0 339.439 3.768 20 5 EHBDRP C[C@@H](CC[NH+](C)C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237551863 1123750303 /nfs/dbraw/zinc/75/03/03/1123750303.db2.gz JZKGWBQGDUNAEK-ZDUSSCGKSA-N 2 0 333.457 3.753 20 5 EHBDRP C[C@H](CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCCC1 ZINC000543416023 1129475231 /nfs/dbraw/zinc/47/52/31/1129475231.db2.gz ICHLUNSTOGDQEH-VQIMIIECSA-N 2 0 345.487 3.770 20 5 EHBDRP [NH3+]CCC[N@H+](C1CCCCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899940 1131883384 /nfs/dbraw/zinc/88/33/84/1131883384.db2.gz QESPRYUDPBOKSC-IBGZPJMESA-N 2 0 345.487 3.826 20 5 EHBDRP C[NH+](C)CC1CCC([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172908423 1131887411 /nfs/dbraw/zinc/88/74/11/1131887411.db2.gz MQCYNAAFEWMKEI-PPSBMQLTSA-N 2 0 345.487 3.552 20 5 EHBDRP CCC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cccc([N+](=O)[O-])c1 ZINC000817947751 1136850049 /nfs/dbraw/zinc/85/00/49/1136850049.db2.gz QAUYUMAFPUOJGX-LJQANCHMSA-N 2 0 327.428 3.727 20 5 EHBDRP CC[NH+](CC)CCCC1CC[NH+](Cc2cc([O-])ccc2[N+](=O)[O-])CC1 ZINC000339080783 1137408572 /nfs/dbraw/zinc/40/85/72/1137408572.db2.gz DXTMJOGLCVFRKI-UHFFFAOYSA-N 2 0 349.475 3.634 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCCC[N@H+](C)C1 ZINC000872088544 1137570643 /nfs/dbraw/zinc/57/06/43/1137570643.db2.gz RSJLEVUPXPQVSF-ZIAGYGMSSA-N 2 0 337.489 3.699 20 5 EHBDRP CC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCC[NH2+]CC1 ZINC000414716273 1017150679 /nfs/dbraw/zinc/15/06/79/1017150679.db2.gz NUZKJBJBJYWORT-INIZCTEOSA-N 2 0 343.427 3.819 20 5 EHBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000414805906 1017206864 /nfs/dbraw/zinc/20/68/64/1017206864.db2.gz BGNKDJZBGZAXOT-LSDHHAIUSA-N 2 0 327.428 3.725 20 5 EHBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000414930678 1017325520 /nfs/dbraw/zinc/32/55/20/1017325520.db2.gz TXVKHLAYCHGIDX-VXGBXAGGSA-N 2 0 349.818 3.868 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC[C@@H]2CCC[NH2+]2)s1 ZINC000414975621 1017367835 /nfs/dbraw/zinc/36/78/35/1017367835.db2.gz OXUQLPBRIFNJRB-CQSZACIVSA-N 2 0 345.468 3.945 20 5 EHBDRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414996521 1017376653 /nfs/dbraw/zinc/37/66/53/1017376653.db2.gz GLEXJJBMZJEOLN-HIFRSBDPSA-N 2 0 345.468 3.930 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602844727 1033221390 /nfs/dbraw/zinc/22/13/90/1033221390.db2.gz FAPVENFJJXLWGD-MRXNPFEDSA-N 2 0 340.427 3.572 20 5 EHBDRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548410 1026098304 /nfs/dbraw/zinc/09/83/04/1026098304.db2.gz MXZTZBHSYLMIPB-QZTJIDSGSA-N 2 0 331.460 3.649 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000503942346 1028244101 /nfs/dbraw/zinc/24/41/01/1028244101.db2.gz AYVPIYQFPIJIFM-UHFFFAOYSA-N 2 0 343.427 3.676 20 5 EHBDRP C[C@H]([NH2+]C1CC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423175434 1028245590 /nfs/dbraw/zinc/24/55/90/1028245590.db2.gz AJIUAFJTEWZBPD-LBPRGKRZSA-N 2 0 331.441 3.726 20 5 EHBDRP Cc1c([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cccc1[N+](=O)[O-] ZINC000123655681 1129541201 /nfs/dbraw/zinc/54/12/01/1129541201.db2.gz JAVMWAGMXAPFKF-OAHLLOKOSA-N 2 0 327.428 3.816 20 5 EHBDRP Cc1cc(NC[C@@H](c2ccco2)[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302151052 1129770787 /nfs/dbraw/zinc/77/07/87/1129770787.db2.gz HRWLHRPFOJNIMP-KRWDZBQOSA-N 2 0 340.383 3.759 20 5 EHBDRP C[C@@H](C[NH3+])C[N@H+](Cc1ccccc1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220891 1132004208 /nfs/dbraw/zinc/00/42/08/1132004208.db2.gz HSRSGIVLFUZHAS-IRXDYDNUSA-N 2 0 341.455 3.623 20 5 EHBDRP CC(C)[NH+]1CCC(C[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173228374 1132008399 /nfs/dbraw/zinc/00/83/99/1132008399.db2.gz VRWHKWQQZQSOAG-MRXNPFEDSA-N 2 0 333.476 3.578 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H]1C[C@@H]1CCC[NH+]1C ZINC001173232839 1132010204 /nfs/dbraw/zinc/01/02/04/1132010204.db2.gz IFTUMZWMXFCADK-LSTHTHJFSA-N 2 0 345.487 3.865 20 5 EHBDRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809739123 1135883573 /nfs/dbraw/zinc/88/35/73/1135883573.db2.gz YCZPOVPFWMTUKT-UHFFFAOYSA-N 2 0 347.846 3.942 20 5 EHBDRP CCCC[NH+]1CCC([NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866250204 1137339351 /nfs/dbraw/zinc/33/93/51/1137339351.db2.gz WIGLTAGFASOXMK-CQSZACIVSA-N 2 0 337.439 3.519 20 5 EHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000269011504 1141046807 /nfs/dbraw/zinc/04/68/07/1141046807.db2.gz NTBQZVAIMLEXTH-HNNXBMFYSA-N 2 0 331.460 3.522 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000602021270 1032594154 /nfs/dbraw/zinc/59/41/54/1032594154.db2.gz PMCMARMKFSZPEJ-RBSFLKMASA-N 2 0 337.489 3.573 20 5 EHBDRP CC(C)c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000414785342 1017198240 /nfs/dbraw/zinc/19/82/40/1017198240.db2.gz SMSWCTHUKXSGKG-IRXDYDNUSA-N 2 0 331.460 3.540 20 5 EHBDRP C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCC[NH2+]C1 ZINC000414850944 1017250849 /nfs/dbraw/zinc/25/08/49/1017250849.db2.gz IVYKYAYRLANTTP-KBPBESRZSA-N 2 0 345.468 3.801 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000415022659 1017411097 /nfs/dbraw/zinc/41/10/97/1017411097.db2.gz JFYSNETYGVCKBB-LSTDLKDCSA-N 2 0 345.487 3.661 20 5 EHBDRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000415025610 1017419173 /nfs/dbraw/zinc/41/91/73/1017419173.db2.gz RJJXBPRIXYMXGQ-NSHDSACASA-N 2 0 337.807 3.725 20 5 EHBDRP CC[N@H+](CCC[NH+]1CCCC1)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000579776481 1019857446 /nfs/dbraw/zinc/85/74/46/1019857446.db2.gz OVYWTANSNSQQPX-VKAVYKQESA-N 2 0 331.460 3.806 20 5 EHBDRP C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183188776 1020546818 /nfs/dbraw/zinc/54/68/18/1020546818.db2.gz DKNFGLYDYGIMST-ZMSDIMECSA-N 2 0 331.460 3.898 20 5 EHBDRP [NH3+][C@@H]1C[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000422915000 1028051038 /nfs/dbraw/zinc/05/10/38/1028051038.db2.gz AFEQBXDCYLHTAI-MOPGFXCFSA-N 2 0 325.412 3.652 20 5 EHBDRP C[C@@H]1C[C@H]([NH3+])CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946166 1031260124 /nfs/dbraw/zinc/26/01/24/1031260124.db2.gz BYSGAORBLGWFDM-VXGBXAGGSA-N 2 0 349.818 3.820 20 5 EHBDRP C[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCCC1 ZINC000556063477 1122800247 /nfs/dbraw/zinc/80/02/47/1122800247.db2.gz HAYGKLLVMPHCNK-HNAYVOBHSA-N 2 0 331.460 3.684 20 5 EHBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000866279676 1137342460 /nfs/dbraw/zinc/34/24/60/1137342460.db2.gz ZZCDBIGAWAKCGX-CQSZACIVSA-N 2 0 349.450 3.662 20 5 EHBDRP O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1CCCCC12CC[NH2+]CC2 ZINC000873232751 1137594664 /nfs/dbraw/zinc/59/46/64/1137594664.db2.gz KLXWYCYHKLOKKA-YEODSOHDSA-N 2 0 329.444 3.510 20 5 EHBDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000459726042 1032431625 /nfs/dbraw/zinc/43/16/25/1032431625.db2.gz FZPHFERXFPLMEJ-HNNXBMFYSA-N 2 0 343.427 3.676 20 5 EHBDRP C[C@H]([NH2+]CCC[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151901070 1032652719 /nfs/dbraw/zinc/65/27/19/1032652719.db2.gz AUKFHQQVZZOJLD-ZDUSSCGKSA-N 2 0 333.457 3.926 20 5 EHBDRP C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCC[NH2+]C1 ZINC000414858600 1017245351 /nfs/dbraw/zinc/24/53/51/1017245351.db2.gz SCNZIMRILNCILH-HIFRSBDPSA-N 2 0 345.468 3.801 20 5 EHBDRP CC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1[NH3+] ZINC000592427640 1032817093 /nfs/dbraw/zinc/81/70/93/1032817093.db2.gz LTBKCWBPURVAGN-SUMWQHHRSA-N 2 0 345.468 3.883 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCN(c2cc[nH+]cc2)CC1 ZINC000602844726 1033220606 /nfs/dbraw/zinc/22/06/06/1033220606.db2.gz FAPVENFJJXLWGD-INIZCTEOSA-N 2 0 340.427 3.572 20 5 EHBDRP C[C@@H](CC[NH+](C)C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237552191 1026993669 /nfs/dbraw/zinc/99/36/69/1026993669.db2.gz JCCRKIYPHQKWIF-ZDUSSCGKSA-N 2 0 333.457 3.753 20 5 EHBDRP C[NH+](C)C1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000421365812 1028318855 /nfs/dbraw/zinc/31/88/55/1028318855.db2.gz BHFSEYAEXAMXCH-UHFFFAOYSA-N 2 0 343.427 3.817 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423469605 1028456087 /nfs/dbraw/zinc/45/60/87/1028456087.db2.gz CUZDJXLVIAKQLR-GJZGRUSLSA-N 2 0 337.489 3.587 20 5 EHBDRP C[N@H+](CCCC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453419353 1030270775 /nfs/dbraw/zinc/27/07/75/1030270775.db2.gz YWJSGGJGSYMFSF-LPHOPBHVSA-N 2 0 345.487 3.770 20 5 EHBDRP Cc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192922382 1030452157 /nfs/dbraw/zinc/45/21/57/1030452157.db2.gz OXVAKQYLEXKHSV-LJQANCHMSA-N 2 0 339.439 3.515 20 5 EHBDRP CCOc1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)ccc1[N+](=O)[O-] ZINC000492719395 1036213637 /nfs/dbraw/zinc/21/36/37/1036213637.db2.gz FBRLATWUOVVXCY-UHFFFAOYSA-N 2 0 349.475 3.547 20 5 EHBDRP C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272135628 1037088345 /nfs/dbraw/zinc/08/83/45/1037088345.db2.gz AJQSHDVZEQQYCE-LPHOPBHVSA-N 2 0 339.439 3.595 20 5 EHBDRP C[N@H+](CCCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000417382852 1039752051 /nfs/dbraw/zinc/75/20/51/1039752051.db2.gz WKIRNLFPDQCHEM-IBGZPJMESA-N 2 0 331.460 3.826 20 5 EHBDRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000236859411 1044767762 /nfs/dbraw/zinc/76/77/62/1044767762.db2.gz VTKJFQOWVWPUQV-ZDUSSCGKSA-N 2 0 327.856 3.848 20 5 EHBDRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131935 1123165333 /nfs/dbraw/zinc/16/53/33/1123165333.db2.gz BTHPXNWILXEPAA-WMZOPIPTSA-N 2 0 339.439 3.768 20 5 EHBDRP C[NH+](C)CCCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182384367 1125271115 /nfs/dbraw/zinc/27/11/15/1125271115.db2.gz NYLNULMDQXBDAJ-UHFFFAOYSA-N 2 0 339.867 3.802 20 5 EHBDRP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900960 1131883487 /nfs/dbraw/zinc/88/34/87/1131883487.db2.gz HWRZXGJUXDCXJK-QFBILLFUSA-N 2 0 345.487 3.696 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173226133 1132007017 /nfs/dbraw/zinc/00/70/17/1132007017.db2.gz VBIXJVSMUJPJNL-WBAXXEDZSA-N 2 0 331.460 3.508 20 5 EHBDRP CC1([NH+]2CCCC2)CCC([NH2+]CCc2ccccc2[N+](=O)[O-])CC1 ZINC000886532462 1138091117 /nfs/dbraw/zinc/09/11/17/1138091117.db2.gz JLHOAGUQICDBTB-UHFFFAOYSA-N 2 0 331.460 3.524 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000449082542 1032137860 /nfs/dbraw/zinc/13/78/60/1032137860.db2.gz OBRAWBAETVBAGJ-KRWDZBQOSA-N 2 0 333.476 3.628 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000449155731 1032258567 /nfs/dbraw/zinc/25/85/67/1032258567.db2.gz QJALSZDIOJRGOX-CQSZACIVSA-N 2 0 345.418 3.516 20 5 EHBDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249038865 1032270617 /nfs/dbraw/zinc/27/06/17/1032270617.db2.gz UERRIUXWVZNHJE-KXBFYZLASA-N 2 0 331.460 3.682 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000468606009 1018019094 /nfs/dbraw/zinc/01/90/94/1018019094.db2.gz DXHPZVAWVQMDLH-NOCRFKNCSA-N 2 0 331.460 3.852 20 5 EHBDRP CC[NH+](CC)CCCC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000542947444 1019120737 /nfs/dbraw/zinc/12/07/37/1019120737.db2.gz BSYHWDCXIJSDIH-UHFFFAOYSA-N 2 0 347.503 3.971 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@]4(CC[NH2+]C4)C3)s2)cc1 ZINC000262107566 1019927229 /nfs/dbraw/zinc/92/72/29/1019927229.db2.gz WCNOCIJVANMVRP-GOSISDBHSA-N 2 0 343.452 3.509 20 5 EHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000516998298 1021933308 /nfs/dbraw/zinc/93/33/08/1021933308.db2.gz SJXRHQPSZYJCHM-UHFFFAOYSA-N 2 0 333.476 3.847 20 5 EHBDRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423202082 1028270073 /nfs/dbraw/zinc/27/00/73/1028270073.db2.gz ALHMPRDMDCBAIC-ZIAGYGMSSA-N 2 0 345.468 3.974 20 5 EHBDRP CCc1ccc([C@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423438985 1028446252 /nfs/dbraw/zinc/44/62/52/1028446252.db2.gz RWWVTGUBHYVZOG-IFXJQAMLSA-N 2 0 345.443 3.947 20 5 EHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000159641032 1030307409 /nfs/dbraw/zinc/30/74/09/1030307409.db2.gz NTMCBWPIOXBGNG-CQSZACIVSA-N 2 0 333.476 3.815 20 5 EHBDRP Cc1c([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cccc1[N+](=O)[O-] ZINC000160872531 1031125321 /nfs/dbraw/zinc/12/53/21/1031125321.db2.gz UXJLOWRILSVENT-OAHLLOKOSA-N 2 0 327.428 3.816 20 5 EHBDRP C[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[NH+](C)C ZINC000491599681 1037578010 /nfs/dbraw/zinc/57/80/10/1037578010.db2.gz UHHGDNNIRCIVKR-CYBMUJFWSA-N 2 0 333.457 3.611 20 5 EHBDRP Cc1c([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150545 1037622920 /nfs/dbraw/zinc/62/29/20/1037622920.db2.gz FURLWNZUSZQCEC-SJORKVTESA-N 2 0 333.476 3.922 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000123655438 1040909151 /nfs/dbraw/zinc/90/91/51/1040909151.db2.gz WOTDYZWTHGTIOX-HNNXBMFYSA-N 2 0 327.428 3.816 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCn2cc(C)nc21 ZINC000344857162 1044532595 /nfs/dbraw/zinc/53/25/95/1044532595.db2.gz LQMJXTKGTXCPDI-ZGUWOUCSSA-N 2 0 340.427 3.670 20 5 EHBDRP C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272200552 1120563046 /nfs/dbraw/zinc/56/30/46/1120563046.db2.gz OLHZXCQAFXQZPP-VQIMIIECSA-N 2 0 339.439 3.595 20 5 EHBDRP C[NH+](C)CC1CCC([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172908424 1131887854 /nfs/dbraw/zinc/88/78/54/1131887854.db2.gz MQCYNAAFEWMKEI-XUJQIHCRSA-N 2 0 345.487 3.552 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC001173222280 1132004586 /nfs/dbraw/zinc/00/45/86/1132004586.db2.gz VVTYBMOUGFXGNZ-MRXNPFEDSA-N 2 0 345.487 3.913 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000271128440 1141312294 /nfs/dbraw/zinc/31/22/94/1141312294.db2.gz LAIZTEMBCWBCRL-GJZGRUSLSA-N 2 0 349.500 3.539 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCCC[NH+]1CCCCC1 ZINC000449121122 1032215584 /nfs/dbraw/zinc/21/55/84/1032215584.db2.gz GARSSDPJRGXWEY-KRWDZBQOSA-N 2 0 333.476 3.772 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000459727991 1032432924 /nfs/dbraw/zinc/43/29/24/1032432924.db2.gz HWNZNTORTDNIQH-OAHLLOKOSA-N 2 0 343.427 3.676 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000459727008 1032433211 /nfs/dbraw/zinc/43/32/11/1032433211.db2.gz GXSZLDMAMFNIOA-OAHLLOKOSA-N 2 0 343.427 3.676 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000468606007 1018018649 /nfs/dbraw/zinc/01/86/49/1018018649.db2.gz DXHPZVAWVQMDLH-HJUDDPQBSA-N 2 0 331.460 3.852 20 5 EHBDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414926137 1022522453 /nfs/dbraw/zinc/52/24/53/1022522453.db2.gz MNUHYPMHUAEHGA-KBPBESRZSA-N 2 0 331.441 3.683 20 5 EHBDRP C[NH+](C)CC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000506896667 1022997496 /nfs/dbraw/zinc/99/74/96/1022997496.db2.gz OJEXGYNUGKFRJU-UHFFFAOYSA-N 2 0 343.427 3.628 20 5 EHBDRP C[NH+](C)[C@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000277436974 1025104740 /nfs/dbraw/zinc/10/47/40/1025104740.db2.gz JXQMWSMQNWVZKQ-INIZCTEOSA-N 2 0 343.427 3.771 20 5 EHBDRP CCc1ccc([C@@H]([NH2+]C2CCC([NH3+])CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423229143 1028294536 /nfs/dbraw/zinc/29/45/36/1028294536.db2.gz GMJHLLOOEWITMS-ZOJXTTQQSA-N 2 0 343.427 3.699 20 5 EHBDRP C[NH+](C)C1CCC([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000421371173 1028329362 /nfs/dbraw/zinc/32/93/62/1028329362.db2.gz KIZBFESAKCKVFL-RXQRSOPUSA-N 2 0 345.487 3.768 20 5 EHBDRP CC(C)c1ccc(C[N@@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000424386626 1029038541 /nfs/dbraw/zinc/03/85/41/1029038541.db2.gz XRVHDSCBUJLLBL-OAHLLOKOSA-N 2 0 331.460 3.682 20 5 EHBDRP C[N@H+](CCCC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453419354 1030271731 /nfs/dbraw/zinc/27/17/31/1030271731.db2.gz YWJSGGJGSYMFSF-QFBILLFUSA-N 2 0 345.487 3.770 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000595900796 1034026486 /nfs/dbraw/zinc/02/64/86/1034026486.db2.gz LNFMZPAGKPWGCM-DOTOQJQBSA-N 2 0 331.460 3.676 20 5 EHBDRP CCc1ccc([C@H]([NH2+]CCC2(C[NH3+])CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000593321497 1034646704 /nfs/dbraw/zinc/64/67/04/1034646704.db2.gz XVNBZDBEHFIFPO-GOSISDBHSA-N 2 0 343.427 3.558 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000414204110 1036052496 /nfs/dbraw/zinc/05/24/96/1036052496.db2.gz ZYPRKYGVNYNYBW-RDTXWAMCSA-N 2 0 331.460 3.639 20 5 EHBDRP C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[NH+](C)C ZINC000491595645 1037576230 /nfs/dbraw/zinc/57/62/30/1037576230.db2.gz CDVYCOQPSXPJTF-ZDUSSCGKSA-N 2 0 333.457 3.611 20 5 EHBDRP C[N@H+](CCCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000417382854 1039751531 /nfs/dbraw/zinc/75/15/31/1039751531.db2.gz WKIRNLFPDQCHEM-LJQANCHMSA-N 2 0 331.460 3.826 20 5 EHBDRP Cc1ccc(CN2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171370 1043610286 /nfs/dbraw/zinc/61/02/86/1043610286.db2.gz WWVGNJGPMVWXCJ-HKUYNNGSSA-N 2 0 345.487 3.990 20 5 EHBDRP Cc1cc(N[C@H]2CCC[C@H]([NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302087604 1129766891 /nfs/dbraw/zinc/76/68/91/1129766891.db2.gz OAHDQMBRHPHEQD-KBPBESRZSA-N 2 0 328.416 3.736 20 5 EHBDRP Cc1cc(NC2CC[NH+](CC(C)C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302186757 1129772319 /nfs/dbraw/zinc/77/23/19/1129772319.db2.gz PQWYCLWHYGTJMI-UHFFFAOYSA-N 2 0 342.443 3.984 20 5 EHBDRP CC(C)[NH+]1CCC(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172899163 1131882895 /nfs/dbraw/zinc/88/28/95/1131882895.db2.gz LKHOXAICMSVQAN-IBGZPJMESA-N 2 0 345.487 3.552 20 5 EHBDRP CC1(C)C[C@H]([NH2+]Cc2ccc(CC[NH3+])cc2)c2cc([N+](=O)[O-])ccc21 ZINC000817949104 1136850529 /nfs/dbraw/zinc/85/05/29/1136850529.db2.gz NXAVIGMUWBHPJZ-IBGZPJMESA-N 2 0 339.439 3.608 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000449082278 1032173100 /nfs/dbraw/zinc/17/31/00/1032173100.db2.gz MDCYZVZSRODXPK-IRXDYDNUSA-N 2 0 333.476 3.628 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000449174806 1032269060 /nfs/dbraw/zinc/26/90/60/1032269060.db2.gz IQINDTZOHCAGBH-INIZCTEOSA-N 2 0 345.487 3.913 20 5 EHBDRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414869196 1017262111 /nfs/dbraw/zinc/26/21/11/1017262111.db2.gz AHQNZNXHVUZGKY-LBPRGKRZSA-N 2 0 349.818 3.725 20 5 EHBDRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000415016443 1017398975 /nfs/dbraw/zinc/39/89/75/1017398975.db2.gz PQYYRESGFPISOF-CYBMUJFWSA-N 2 0 333.457 3.930 20 5 EHBDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000415042435 1017447800 /nfs/dbraw/zinc/44/78/00/1017447800.db2.gz QVKDTVVMTQYJGS-QWHCGFSZSA-N 2 0 331.441 3.540 20 5 EHBDRP C[C@H]([NH2+]Cc1cccc(Cn2ccnc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000151351521 1021310446 /nfs/dbraw/zinc/31/04/46/1021310446.db2.gz QBEOIBAYLRBPAX-HNNXBMFYSA-N 2 0 336.395 3.690 20 5 EHBDRP [NH3+]CC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000435384370 1024867516 /nfs/dbraw/zinc/86/75/16/1024867516.db2.gz LWPNLAYIRRAKEI-UHFFFAOYSA-N 2 0 349.818 3.679 20 5 EHBDRP C[NH2+]CC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000435396607 1024877666 /nfs/dbraw/zinc/87/76/66/1024877666.db2.gz XEYSKFNAMNBQEP-UHFFFAOYSA-N 2 0 345.468 3.755 20 5 EHBDRP CCOc1ccc([C@@H](C)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1[N+](=O)[O-] ZINC000152630154 1026470612 /nfs/dbraw/zinc/47/06/12/1026470612.db2.gz NDVIXQUIKWNNEE-CYBMUJFWSA-N 2 0 349.475 3.953 20 5 EHBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422920462 1028076608 /nfs/dbraw/zinc/07/66/08/1028076608.db2.gz MCZFEYLKIRYUEW-XUVXKRRUSA-N 2 0 345.487 3.818 20 5 EHBDRP CC1(C)CC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC(C)(C)[NH2+]1 ZINC000192613525 1030767218 /nfs/dbraw/zinc/76/72/18/1030767218.db2.gz CWPLJUAUSIJMLX-KRWDZBQOSA-N 2 0 331.460 3.871 20 5 EHBDRP CC[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595102717 1033690837 /nfs/dbraw/zinc/69/08/37/1033690837.db2.gz JFYUXZRRUJQCHH-IBGZPJMESA-N 2 0 331.460 3.758 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000591582968 1037516937 /nfs/dbraw/zinc/51/69/37/1037516937.db2.gz VXCPDAPOVZBUNT-GJZGRUSLSA-N 2 0 349.500 3.730 20 5 EHBDRP CC1(C)C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2)c2cc([N+](=O)[O-])ccc21 ZINC000569811313 1040868428 /nfs/dbraw/zinc/86/84/28/1040868428.db2.gz RVPPLKYBJHTIMA-SFHVURJKSA-N 2 0 325.412 3.566 20 5 EHBDRP O=[N+]([O-])c1cc(Cl)ccc1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000116277080 1129348767 /nfs/dbraw/zinc/34/87/67/1129348767.db2.gz WRYPLJKLMVTHHA-UHFFFAOYSA-N 2 0 337.851 3.556 20 5 EHBDRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902127 1131884991 /nfs/dbraw/zinc/88/49/91/1131884991.db2.gz VQRNALKJSZXVBS-LPHOPBHVSA-N 2 0 347.503 3.942 20 5 EHBDRP C[C@H](C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)CC(C)(C)CC[NH3+] ZINC001172903410 1131886406 /nfs/dbraw/zinc/88/64/06/1131886406.db2.gz QYEVGEJLGRHOMH-MAUKXSAKSA-N 2 0 347.503 3.833 20 5 EHBDRP [NH3+]CCC[C@H]1CCCC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172904915 1131886610 /nfs/dbraw/zinc/88/66/10/1131886610.db2.gz GUDRRTXDURNVHV-VQIMIIECSA-N 2 0 345.487 3.683 20 5 EHBDRP CCOc1cc(C[N@H+](C)CCCC[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC001175690529 1132739572 /nfs/dbraw/zinc/73/95/72/1132739572.db2.gz ZEJHZJIDPVCVIC-UHFFFAOYSA-N 2 0 349.475 3.691 20 5 EHBDRP C[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188795 1140019256 /nfs/dbraw/zinc/01/92/56/1140019256.db2.gz DKNFGLYDYGIMST-BFYDXBDKSA-N 2 0 331.460 3.898 20 5 EHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000269011505 1141046700 /nfs/dbraw/zinc/04/67/00/1141046700.db2.gz NTBQZVAIMLEXTH-OAHLLOKOSA-N 2 0 331.460 3.522 20 5 EHBDRP C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCC[NH2+]C1 ZINC000414850949 1017250886 /nfs/dbraw/zinc/25/08/86/1017250886.db2.gz IVYKYAYRLANTTP-KGLIPLIRSA-N 2 0 345.468 3.801 20 5 EHBDRP CC[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1[NH3+] ZINC000592427638 1032816561 /nfs/dbraw/zinc/81/65/61/1032816561.db2.gz LTBKCWBPURVAGN-DYVFJYSZSA-N 2 0 345.468 3.883 20 5 EHBDRP O[C@@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)C[NH+]1CCCC1 ZINC000051188020 1021624757 /nfs/dbraw/zinc/62/47/57/1021624757.db2.gz BLNJQFIGBPZFFT-IBGZPJMESA-N 2 0 334.463 3.539 20 5 EHBDRP C[C@H](CC[NH+](C)C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237446994 1026380538 /nfs/dbraw/zinc/38/05/38/1026380538.db2.gz JCCRKIYPHQKWIF-CYBMUJFWSA-N 2 0 333.457 3.753 20 5 EHBDRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479918885 1026884689 /nfs/dbraw/zinc/88/46/89/1026884689.db2.gz WICPTAHVWFSSIU-APWZRJJASA-N 2 0 345.487 3.770 20 5 EHBDRP C[C@H]([NH3+])C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000414675803 1027833016 /nfs/dbraw/zinc/83/30/16/1027833016.db2.gz RQZNZEQOGZBASN-ZDUSSCGKSA-N 2 0 345.468 3.883 20 5 EHBDRP CCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000278546121 1031312383 /nfs/dbraw/zinc/31/23/83/1031312383.db2.gz VJCUPXSLSHBRHA-AWEZNQCLSA-N 2 0 347.459 3.519 20 5 EHBDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000175060281 1039150709 /nfs/dbraw/zinc/15/07/09/1039150709.db2.gz NNZDCWCPMVPHLB-OAHLLOKOSA-N 2 0 327.428 3.816 20 5 EHBDRP Cc1cc(N2CCC[C@H](c3ncc[nH]3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272892026 1127097811 /nfs/dbraw/zinc/09/78/11/1127097811.db2.gz YCHGULUEOSRMMW-ZDUSSCGKSA-N 2 0 337.383 3.559 20 5 EHBDRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136470 1123167399 /nfs/dbraw/zinc/16/73/99/1123167399.db2.gz IWCAWLSRKOURNS-FUHWJXTLSA-N 2 0 339.439 3.768 20 5 EHBDRP C[NH+](C)C[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000125499333 1129696803 /nfs/dbraw/zinc/69/68/03/1129696803.db2.gz QRDCCLOQDHXOBP-AWEZNQCLSA-N 2 0 345.468 3.707 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001173218767 1132003572 /nfs/dbraw/zinc/00/35/72/1132003572.db2.gz MBJLVOFIEZMPKN-AWEZNQCLSA-N 2 0 333.476 3.767 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC(C)(C)C[C@@](C)(C[NH3+])C1 ZINC001173234103 1132010436 /nfs/dbraw/zinc/01/04/36/1132010436.db2.gz MQHSADHVWXSZDQ-ALKREAHSSA-N 2 0 333.476 3.659 20 5 EHBDRP Cc1ccc(C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001168997175 1132627516 /nfs/dbraw/zinc/62/75/16/1132627516.db2.gz BVQVQDKQMNEPSY-MUGJNUQGSA-N 2 0 345.487 3.512 20 5 EHBDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173387623 1136989529 /nfs/dbraw/zinc/98/95/29/1136989529.db2.gz QLWRXOXFRHMFRA-OAHLLOKOSA-N 2 0 327.428 3.897 20 5 EHBDRP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000866216202 1137335875 /nfs/dbraw/zinc/33/58/75/1137335875.db2.gz QTGRDCCQUVTXMW-LBPRGKRZSA-N 2 0 337.439 3.564 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000449183066 1032298809 /nfs/dbraw/zinc/29/88/09/1032298809.db2.gz KNUYQACQSOTPKO-OAHLLOKOSA-N 2 0 331.460 3.522 20 5 EHBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414996517 1017377579 /nfs/dbraw/zinc/37/75/79/1017377579.db2.gz GLEXJJBMZJEOLN-DZGCQCFKSA-N 2 0 345.468 3.930 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000468609439 1018139763 /nfs/dbraw/zinc/13/97/63/1018139763.db2.gz HCBSFVIUHULGAF-DMVFFGLYSA-N 2 0 345.487 3.956 20 5 EHBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414926140 1022509897 /nfs/dbraw/zinc/50/98/97/1022509897.db2.gz MNUHYPMHUAEHGA-ZIAGYGMSSA-N 2 0 331.441 3.683 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@@H]3[NH2+]CC[C@@H]3C2)s1 ZINC000427105297 1023217272 /nfs/dbraw/zinc/21/72/72/1023217272.db2.gz XHNPQKXHRIYAGJ-CJNGLKHVSA-N 2 0 343.452 3.507 20 5 EHBDRP COc1ccc(CNC(C)(C)CC[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000479592937 1026725117 /nfs/dbraw/zinc/72/51/17/1026725117.db2.gz PKZFUDZMUSXZAB-UHFFFAOYSA-N 2 0 349.475 3.738 20 5 EHBDRP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924954779 1027789609 /nfs/dbraw/zinc/78/96/09/1027789609.db2.gz LDIBKSMUTZGSLH-AWEZNQCLSA-N 2 0 343.427 3.516 20 5 EHBDRP [NH3+][C@H]1C[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000422915002 1028048250 /nfs/dbraw/zinc/04/82/50/1028048250.db2.gz AFEQBXDCYLHTAI-RBUKOAKNSA-N 2 0 325.412 3.652 20 5 EHBDRP [NH3+]C1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCCC1 ZINC000423198791 1028268533 /nfs/dbraw/zinc/26/85/33/1028268533.db2.gz HYZDMLNFPMBAKV-KRWDZBQOSA-N 2 0 331.460 3.557 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000423274416 1028338539 /nfs/dbraw/zinc/33/85/39/1028338539.db2.gz KKMLWPKESUEOMO-RRFJBIMHSA-N 2 0 337.489 3.573 20 5 EHBDRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423438288 1028446897 /nfs/dbraw/zinc/44/68/97/1028446897.db2.gz RBWBZFOJENEESY-DNVCBOLYSA-N 2 0 327.428 3.791 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423469894 1028456146 /nfs/dbraw/zinc/45/61/46/1028456146.db2.gz LBUFAMQHTPZJIL-RBSFLKMASA-N 2 0 337.489 3.573 20 5 EHBDRP CC[NH+](CC)CCCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000541084068 1035970040 /nfs/dbraw/zinc/97/00/40/1035970040.db2.gz GJPZKSZRVVDFBM-UHFFFAOYSA-N 2 0 333.476 3.929 20 5 EHBDRP CN(Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109668 1037322274 /nfs/dbraw/zinc/32/22/74/1037322274.db2.gz FHPVBXZAUXZMAL-IBGZPJMESA-N 2 0 339.439 3.549 20 5 EHBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000046065117 1037740777 /nfs/dbraw/zinc/74/07/77/1037740777.db2.gz FWEAYETZIVPBJB-UHFFFAOYSA-N 2 0 331.460 3.683 20 5 EHBDRP C[NH+]1CCC(CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417301645 1039643872 /nfs/dbraw/zinc/64/38/72/1039643872.db2.gz BRROPVBPXRNBKT-LJQANCHMSA-N 2 0 331.460 3.684 20 5 EHBDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309055 1039662405 /nfs/dbraw/zinc/66/24/05/1039662405.db2.gz DFKABBOVOIVWRR-BEFAXECRSA-N 2 0 331.460 3.684 20 5 EHBDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309057 1039664314 /nfs/dbraw/zinc/66/43/14/1039664314.db2.gz DFKABBOVOIVWRR-HNAYVOBHSA-N 2 0 331.460 3.684 20 5 EHBDRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000123285216 1040798616 /nfs/dbraw/zinc/79/86/16/1040798616.db2.gz KZKWPOPXTVQVTK-JXFKEZNVSA-N 2 0 345.487 3.770 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000245522029 1130230874 /nfs/dbraw/zinc/23/08/74/1130230874.db2.gz LHMOJWQCRRULKB-FTRWYGJKSA-N 2 0 343.471 3.913 20 5 EHBDRP [NH3+]CCC[C@@H]1CCCC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172904911 1131886481 /nfs/dbraw/zinc/88/64/81/1131886481.db2.gz GUDRRTXDURNVHV-QFBILLFUSA-N 2 0 345.487 3.683 20 5 EHBDRP CCC1(C)C[NH+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001182228476 1133593536 /nfs/dbraw/zinc/59/35/36/1133593536.db2.gz ZGOLUYKCXKPJKV-UHFFFAOYSA-N 2 0 345.487 3.581 20 5 EHBDRP C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859215041 1137008257 /nfs/dbraw/zinc/00/82/57/1137008257.db2.gz VAQWOEPTCNPZRI-HNNXBMFYSA-N 2 0 327.428 3.849 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000872068806 1137569410 /nfs/dbraw/zinc/56/94/10/1137569410.db2.gz ZTPSEJBLLOPQFU-ZDUSSCGKSA-N 2 0 349.500 3.842 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000271128442 1141311674 /nfs/dbraw/zinc/31/16/74/1141311674.db2.gz LAIZTEMBCWBCRL-LSDHHAIUSA-N 2 0 349.500 3.539 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@H]2CCC[NH2+]C2)s1 ZINC000414846741 1024094979 /nfs/dbraw/zinc/09/49/79/1024094979.db2.gz VAPQCLZIPUXGMZ-CQSZACIVSA-N 2 0 345.468 3.803 20 5 EHBDRP CC[NH2+]CC1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000347023823 1025429492 /nfs/dbraw/zinc/42/94/92/1025429492.db2.gz PUZUVDIRXGFZGT-UHFFFAOYSA-N 2 0 343.427 3.676 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423469892 1028455678 /nfs/dbraw/zinc/45/56/78/1028455678.db2.gz LBUFAMQHTPZJIL-QLFBSQMISA-N 2 0 337.489 3.573 20 5 EHBDRP C[N@H+](CCCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453419355 1030271340 /nfs/dbraw/zinc/27/13/40/1030271340.db2.gz YWJSGGJGSYMFSF-VQIMIIECSA-N 2 0 345.487 3.770 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000160872257 1031118795 /nfs/dbraw/zinc/11/87/95/1031118795.db2.gz UUIWEMYEQDCICS-OAHLLOKOSA-N 2 0 327.428 3.816 20 5 EHBDRP CCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000278546125 1031312496 /nfs/dbraw/zinc/31/24/96/1031312496.db2.gz VJCUPXSLSHBRHA-CQSZACIVSA-N 2 0 347.459 3.519 20 5 EHBDRP CCc1ccc([C@@H]([NH2+]CCC2(C[NH3+])CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000593321498 1034645325 /nfs/dbraw/zinc/64/53/25/1034645325.db2.gz XVNBZDBEHFIFPO-SFHVURJKSA-N 2 0 343.427 3.558 20 5 EHBDRP CC1(C)C[C@H]([NH2+]Cc2ccc3c[nH+]cn3c2)c2cc([N+](=O)[O-])ccc21 ZINC000414200623 1036025306 /nfs/dbraw/zinc/02/53/06/1036025306.db2.gz ZZPJZBGQCBASDN-SFHVURJKSA-N 2 0 336.395 3.755 20 5 EHBDRP CC1CC[NH+](CCC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000480169587 1039245731 /nfs/dbraw/zinc/24/57/31/1039245731.db2.gz VMZJCPFIBIRCAB-LJQANCHMSA-N 2 0 345.487 3.628 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C2CC[NH+](C)CC2)CC1 ZINC001173226069 1132006599 /nfs/dbraw/zinc/00/65/99/1132006599.db2.gz HKKOOVCOEFHBFZ-INIZCTEOSA-N 2 0 345.487 3.580 20 5 EHBDRP CC[C@@H]1CCC[N@@H+]1CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001179863574 1133295427 /nfs/dbraw/zinc/29/54/27/1133295427.db2.gz PKOJNLBHPQUQAO-LJQANCHMSA-N 2 0 345.487 3.724 20 5 EHBDRP CC1(C)C[C@@H]([NH2+]Cc2ccc(CC[NH3+])cc2)c2cc([N+](=O)[O-])ccc21 ZINC000817949109 1136850550 /nfs/dbraw/zinc/85/05/50/1136850550.db2.gz NXAVIGMUWBHPJZ-LJQANCHMSA-N 2 0 339.439 3.608 20 5 EHBDRP CCOc1ccc([C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000866517453 1137360942 /nfs/dbraw/zinc/36/09/42/1137360942.db2.gz ZJWFBEGGHQTAIO-ICXUMSERSA-N 2 0 349.475 3.907 20 5 EHBDRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000873043912 1137588743 /nfs/dbraw/zinc/58/87/43/1137588743.db2.gz WLSPFXCARDRRLS-UHFFFAOYSA-N 2 0 327.428 3.645 20 5 EHBDRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000092856917 1138232351 /nfs/dbraw/zinc/23/23/51/1138232351.db2.gz FPVMNRGBHNOOQB-OAHLLOKOSA-N 2 0 340.427 3.557 20 5 EHBDRP CCc1ccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423456740 1028449151 /nfs/dbraw/zinc/44/91/51/1028449151.db2.gz OEPGIVILPAXUCI-FZKQIMNGSA-N 2 0 331.416 3.557 20 5 EHBDRP C[NH+](C)C1CCC([NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000421868465 1028902415 /nfs/dbraw/zinc/90/24/15/1028902415.db2.gz CIHXBEQNCUOSMA-RJYAGPCLSA-N 2 0 331.460 3.825 20 5 EHBDRP C[N@@H+]1CCCC[C@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068691 1033709201 /nfs/dbraw/zinc/70/92/01/1033709201.db2.gz CJHMXCIVKJMZTQ-KDOFPFPSSA-N 2 0 331.460 3.639 20 5 EHBDRP [NH3+]CC1(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000593316242 1034635841 /nfs/dbraw/zinc/63/58/41/1034635841.db2.gz NQBZSSKKEZFXGM-UHFFFAOYSA-N 2 0 331.441 3.542 20 5 EHBDRP C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272135631 1037087209 /nfs/dbraw/zinc/08/72/09/1037087209.db2.gz AJQSHDVZEQQYCE-VQIMIIECSA-N 2 0 339.439 3.595 20 5 EHBDRP CCc1ccc([C@@H]([NH2+]CCCC[NH+](C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543403882 1129464188 /nfs/dbraw/zinc/46/41/88/1129464188.db2.gz FIBGCEGNJREGCX-IBGZPJMESA-N 2 0 345.443 3.771 20 5 EHBDRP Cc1cc(N[C@@H]2CCC[C@@H]([NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302087607 1129767333 /nfs/dbraw/zinc/76/73/33/1129767333.db2.gz OAHDQMBRHPHEQD-ZIAGYGMSSA-N 2 0 328.416 3.736 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1CC[NH+](CC(C)(C)C)CC1 ZINC001173221180 1132004437 /nfs/dbraw/zinc/00/44/37/1132004437.db2.gz LGBQTMANUSELME-INIZCTEOSA-N 2 0 347.503 3.874 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000459777276 1032463483 /nfs/dbraw/zinc/46/34/83/1032463483.db2.gz KLXAHJAXQUUYRQ-ZIFCJYIRSA-N 2 0 345.487 3.628 20 5 EHBDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]1 ZINC000414952389 1017352571 /nfs/dbraw/zinc/35/25/71/1017352571.db2.gz QQRGAABWCLIUQZ-GXTWGEPZSA-N 2 0 331.441 3.553 20 5 EHBDRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414971506 1017360611 /nfs/dbraw/zinc/36/06/11/1017360611.db2.gz LMDNKLJDHKTPKS-KRWDZBQOSA-N 2 0 345.468 3.801 20 5 EHBDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000592439052 1032845596 /nfs/dbraw/zinc/84/55/96/1032845596.db2.gz YTLRXHSYSYLSJH-QWRGUYRKSA-N 2 0 337.807 3.724 20 5 EHBDRP C[N@H+](CCCC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000602688959 1033068744 /nfs/dbraw/zinc/06/87/44/1033068744.db2.gz UKDKRKKDRPMJRI-UHFFFAOYSA-N 2 0 345.365 3.578 20 5 EHBDRP C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(C[NH+](C)C)c1 ZINC000924956152 1027841087 /nfs/dbraw/zinc/84/10/87/1027841087.db2.gz UDGIPCDLKSNAMD-OAHLLOKOSA-N 2 0 327.428 3.550 20 5 EHBDRP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCC[NH2+]CC1 ZINC000414756659 1028572775 /nfs/dbraw/zinc/57/27/75/1028572775.db2.gz VQXQINJIOAJONV-CQSZACIVSA-N 2 0 345.468 3.897 20 5 EHBDRP CCOc1ccc([C@@H](C)NCCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504894986 1029039256 /nfs/dbraw/zinc/03/92/56/1029039256.db2.gz PXPUHKBCKIBBHX-HZPDHXFCSA-N 2 0 349.475 3.909 20 5 EHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000052210060 1029356633 /nfs/dbraw/zinc/35/66/33/1029356633.db2.gz VZASYVPYHXWAKR-UHFFFAOYSA-N 2 0 333.476 3.847 20 5 EHBDRP CCC[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000447572053 1030291078 /nfs/dbraw/zinc/29/10/78/1030291078.db2.gz MQZKIHHHJKHLOF-IBGZPJMESA-N 2 0 331.460 3.900 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000595104714 1033691308 /nfs/dbraw/zinc/69/13/08/1033691308.db2.gz SHZOCZZRRJWJFL-OAHLLOKOSA-N 2 0 331.460 3.676 20 5 EHBDRP CC1(C)C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2F)c2cc([N+](=O)[O-])ccc21 ZINC000593320259 1034659604 /nfs/dbraw/zinc/65/96/04/1034659604.db2.gz BTARHFIOIGAARP-GOSISDBHSA-N 2 0 343.402 3.705 20 5 EHBDRP C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272135630 1037088556 /nfs/dbraw/zinc/08/85/56/1037088556.db2.gz AJQSHDVZEQQYCE-QFBILLFUSA-N 2 0 339.439 3.595 20 5 EHBDRP C[NH+]1CCC(CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417301643 1039642692 /nfs/dbraw/zinc/64/26/92/1039642692.db2.gz BRROPVBPXRNBKT-IBGZPJMESA-N 2 0 331.460 3.684 20 5 EHBDRP O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000255210933 1129046186 /nfs/dbraw/zinc/04/61/86/1129046186.db2.gz IDEGDDWVSWEWHK-MTIYJEKLSA-N 2 0 329.444 3.558 20 5 EHBDRP C[C@H](C[NH3+])C[N@H+](Cc1ccccc1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220890 1132004283 /nfs/dbraw/zinc/00/42/83/1132004283.db2.gz HSRSGIVLFUZHAS-IAGOWNOFSA-N 2 0 341.455 3.623 20 5 EHBDRP Cc1c(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)cccc1[N+](=O)[O-] ZINC000859214173 1137008263 /nfs/dbraw/zinc/00/82/63/1137008263.db2.gz NMHCZIKHOMAAFL-UHFFFAOYSA-N 2 0 327.428 3.597 20 5 EHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000131431886 1137853046 /nfs/dbraw/zinc/85/30/46/1137853046.db2.gz DDPHCAVNEOHVFH-UHFFFAOYSA-N 2 0 327.428 3.725 20 5 EHBDRP C[NH+](C)CCCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000263806871 1138371159 /nfs/dbraw/zinc/37/11/59/1138371159.db2.gz LJZWUGAANGOMQC-UHFFFAOYSA-N 2 0 333.457 3.755 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCCC[NH+]1CCCCC1 ZINC000449121123 1032215429 /nfs/dbraw/zinc/21/54/29/1032215429.db2.gz GARSSDPJRGXWEY-QGZVFWFLSA-N 2 0 333.476 3.772 20 5 EHBDRP CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[NH2+]CC1 ZINC000414720662 1017153917 /nfs/dbraw/zinc/15/39/17/1017153917.db2.gz ZIZSWXQVIAAIDN-HNNXBMFYSA-N 2 0 343.427 3.819 20 5 EHBDRP CC(C)c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000414785344 1017198509 /nfs/dbraw/zinc/19/85/09/1017198509.db2.gz SMSWCTHUKXSGKG-SJORKVTESA-N 2 0 331.460 3.540 20 5 EHBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000415017272 1017402199 /nfs/dbraw/zinc/40/21/99/1017402199.db2.gz RXCGIXNYQXKTSS-ZDUSSCGKSA-N 2 0 333.457 3.930 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@H]2CCC[NH2+]2)s1 ZINC000414900838 1021719691 /nfs/dbraw/zinc/71/96/91/1021719691.db2.gz FBDMTAFRICLSMA-CYBMUJFWSA-N 2 0 331.441 3.555 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423469603 1028455379 /nfs/dbraw/zinc/45/53/79/1028455379.db2.gz CUZDJXLVIAKQLR-CABCVRRESA-N 2 0 337.489 3.587 20 5 EHBDRP CCOc1ccc([C@H](C)NCCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504894985 1029040032 /nfs/dbraw/zinc/04/00/32/1029040032.db2.gz PXPUHKBCKIBBHX-HOTGVXAUSA-N 2 0 349.475 3.909 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000595000084 1033625658 /nfs/dbraw/zinc/62/56/58/1033625658.db2.gz BWUQBAWCFYKSMI-WJDWOHSUSA-N 2 0 343.471 3.710 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000595900213 1034025862 /nfs/dbraw/zinc/02/58/62/1034025862.db2.gz BERHXONURATMNX-RDJZCZTQSA-N 2 0 331.460 3.676 20 5 EHBDRP CCC[C@@H]([NH2+]Cc1ccccc1C[NH2+]C)c1cccc([N+](=O)[O-])c1 ZINC000593322525 1034645189 /nfs/dbraw/zinc/64/51/89/1034645189.db2.gz NZKXXINEOUKYPY-LJQANCHMSA-N 2 0 327.428 3.945 20 5 EHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000236666558 1035037573 /nfs/dbraw/zinc/03/75/73/1035037573.db2.gz AFUUASPJKAXSPT-UHFFFAOYSA-N 2 0 327.428 3.725 20 5 EHBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000591282864 1037320620 /nfs/dbraw/zinc/32/06/20/1037320620.db2.gz WCFYJPUOXPXGEW-RYQLBKOJSA-N 2 0 343.471 3.570 20 5 EHBDRP Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000540150543 1037621719 /nfs/dbraw/zinc/62/17/19/1037621719.db2.gz FURLWNZUSZQCEC-IRXDYDNUSA-N 2 0 333.476 3.922 20 5 EHBDRP C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C[NH+]1CCCCC1 ZINC000480901978 1037681334 /nfs/dbraw/zinc/68/13/34/1037681334.db2.gz UVIYWUKQCGIIAU-LPHOPBHVSA-N 2 0 345.487 3.628 20 5 EHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000485748438 1039512877 /nfs/dbraw/zinc/51/28/77/1039512877.db2.gz WYZXOGMQDSJFJU-UHFFFAOYSA-N 2 0 349.475 3.547 20 5 EHBDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417309058 1039663165 /nfs/dbraw/zinc/66/31/65/1039663165.db2.gz DFKABBOVOIVWRR-KXBFYZLASA-N 2 0 331.460 3.684 20 5 EHBDRP Cc1nccn1C[C@H](C)C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314607 1039669663 /nfs/dbraw/zinc/66/96/63/1039669663.db2.gz RMKMAWOBCIGZOC-KUHUBIRLSA-N 2 0 342.443 3.793 20 5 EHBDRP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000566568901 1040548267 /nfs/dbraw/zinc/54/82/67/1040548267.db2.gz CYYGPLCSHVUHDX-OLZOCXBDSA-N 2 0 331.441 3.635 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433233665 1041120196 /nfs/dbraw/zinc/12/01/96/1041120196.db2.gz PKHXWGKKYALNRB-QGZVFWFLSA-N 2 0 331.460 3.639 20 5 EHBDRP CCC[N@H+](C)C[C@@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000302204128 1129772969 /nfs/dbraw/zinc/77/29/69/1129772969.db2.gz WFVSFYLXCDFDCK-HNNXBMFYSA-N 2 0 342.443 3.620 20 5 EHBDRP C[NH+]1CCC(CCC[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172903217 1131884976 /nfs/dbraw/zinc/88/49/76/1131884976.db2.gz PMFYFZZDGXOULA-LJQANCHMSA-N 2 0 345.487 3.554 20 5 EHBDRP CC(C)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902932 1131885243 /nfs/dbraw/zinc/88/52/43/1131885243.db2.gz CQTBOVIMYYTDCZ-GUDVDZBRSA-N 2 0 345.487 3.823 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC001173222278 1132004075 /nfs/dbraw/zinc/00/40/75/1132004075.db2.gz VVTYBMOUGFXGNZ-INIZCTEOSA-N 2 0 345.487 3.913 20 5 EHBDRP C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768209609 1133107730 /nfs/dbraw/zinc/10/77/30/1133107730.db2.gz SFNKWSYRDFLPRO-HNNXBMFYSA-N 2 0 327.428 3.849 20 5 EHBDRP COc1ccc(C[C@H](C)[N@H+](C(C)C)[C@H]2CC[C@H]([NH3+])CC2)c([N+](=O)[O-])c1 ZINC001170322375 1134747567 /nfs/dbraw/zinc/74/75/67/1134747567.db2.gz FHTKAAKEZQGDQD-XIRDDKMYSA-N 2 0 349.475 3.515 20 5 EHBDRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000809736972 1135882384 /nfs/dbraw/zinc/88/23/84/1135882384.db2.gz ACPYJRBNTOEFNV-UHFFFAOYSA-N 2 0 347.846 3.942 20 5 EHBDRP C[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815586687 1136615013 /nfs/dbraw/zinc/61/50/13/1136615013.db2.gz OUVMETPGCSUMBK-OOHWJJMZSA-N 2 0 346.475 3.625 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000872079359 1137570210 /nfs/dbraw/zinc/57/02/10/1137570210.db2.gz XVMVBBUPSLMRMV-ZDUSSCGKSA-N 2 0 337.489 3.842 20 5 EHBDRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000123639533 1138272778 /nfs/dbraw/zinc/27/27/78/1138272778.db2.gz YUYGMZGLWDDVFM-HNNXBMFYSA-N 2 0 327.428 3.816 20 5 EHBDRP C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCC[NH2+]C1 ZINC000414850955 1017249518 /nfs/dbraw/zinc/24/95/18/1017249518.db2.gz IVYKYAYRLANTTP-ZIAGYGMSSA-N 2 0 345.468 3.801 20 5 EHBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414926138 1017329308 /nfs/dbraw/zinc/32/93/08/1017329308.db2.gz MNUHYPMHUAEHGA-KGLIPLIRSA-N 2 0 331.441 3.683 20 5 EHBDRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000415016444 1017398415 /nfs/dbraw/zinc/39/84/15/1017398415.db2.gz PQYYRESGFPISOF-ZDUSSCGKSA-N 2 0 333.457 3.930 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000592491868 1032927645 /nfs/dbraw/zinc/92/76/45/1032927645.db2.gz MQIAAEHXGPLPSC-GVDBMIGSSA-N 2 0 331.460 3.676 20 5 EHBDRP C[NH+](C)C1CCC([NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000421868464 1028901912 /nfs/dbraw/zinc/90/19/12/1028901912.db2.gz CIHXBEQNCUOSMA-LADRWXRNSA-N 2 0 331.460 3.825 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH+]1CCCC1 ZINC000504905801 1029051339 /nfs/dbraw/zinc/05/13/39/1029051339.db2.gz OARJGCVSWNFMMT-HNNXBMFYSA-N 2 0 337.489 3.541 20 5 EHBDRP Cc1cnccc1OC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278532799 1031260044 /nfs/dbraw/zinc/26/00/44/1031260044.db2.gz FGYQXWMEDMVSDY-OAHLLOKOSA-N 2 0 341.411 3.903 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000598998911 1033634589 /nfs/dbraw/zinc/63/45/89/1033634589.db2.gz ZCJFANUGNNSFPZ-HVEPWOEZSA-N 2 0 329.444 3.605 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596059047 1034063851 /nfs/dbraw/zinc/06/38/51/1034063851.db2.gz MCWNNXXUFRHRLP-XLCPLWEUSA-N 2 0 343.471 3.710 20 5 EHBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000591282862 1037319487 /nfs/dbraw/zinc/31/94/87/1037319487.db2.gz WCFYJPUOXPXGEW-JQHSSLGASA-N 2 0 343.471 3.570 20 5 EHBDRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000470178706 1038563568 /nfs/dbraw/zinc/56/35/68/1038563568.db2.gz MNWPYSUHUGBYNI-CSXOKHGMSA-N 2 0 331.460 3.803 20 5 EHBDRP CCN1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000236920657 1040183022 /nfs/dbraw/zinc/18/30/22/1040183022.db2.gz ODIJPZKCMPTKOV-UHFFFAOYSA-N 2 0 345.468 3.897 20 5 EHBDRP C[NH+](C)CCCC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000490148781 1040357158 /nfs/dbraw/zinc/35/71/58/1040357158.db2.gz GMTRWWIRKWXZGE-LJQANCHMSA-N 2 0 327.428 3.616 20 5 EHBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(F)c1 ZINC000490339934 1040502714 /nfs/dbraw/zinc/50/27/14/1040502714.db2.gz KYCYWZSYIKTXTD-UHFFFAOYSA-N 2 0 349.450 3.822 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000245522032 1130230399 /nfs/dbraw/zinc/23/03/99/1130230399.db2.gz LHMOJWQCRRULKB-TWOQFEAHSA-N 2 0 343.471 3.913 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC001173220076 1132003376 /nfs/dbraw/zinc/00/33/76/1132003376.db2.gz SVWGFCPQOKIJHU-OAHLLOKOSA-N 2 0 331.460 3.522 20 5 EHBDRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173230690 1132009330 /nfs/dbraw/zinc/00/93/30/1132009330.db2.gz ULWHDTRFBSDGGE-KBAYOESNSA-N 2 0 333.476 3.768 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000271128441 1141311658 /nfs/dbraw/zinc/31/16/58/1141311658.db2.gz LAIZTEMBCWBCRL-HUUCEWRRSA-N 2 0 349.500 3.539 20 5 EHBDRP CC[C@H]([NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000247000738 1016270963 /nfs/dbraw/zinc/27/09/63/1016270963.db2.gz LOUPBUDTVBBJBF-BXWFABGCSA-N 2 0 349.475 3.525 20 5 EHBDRP CCC[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cccc([N+](=O)[O-])c1 ZINC000602021610 1032594680 /nfs/dbraw/zinc/59/46/80/1032594680.db2.gz QHCJXEAXGPOARN-FQEVSTJZSA-N 2 0 339.439 3.872 20 5 EHBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000414805903 1017207152 /nfs/dbraw/zinc/20/71/52/1017207152.db2.gz BGNKDJZBGZAXOT-HUUCEWRRSA-N 2 0 327.428 3.725 20 5 EHBDRP CC(C)c1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000511525781 1018014706 /nfs/dbraw/zinc/01/47/06/1018014706.db2.gz MAFUSBFJEOAWGZ-UHFFFAOYSA-N 2 0 333.476 3.882 20 5 EHBDRP CC1([NH3+])CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000592431664 1032836559 /nfs/dbraw/zinc/83/65/59/1032836559.db2.gz WRYIHMYBAWDLPF-UHFFFAOYSA-N 2 0 331.441 3.637 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@@H]3CCC[NH2+]C3)s2)cc1 ZINC000414844072 1023953110 /nfs/dbraw/zinc/95/31/10/1023953110.db2.gz QYWTUNPFNOHSQW-AWEZNQCLSA-N 2 0 345.468 3.803 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCCN1C1CC1 ZINC000434789380 1024426893 /nfs/dbraw/zinc/42/68/93/1024426893.db2.gz MKTLNDCRAKGUNQ-LSSBLYJVSA-N 2 0 329.444 3.605 20 5 EHBDRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000423289695 1028325271 /nfs/dbraw/zinc/32/52/71/1028325271.db2.gz BONIFYZXZZEDHF-ZIAGYGMSSA-N 2 0 343.427 3.864 20 5 EHBDRP C[N@H+](CCCC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453419352 1030270863 /nfs/dbraw/zinc/27/08/63/1030270863.db2.gz YWJSGGJGSYMFSF-APWZRJJASA-N 2 0 345.487 3.770 20 5 EHBDRP C[N@H+](CCCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000453590839 1030381133 /nfs/dbraw/zinc/38/11/33/1030381133.db2.gz BVUXQWLLUTZMIE-UHFFFAOYSA-N 2 0 343.427 3.819 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000595000079 1033626528 /nfs/dbraw/zinc/62/65/28/1033626528.db2.gz BWUQBAWCFYKSMI-LFIBNONCSA-N 2 0 343.471 3.710 20 5 EHBDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000236666064 1035037373 /nfs/dbraw/zinc/03/73/73/1035037373.db2.gz YTYSAQIKBMHLQY-UHFFFAOYSA-N 2 0 327.428 3.725 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000480927669 1040178309 /nfs/dbraw/zinc/17/83/09/1040178309.db2.gz BPOIRSWGCLYQLC-WJDWOHSUSA-N 2 0 331.460 3.710 20 5 EHBDRP [NH3+]CCC[C@H]1CCCC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172904904 1131886774 /nfs/dbraw/zinc/88/67/74/1131886774.db2.gz GUDRRTXDURNVHV-APWZRJJASA-N 2 0 345.487 3.683 20 5 EHBDRP CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cc[nH+]c(C)c1 ZINC001174656688 1132440314 /nfs/dbraw/zinc/44/03/14/1132440314.db2.gz PMMGUVVTUSSFJP-UHFFFAOYSA-N 2 0 344.418 3.947 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000872080578 1137570221 /nfs/dbraw/zinc/57/02/21/1137570221.db2.gz SAXKBCUIYZKLLD-HSBZDZAISA-N 2 0 337.489 3.840 20 5 EHBDRP O=[N+]([O-])c1ccc(CC[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000877077081 1137669697 /nfs/dbraw/zinc/66/96/97/1137669697.db2.gz WAYCAFOYDVNJBD-UHFFFAOYSA-N 2 0 331.460 3.524 20 5 EHBDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000592439054 1032844531 /nfs/dbraw/zinc/84/45/31/1032844531.db2.gz YTLRXHSYSYLSJH-WDEREUQCSA-N 2 0 337.807 3.724 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000507442112 1021279116 /nfs/dbraw/zinc/27/91/16/1021279116.db2.gz MXQOEKBMZQKRHC-FUHWJXTLSA-N 2 0 345.487 3.628 20 5 EHBDRP Cc1c(CN2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475455 1023246465 /nfs/dbraw/zinc/24/64/65/1023246465.db2.gz XAKNSKZHOLWYIM-WMZOPIPTSA-N 2 0 345.487 3.990 20 5 EHBDRP CC(C)[N@H+](C)CC1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000535811317 1023651641 /nfs/dbraw/zinc/65/16/41/1023651641.db2.gz CTRABTBPFIUHSK-SOFGYWHQSA-N 2 0 331.460 3.660 20 5 EHBDRP C[NH+](C)[C@@H]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000277436976 1025104349 /nfs/dbraw/zinc/10/43/49/1025104349.db2.gz JXQMWSMQNWVZKQ-MRXNPFEDSA-N 2 0 343.427 3.771 20 5 EHBDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCN1C ZINC000525195852 1029739107 /nfs/dbraw/zinc/73/91/07/1029739107.db2.gz SQTLWCSNZPSIRZ-ZIAGYGMSSA-N 2 0 345.468 3.896 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000598998912 1033634845 /nfs/dbraw/zinc/63/48/45/1033634845.db2.gz ZCJFANUGNNSFPZ-ILCZHQDMSA-N 2 0 329.444 3.605 20 5 EHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595293668 1033720570 /nfs/dbraw/zinc/72/05/70/1033720570.db2.gz RXKATAGHNJJEDA-UHFFFAOYSA-N 2 0 337.439 3.678 20 5 EHBDRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095282 1034078734 /nfs/dbraw/zinc/07/87/34/1034078734.db2.gz OOSGJCXCQWEPIK-QFBILLFUSA-N 2 0 331.460 3.758 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000591582967 1037517809 /nfs/dbraw/zinc/51/78/09/1037517809.db2.gz VXCPDAPOVZBUNT-CABCVRRESA-N 2 0 349.500 3.730 20 5 EHBDRP C[C@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000584593644 1039350937 /nfs/dbraw/zinc/35/09/37/1039350937.db2.gz KIRTVSKWOUTVJY-STQMWFEESA-N 2 0 347.390 3.742 20 5 EHBDRP [NH3+]CCC[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000925630060 1040327984 /nfs/dbraw/zinc/32/79/84/1040327984.db2.gz PXUNLRJQYAITQR-QGZVFWFLSA-N 2 0 347.846 3.861 20 5 EHBDRP CC1(C)C[C@@H]([NH2+]Cc2ccc(C[NH3+])cc2)c2cc([N+](=O)[O-])ccc21 ZINC000569811312 1040868461 /nfs/dbraw/zinc/86/84/61/1040868461.db2.gz RVPPLKYBJHTIMA-GOSISDBHSA-N 2 0 325.412 3.566 20 5 EHBDRP Cc1cc(N[C@H]2CCC[C@@H]([NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302087606 1129767089 /nfs/dbraw/zinc/76/70/89/1129767089.db2.gz OAHDQMBRHPHEQD-UONOGXRCSA-N 2 0 328.416 3.736 20 5 EHBDRP CCC[N@H+](CCC[NH+](C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914062 1131902972 /nfs/dbraw/zinc/90/29/72/1131902972.db2.gz YSDCBOREFJZZCY-GOSISDBHSA-N 2 0 333.476 3.506 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC([NH3+])(CC2CCC2)CC1 ZINC001173224817 1132005475 /nfs/dbraw/zinc/00/54/75/1132005475.db2.gz PDZWTEQGXUFXNM-OAHLLOKOSA-N 2 0 331.460 3.509 20 5 EHBDRP C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CC[NH+](C)CC1 ZINC000809946249 1135903095 /nfs/dbraw/zinc/90/30/95/1135903095.db2.gz AUTOMRUIIQAPGX-UHFFFAOYSA-N 2 0 346.258 3.675 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000449084117 1032139609 /nfs/dbraw/zinc/13/96/09/1032139609.db2.gz WPPJGDBYFZTHER-SJORKVTESA-N 2 0 333.476 3.770 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000449084116 1032139642 /nfs/dbraw/zinc/13/96/42/1032139642.db2.gz WPPJGDBYFZTHER-IRXDYDNUSA-N 2 0 333.476 3.770 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@@H]3CC[NH2+]C3)o2)c(Cl)c1 ZINC000414834824 1017225146 /nfs/dbraw/zinc/22/51/46/1017225146.db2.gz QXVGRQVVVQXGAP-LBPRGKRZSA-N 2 0 349.818 3.597 20 5 EHBDRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414840525 1017232545 /nfs/dbraw/zinc/23/25/45/1017232545.db2.gz KLPJAGSMMDDKII-NVXWUHKLSA-N 2 0 331.460 3.557 20 5 EHBDRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423241087 1028304545 /nfs/dbraw/zinc/30/45/45/1028304545.db2.gz CYCDYVUAKYUWRG-UONOGXRCSA-N 2 0 345.468 3.974 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423274415 1028336921 /nfs/dbraw/zinc/33/69/21/1028336921.db2.gz KKMLWPKESUEOMO-RBSFLKMASA-N 2 0 337.489 3.573 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423469897 1028455269 /nfs/dbraw/zinc/45/52/69/1028455269.db2.gz LBUFAMQHTPZJIL-SOUVJXGZSA-N 2 0 337.489 3.573 20 5 EHBDRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000192635102 1030873737 /nfs/dbraw/zinc/87/37/37/1030873737.db2.gz LYGYLPWYKTYDJC-FQEVSTJZSA-N 2 0 339.439 3.824 20 5 EHBDRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417358006 1039719970 /nfs/dbraw/zinc/71/99/70/1039719970.db2.gz HIUQUHHQQKWJLM-KXBFYZLASA-N 2 0 331.460 3.684 20 5 EHBDRP C[NH+](C)CCCC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000490148780 1040355875 /nfs/dbraw/zinc/35/58/75/1040355875.db2.gz GMTRWWIRKWXZGE-IBGZPJMESA-N 2 0 327.428 3.616 20 5 EHBDRP CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000609203745 1120558700 /nfs/dbraw/zinc/55/87/00/1120558700.db2.gz QYLZTJBCYSOKLO-UHFFFAOYSA-N 2 0 349.475 3.546 20 5 EHBDRP CC(C)N(CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)C ZINC001172896658 1131901861 /nfs/dbraw/zinc/90/18/61/1131901861.db2.gz QLQWZNACYQPRQC-GOSISDBHSA-N 2 0 333.476 3.551 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC(C)(C)C[C@](C)(C[NH3+])C1 ZINC001173234106 1132010285 /nfs/dbraw/zinc/01/02/85/1132010285.db2.gz MQHSADHVWXSZDQ-SIXWZSSISA-N 2 0 333.476 3.659 20 5 EHBDRP COc1ccc(C[C@@H](C)[N@H+](CCC[NH3+])C2CCCCC2)c([N+](=O)[O-])c1 ZINC001170295628 1134737653 /nfs/dbraw/zinc/73/76/53/1134737653.db2.gz CTHBOGHCJHTPTL-OAHLLOKOSA-N 2 0 349.475 3.518 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000865765469 1137309989 /nfs/dbraw/zinc/30/99/89/1137309989.db2.gz WFUIEFNGKARWBW-QINSGFPZSA-N 2 0 331.460 3.851 20 5 EHBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017299 1137564776 /nfs/dbraw/zinc/56/47/76/1137564776.db2.gz YZRKLMIVOTXLBM-KGLIPLIRSA-N 2 0 325.428 3.895 20 5 EHBDRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872089333 1137570796 /nfs/dbraw/zinc/57/07/96/1137570796.db2.gz XDIIKMRXMWGHAT-CYBMUJFWSA-N 2 0 335.423 3.507 20 5 EHBDRP [NH3+]CCCC[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414911160 1017303237 /nfs/dbraw/zinc/30/32/37/1017303237.db2.gz SOPCTQHMIJGKEI-UHFFFAOYSA-N 2 0 349.818 3.869 20 5 EHBDRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414923648 1017328131 /nfs/dbraw/zinc/32/81/31/1017328131.db2.gz IXIHJQPKQSLYMR-CHWSQXEVSA-N 2 0 331.441 3.683 20 5 EHBDRP Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000521847963 1025717876 /nfs/dbraw/zinc/71/78/76/1025717876.db2.gz CHPUTPHEIWYELX-GOEBONIOSA-N 2 0 340.427 3.514 20 5 EHBDRP C[NH+](C)C1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000421366176 1028320828 /nfs/dbraw/zinc/32/08/28/1028320828.db2.gz BUVAZVVDKODNOK-UHFFFAOYSA-N 2 0 343.427 3.817 20 5 EHBDRP C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1CC[NH+](C)CC1 ZINC000093088914 1028447078 /nfs/dbraw/zinc/44/70/78/1028447078.db2.gz AGYJTSYHFLSTMK-UHFFFAOYSA-N 2 0 343.427 3.628 20 5 EHBDRP O=[N+]([O-])c1ccccc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000532778428 1028821730 /nfs/dbraw/zinc/82/17/30/1028821730.db2.gz YCNKENRMUGRNGQ-UHFFFAOYSA-N 2 0 331.460 3.683 20 5 EHBDRP [NH3+][C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000424366983 1029030880 /nfs/dbraw/zinc/03/08/80/1029030880.db2.gz KCGZDJNFOSQTLW-HZPDHXFCSA-N 2 0 331.441 3.683 20 5 EHBDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCN1C ZINC000525195850 1029738917 /nfs/dbraw/zinc/73/89/17/1029738917.db2.gz SQTLWCSNZPSIRZ-KGLIPLIRSA-N 2 0 345.468 3.896 20 5 EHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477908623 1039012851 /nfs/dbraw/zinc/01/28/51/1039012851.db2.gz CBGHOYFPPICAQR-INIZCTEOSA-N 2 0 333.476 3.628 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@@H]3C1)CCCC2 ZINC000417328258 1039671284 /nfs/dbraw/zinc/67/12/84/1039671284.db2.gz SFFPXTDINIHVMQ-GPMSIDNRSA-N 2 0 329.444 3.579 20 5 EHBDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000192831004 1040042534 /nfs/dbraw/zinc/04/25/34/1040042534.db2.gz UERRIUXWVZNHJE-DNVCBOLYSA-N 2 0 331.460 3.682 20 5 EHBDRP O=[N+]([O-])c1ccc(CC[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1 ZINC000123241286 1040777602 /nfs/dbraw/zinc/77/76/02/1040777602.db2.gz JGWLAMNFDXVRJK-UHFFFAOYSA-N 2 0 345.487 3.772 20 5 EHBDRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000123285008 1040799242 /nfs/dbraw/zinc/79/92/42/1040799242.db2.gz KZKWPOPXTVQVTK-UZLBHIALSA-N 2 0 345.487 3.770 20 5 EHBDRP CC1(C)C[C@H](N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170621 1040963190 /nfs/dbraw/zinc/96/31/90/1040963190.db2.gz YGOJIYJMFHWIAY-DEYYWGMASA-N 2 0 329.444 3.534 20 5 EHBDRP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900959 1131883285 /nfs/dbraw/zinc/88/32/85/1131883285.db2.gz HWRZXGJUXDCXJK-LPHOPBHVSA-N 2 0 345.487 3.696 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CC[NH+](C)C)c1ccccc1 ZINC001173215704 1132002332 /nfs/dbraw/zinc/00/23/32/1132002332.db2.gz YTWWSUCQZZNNCU-JXFKEZNVSA-N 2 0 341.455 3.808 20 5 EHBDRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168998116 1132627278 /nfs/dbraw/zinc/62/72/78/1132627278.db2.gz ILULUGZIBZHFQP-MKXGPGLRSA-N 2 0 337.508 3.584 20 5 EHBDRP CC1CC[NH+](CC[C@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001175353473 1132646937 /nfs/dbraw/zinc/64/69/37/1132646937.db2.gz ZTTDOXYWBWQQDH-LJQANCHMSA-N 2 0 345.487 3.724 20 5 EHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[N@H+]1CCC[C@H](C)C1 ZINC001199344080 1135896413 /nfs/dbraw/zinc/89/64/13/1135896413.db2.gz DPJWDNSWIJRBKQ-HNNXBMFYSA-N 2 0 333.476 3.813 20 5 EHBDRP C[C@@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)N1CC[NH+](C)CC1 ZINC000105467019 1135948526 /nfs/dbraw/zinc/94/85/26/1135948526.db2.gz KBMDOFKVVZRDHU-SFHVURJKSA-N 2 0 347.506 3.719 20 5 EHBDRP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000866517629 1137361003 /nfs/dbraw/zinc/36/10/03/1137361003.db2.gz KVKFNIFAUGDBAT-VNSJNIRKSA-N 2 0 335.448 3.517 20 5 EHBDRP C[N@H+](CCCCCC[NH3+])Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000873231543 1137594507 /nfs/dbraw/zinc/59/45/07/1137594507.db2.gz MYCPHHJFJFIOTQ-UHFFFAOYSA-N 2 0 348.472 3.669 20 5 EHBDRP CC(C)(C)[NH+]1CCC([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000089512896 1138200720 /nfs/dbraw/zinc/20/07/20/1138200720.db2.gz FSLOGTBHGSZDAU-SFHVURJKSA-N 2 0 345.487 3.768 20 5 EHBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414999202 1021465991 /nfs/dbraw/zinc/46/59/91/1021465991.db2.gz JBBACTZXKDXSCI-ZIAGYGMSSA-N 2 0 345.468 3.930 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@H]3CCC[NH2+]3)s2)cc1 ZINC000414911567 1022052799 /nfs/dbraw/zinc/05/27/99/1022052799.db2.gz WLEDIABHVUHCMI-CQSZACIVSA-N 2 0 331.441 3.555 20 5 EHBDRP CCC[C@H]([NH2+]CCc1cn2c(n1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000152784630 1026717839 /nfs/dbraw/zinc/71/78/39/1026717839.db2.gz GIFBWJLVFAOQNE-SFHVURJKSA-N 2 0 342.443 3.801 20 5 EHBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422920460 1028075599 /nfs/dbraw/zinc/07/55/99/1028075599.db2.gz MCZFEYLKIRYUEW-SLFFLAALSA-N 2 0 345.487 3.818 20 5 EHBDRP O=[N+]([O-])c1cccc([C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccccc2)c1 ZINC000423476620 1028460070 /nfs/dbraw/zinc/46/00/70/1028460070.db2.gz JCCVIXGFSHFZTJ-UYAOXDASSA-N 2 0 339.439 3.806 20 5 EHBDRP CCCC[NH+](CCCC)CCNc1cc2c(cc1[N+](=O)[O-])C[NH2+]C2 ZINC001167732917 1038319942 /nfs/dbraw/zinc/31/99/42/1038319942.db2.gz ICVQUBVYSZWRMT-UHFFFAOYSA-N 2 0 334.464 3.512 20 5 EHBDRP CCC[NH+]1CCC(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192826560 1039894286 /nfs/dbraw/zinc/89/42/86/1039894286.db2.gz GAQRSJICOKTIOU-LJQANCHMSA-N 2 0 331.460 3.684 20 5 EHBDRP Cc1cc(N2CCC[C@H]([NH+]3CCCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302167185 1129771346 /nfs/dbraw/zinc/77/13/46/1129771346.db2.gz LCXFBKGOJSEKIL-INIZCTEOSA-N 2 0 340.427 3.516 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCCCC[NH+]1CCCC1)CC2 ZINC001172913165 1131919204 /nfs/dbraw/zinc/91/92/04/1131919204.db2.gz UJRUFRFARRAYBE-IBGZPJMESA-N 2 0 345.487 3.698 20 5 EHBDRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173230691 1132008808 /nfs/dbraw/zinc/00/88/08/1132008808.db2.gz ULWHDTRFBSDGGE-SZMVWBNQSA-N 2 0 333.476 3.768 20 5 EHBDRP Cc1ccccc1C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168998339 1132627122 /nfs/dbraw/zinc/62/71/22/1132627122.db2.gz LLZLHXKKHPKGFS-AFYVEPGGSA-N 2 0 345.487 3.512 20 5 EHBDRP CC[N@H+](CCC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1)CC(C)C ZINC000886104564 1138047182 /nfs/dbraw/zinc/04/71/82/1138047182.db2.gz GBADOTZKXVTUFU-UHFFFAOYSA-N 2 0 348.491 3.570 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000449200938 1032324734 /nfs/dbraw/zinc/32/47/34/1032324734.db2.gz FXAZKCHFOUXECI-CQSZACIVSA-N 2 0 345.418 3.516 20 5 EHBDRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414869193 1017261842 /nfs/dbraw/zinc/26/18/42/1017261842.db2.gz AHQNZNXHVUZGKY-GFCCVEGCSA-N 2 0 349.818 3.725 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC[C@H]3CCC[NH2+]3)s2)cc1 ZINC000414967748 1017359024 /nfs/dbraw/zinc/35/90/24/1017359024.db2.gz HJLRMCPTJLZHSW-HNNXBMFYSA-N 2 0 345.468 3.945 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000415022226 1017403697 /nfs/dbraw/zinc/40/36/97/1017403697.db2.gz IMEPOSFVOMQAJD-SHTZXODSSA-N 2 0 343.427 3.710 20 5 EHBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000895821998 1024876869 /nfs/dbraw/zinc/87/68/69/1024876869.db2.gz HUEGGSKRBJUOHR-UHFFFAOYSA-N 2 0 325.840 3.601 20 5 EHBDRP CC[NH2+]CC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000347195844 1025663245 /nfs/dbraw/zinc/66/32/45/1025663245.db2.gz HHZUWOVKLOXBAU-UHFFFAOYSA-N 2 0 343.427 3.676 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](C[NH3+])[C@H](c2ccccc2)C1 ZINC000420311167 1027456306 /nfs/dbraw/zinc/45/63/06/1027456306.db2.gz GYRRKUNYFUJASP-VPWXQRGCSA-N 2 0 339.439 3.639 20 5 EHBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000423296146 1028354582 /nfs/dbraw/zinc/35/45/82/1028354582.db2.gz YJSKJBKSDTXAOL-BFUOFWGJSA-N 2 0 325.412 3.782 20 5 EHBDRP O=[N+]([O-])c1cccc([C@H]([NH2+]CCC2=CC[NH2+]CC2)c2ccccc2)c1 ZINC000423546575 1028509194 /nfs/dbraw/zinc/50/91/94/1028509194.db2.gz ZBYCBNUNVCNSFB-HXUWFJFHSA-N 2 0 337.423 3.584 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000504926270 1029073051 /nfs/dbraw/zinc/07/30/51/1029073051.db2.gz HEYVYOIKRBTDGY-PMPSAXMXSA-N 2 0 349.500 3.682 20 5 EHBDRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000571642412 1035578381 /nfs/dbraw/zinc/57/83/81/1035578381.db2.gz NPSDMDOCVUUESQ-IEBWSBKVSA-N 2 0 339.439 3.555 20 5 EHBDRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])cc1 ZINC000571642416 1035578579 /nfs/dbraw/zinc/57/85/79/1035578579.db2.gz NPSDMDOCVUUESQ-PKOBYXMFSA-N 2 0 339.439 3.555 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCC[NH2+]CC3)s2)cc1 ZINC000591278462 1035615610 /nfs/dbraw/zinc/61/56/10/1035615610.db2.gz DMJRJUQDMHGJPU-CQSZACIVSA-N 2 0 331.441 3.555 20 5 EHBDRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000271817600 1037359454 /nfs/dbraw/zinc/35/94/54/1037359454.db2.gz MGNKDZCDOVFFIG-UHFFFAOYSA-N 2 0 343.452 3.675 20 5 EHBDRP CCCC[N@H+](C)CC1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000103554993 1037927956 /nfs/dbraw/zinc/92/79/56/1037927956.db2.gz RQJGHMSEYVJQJN-UHFFFAOYSA-N 2 0 337.439 3.678 20 5 EHBDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000125742675 1129713245 /nfs/dbraw/zinc/71/32/45/1129713245.db2.gz GOCYNTSAKDXIKP-APWZRJJASA-N 2 0 345.487 3.626 20 5 EHBDRP COc1ccc(C[C@H](C)[N@H+](CCC[NH3+])C2CCCCC2)c([N+](=O)[O-])c1 ZINC001170295627 1134736063 /nfs/dbraw/zinc/73/60/63/1134736063.db2.gz CTHBOGHCJHTPTL-HNNXBMFYSA-N 2 0 349.475 3.518 20 5 EHBDRP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000866279675 1137342337 /nfs/dbraw/zinc/34/23/37/1137342337.db2.gz ZZCDBIGAWAKCGX-AWEZNQCLSA-N 2 0 349.450 3.662 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCCC[N@H+](C)C1 ZINC000872088541 1137570631 /nfs/dbraw/zinc/57/06/31/1137570631.db2.gz RSJLEVUPXPQVSF-KGLIPLIRSA-N 2 0 337.489 3.699 20 5 EHBDRP C[C@H]([NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC[NH2+]CC1 ZINC000873271895 1137595989 /nfs/dbraw/zinc/59/59/89/1137595989.db2.gz LMONGAQKTNDBAB-YWZLYKJASA-N 2 0 339.439 3.662 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000602021269 1032593594 /nfs/dbraw/zinc/59/35/94/1032593594.db2.gz PMCMARMKFSZPEJ-KKUMJFAQSA-N 2 0 337.489 3.573 20 5 EHBDRP CCC[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cccc([N+](=O)[O-])c1 ZINC000602021613 1032593688 /nfs/dbraw/zinc/59/36/88/1032593688.db2.gz QHCJXEAXGPOARN-HXUWFJFHSA-N 2 0 339.439 3.872 20 5 EHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414805895 1017206881 /nfs/dbraw/zinc/20/68/81/1017206881.db2.gz BGNKDJZBGZAXOT-CABCVRRESA-N 2 0 327.428 3.725 20 5 EHBDRP CC1(C)C[NH2+]CC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414971508 1017360115 /nfs/dbraw/zinc/36/01/15/1017360115.db2.gz LMDNKLJDHKTPKS-QGZVFWFLSA-N 2 0 345.468 3.801 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000415022663 1017410967 /nfs/dbraw/zinc/41/09/67/1017410967.db2.gz JFYSNETYGVCKBB-MTNOOBJLSA-N 2 0 345.487 3.661 20 5 EHBDRP CC[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1[NH3+] ZINC000592427622 1032816914 /nfs/dbraw/zinc/81/69/14/1032816914.db2.gz JFBZSKYVLDHTCJ-CJNGLKHVSA-N 2 0 345.468 3.883 20 5 EHBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414923649 1022432910 /nfs/dbraw/zinc/43/29/10/1022432910.db2.gz IXIHJQPKQSLYMR-OLZOCXBDSA-N 2 0 331.441 3.683 20 5 EHBDRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000442931116 1025593286 /nfs/dbraw/zinc/59/32/86/1025593286.db2.gz VCOPYSWMYBAUFL-AWEZNQCLSA-N 2 0 345.468 3.884 20 5 EHBDRP [NH3+]C1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCCC1 ZINC000423198792 1028266373 /nfs/dbraw/zinc/26/63/73/1028266373.db2.gz HYZDMLNFPMBAKV-QGZVFWFLSA-N 2 0 331.460 3.557 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[NH+](C)C ZINC000504911816 1029053671 /nfs/dbraw/zinc/05/36/71/1029053671.db2.gz LWDXRVYVJYQILU-CQSZACIVSA-N 2 0 339.505 3.643 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000598998910 1033634358 /nfs/dbraw/zinc/63/43/58/1033634358.db2.gz ZCJFANUGNNSFPZ-FERCGXDMSA-N 2 0 329.444 3.605 20 5 EHBDRP C[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1CCC[NH3+] ZINC000595904557 1034026873 /nfs/dbraw/zinc/02/68/73/1034026873.db2.gz GEAQFEPZBGLDDZ-IUODEOHRSA-N 2 0 325.840 3.588 20 5 EHBDRP C[NH+]1CCC(O)(C[NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000265823036 1129227951 /nfs/dbraw/zinc/22/79/51/1129227951.db2.gz BBYAZJKZSPERIQ-UHFFFAOYSA-N 2 0 334.463 3.539 20 5 EHBDRP Cc1ccccc1C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168998342 1132627098 /nfs/dbraw/zinc/62/70/98/1132627098.db2.gz LLZLHXKKHPKGFS-VBSBHUPXSA-N 2 0 345.487 3.512 20 5 EHBDRP Cc1ccc(C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001168997173 1132627601 /nfs/dbraw/zinc/62/76/01/1132627601.db2.gz BVQVQDKQMNEPSY-LWYYNNOASA-N 2 0 345.487 3.512 20 5 EHBDRP CC[NH+]1CCC(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001181880411 1133545527 /nfs/dbraw/zinc/54/55/27/1133545527.db2.gz VKIGIWXCYRYBES-SFHVURJKSA-N 2 0 331.460 3.506 20 5 EHBDRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173419327 1137095281 /nfs/dbraw/zinc/09/52/81/1137095281.db2.gz KGHAPCFSIXJUNV-CYBMUJFWSA-N 2 0 331.391 3.646 20 5 EHBDRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000089215527 1138195646 /nfs/dbraw/zinc/19/56/46/1138195646.db2.gz JYUAAFAKESPCTM-HNNXBMFYSA-N 2 0 340.427 3.557 20 5 EHBDRP C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCC[NH2+]C1 ZINC000414850952 1017249921 /nfs/dbraw/zinc/24/99/21/1017249921.db2.gz IVYKYAYRLANTTP-UONOGXRCSA-N 2 0 345.468 3.801 20 5 EHBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414923650 1017327715 /nfs/dbraw/zinc/32/77/15/1017327715.db2.gz IXIHJQPKQSLYMR-QWHCGFSZSA-N 2 0 331.441 3.683 20 5 EHBDRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000415015579 1017398986 /nfs/dbraw/zinc/39/89/86/1017398986.db2.gz AWBXFYZWJYGEKK-CYBMUJFWSA-N 2 0 347.390 3.743 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000423274414 1028337469 /nfs/dbraw/zinc/33/74/69/1028337469.db2.gz KKMLWPKESUEOMO-KFWWJZLASA-N 2 0 337.489 3.573 20 5 EHBDRP C[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180459928 1036865990 /nfs/dbraw/zinc/86/59/90/1036865990.db2.gz OORMJKXIBOJDMT-FQEVSTJZSA-N 2 0 339.439 3.616 20 5 EHBDRP C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272135627 1037088794 /nfs/dbraw/zinc/08/87/94/1037088794.db2.gz AJQSHDVZEQQYCE-APWZRJJASA-N 2 0 339.439 3.595 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCC[NH2+]CC2)s1 ZINC000591278508 1037316880 /nfs/dbraw/zinc/31/68/80/1037316880.db2.gz JJOFXAZZKLBCDT-ZDUSSCGKSA-N 2 0 331.441 3.555 20 5 EHBDRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000542942574 1128888285 /nfs/dbraw/zinc/88/82/85/1128888285.db2.gz SQBGYHAEJSNHPH-UHFFFAOYSA-N 2 0 333.476 3.929 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CC[NH+](C)C)c1ccccc1 ZINC001173215706 1132001968 /nfs/dbraw/zinc/00/19/68/1132001968.db2.gz YTWWSUCQZZNNCU-OXQOHEQNSA-N 2 0 341.455 3.808 20 5 EHBDRP CC(C)C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])CC1CC[NH+](C)CC1 ZINC001197194089 1135657572 /nfs/dbraw/zinc/65/75/72/1135657572.db2.gz IYUGFVYOVDRYJL-UHFFFAOYSA-N 2 0 337.439 3.534 20 5 EHBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCCC[NH+]1CCCC1 ZINC000866363171 1137349757 /nfs/dbraw/zinc/34/97/57/1137349757.db2.gz KEERIXZHOBHHPE-OAHLLOKOSA-N 2 0 337.439 3.521 20 5 EHBDRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017300 1137564751 /nfs/dbraw/zinc/56/47/51/1137564751.db2.gz YZRKLMIVOTXLBM-UONOGXRCSA-N 2 0 325.428 3.895 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000872079458 1137570154 /nfs/dbraw/zinc/57/01/54/1137570154.db2.gz MYLGMJGGZDZBCE-KBPBESRZSA-N 2 0 337.489 3.699 20 5 EHBDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449131925 1032227636 /nfs/dbraw/zinc/22/76/36/1032227636.db2.gz QJQXSFDJTICKHQ-INIZCTEOSA-N 2 0 341.455 3.767 20 5 EHBDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]1 ZINC000414952391 1017350862 /nfs/dbraw/zinc/35/08/62/1017350862.db2.gz QQRGAABWCLIUQZ-OCCSQVGLSA-N 2 0 331.441 3.553 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@@H]4[NH2+]CC[C@H]4C3)s2)cc1 ZINC000427128686 1023236509 /nfs/dbraw/zinc/23/65/09/1023236509.db2.gz OQJAOUIRYFJEKE-YOEHRIQHSA-N 2 0 343.452 3.507 20 5 EHBDRP COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924954783 1027788997 /nfs/dbraw/zinc/78/89/97/1027788997.db2.gz LDIBKSMUTZGSLH-CQSZACIVSA-N 2 0 343.427 3.516 20 5 EHBDRP CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000414715210 1028158039 /nfs/dbraw/zinc/15/80/39/1028158039.db2.gz MSUINIBHQAUMCE-MRXNPFEDSA-N 2 0 343.427 3.819 20 5 EHBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423476732 1028459352 /nfs/dbraw/zinc/45/93/52/1028459352.db2.gz RDDGYHJLPTUXJF-XFQXTVEOSA-N 2 0 339.439 3.791 20 5 EHBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423476730 1028459490 /nfs/dbraw/zinc/45/94/90/1028459490.db2.gz RDDGYHJLPTUXJF-CVAIRZPRSA-N 2 0 339.439 3.791 20 5 EHBDRP O=[N+]([O-])c1cccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000532778499 1028822407 /nfs/dbraw/zinc/82/24/07/1028822407.db2.gz MITZTCYGWZQZFW-UHFFFAOYSA-N 2 0 331.460 3.683 20 5 EHBDRP C[C@]1(CNCc2cccc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000310852782 1036638553 /nfs/dbraw/zinc/63/85/53/1036638553.db2.gz AVXQRNAGHFYDER-HXUWFJFHSA-N 2 0 339.439 3.597 20 5 EHBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000591282866 1037319121 /nfs/dbraw/zinc/31/91/21/1037319121.db2.gz WCFYJPUOXPXGEW-SZMVWBNQSA-N 2 0 343.471 3.570 20 5 EHBDRP CC[N@H+](CCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1)CC1CC1 ZINC000539958654 1037406606 /nfs/dbraw/zinc/40/66/06/1037406606.db2.gz YKYXRDIZXNVGEG-UHFFFAOYSA-N 2 0 345.487 3.929 20 5 EHBDRP CC1(C)C[C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433058647 1040596532 /nfs/dbraw/zinc/59/65/32/1040596532.db2.gz QNBIMVWBMLFVFO-LJQANCHMSA-N 2 0 343.471 3.781 20 5 EHBDRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000153591917 1128487570 /nfs/dbraw/zinc/48/75/70/1128487570.db2.gz KEGAUACTEVIIBU-HNNXBMFYSA-N 2 0 349.475 3.766 20 5 EHBDRP Cc1cc(NC[C@@H](C)C[NH+]2CCCC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302054561 1129766135 /nfs/dbraw/zinc/76/61/35/1129766135.db2.gz ACHNLTWTCCXCDO-CYBMUJFWSA-N 2 0 328.416 3.595 20 5 EHBDRP C[C@@H](C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)CC(C)(C)CC[NH3+] ZINC001172903413 1131887022 /nfs/dbraw/zinc/88/70/22/1131887022.db2.gz QYEVGEJLGRHOMH-QAPCUYQASA-N 2 0 347.503 3.833 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CC[NH+](C)C)c1ccccc1 ZINC001173215707 1132001818 /nfs/dbraw/zinc/00/18/18/1132001818.db2.gz YTWWSUCQZZNNCU-UZLBHIALSA-N 2 0 341.455 3.808 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CC[NH+](C)C)c1ccccc1 ZINC001173215705 1132001981 /nfs/dbraw/zinc/00/19/81/1132001981.db2.gz YTWWSUCQZZNNCU-OXJNMPFZSA-N 2 0 341.455 3.808 20 5 EHBDRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168998115 1132627856 /nfs/dbraw/zinc/62/78/56/1132627856.db2.gz ILULUGZIBZHFQP-CADBVGFASA-N 2 0 337.508 3.584 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000872059247 1137568776 /nfs/dbraw/zinc/56/87/76/1137568776.db2.gz CAFFKZNHYHHFGI-ZDUSSCGKSA-N 2 0 337.489 3.699 20 5 EHBDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC2 ZINC000877684126 1137685725 /nfs/dbraw/zinc/68/57/25/1137685725.db2.gz HNLBNNMLCFDVPY-UHFFFAOYSA-N 2 0 337.851 3.556 20 5 EHBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000877711335 1137686590 /nfs/dbraw/zinc/68/65/90/1137686590.db2.gz DVWNSGQPODFUAS-UHFFFAOYSA-N 2 0 325.840 3.601 20 5 EHBDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000249038863 1032264008 /nfs/dbraw/zinc/26/40/08/1032264008.db2.gz UERRIUXWVZNHJE-BEFAXECRSA-N 2 0 331.460 3.682 20 5 EHBDRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414926139 1017329594 /nfs/dbraw/zinc/32/95/94/1017329594.db2.gz MNUHYPMHUAEHGA-UONOGXRCSA-N 2 0 331.441 3.683 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000415022653 1017412035 /nfs/dbraw/zinc/41/20/35/1017412035.db2.gz JFYSNETYGVCKBB-DWRORGKVSA-N 2 0 345.487 3.661 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000415027436 1017419184 /nfs/dbraw/zinc/41/91/84/1017419184.db2.gz WEHMBTIDLHIBSH-SHTZXODSSA-N 2 0 343.427 3.710 20 5 EHBDRP [NH3+]C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000415031559 1017432903 /nfs/dbraw/zinc/43/29/03/1017432903.db2.gz HCNAFCBRNBCKLY-NWDGAFQWSA-N 2 0 349.818 3.725 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000182658766 1019719373 /nfs/dbraw/zinc/71/93/73/1019719373.db2.gz KNSOUFRPJOIBIK-MRXNPFEDSA-N 2 0 331.460 3.772 20 5 EHBDRP Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000521847965 1025717237 /nfs/dbraw/zinc/71/72/37/1025717237.db2.gz CHPUTPHEIWYELX-ZBFHGGJFSA-N 2 0 340.427 3.514 20 5 EHBDRP C[C@H](C[NH3+])C[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414887143 1025864484 /nfs/dbraw/zinc/86/44/84/1025864484.db2.gz YVBCKKDXPDCHMK-GFCCVEGCSA-N 2 0 349.818 3.725 20 5 EHBDRP CC1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[NH2+]CC1 ZINC000423320539 1028350042 /nfs/dbraw/zinc/35/00/42/1028350042.db2.gz FLUKCLNYWRGSFT-IBGZPJMESA-N 2 0 339.439 3.664 20 5 EHBDRP C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCC[NH2+]CC1 ZINC000414756657 1028573483 /nfs/dbraw/zinc/57/34/83/1028573483.db2.gz VQXQINJIOAJONV-AWEZNQCLSA-N 2 0 345.468 3.897 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000595900798 1034024914 /nfs/dbraw/zinc/02/49/14/1034024914.db2.gz LNFMZPAGKPWGCM-RDJZCZTQSA-N 2 0 331.460 3.676 20 5 EHBDRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000592395494 1037939408 /nfs/dbraw/zinc/93/94/08/1037939408.db2.gz CLFCZSMZUUSPLT-ZTNFWEORSA-N 2 0 339.439 3.591 20 5 EHBDRP Cc1nccn1C[C@@H](C)C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314606 1039669540 /nfs/dbraw/zinc/66/95/40/1039669540.db2.gz RMKMAWOBCIGZOC-IFXJQAMLSA-N 2 0 342.443 3.793 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@H]3C1)CCCC2 ZINC000417328262 1039672696 /nfs/dbraw/zinc/67/26/96/1039672696.db2.gz SFFPXTDINIHVMQ-JTDSTZFVSA-N 2 0 329.444 3.579 20 5 EHBDRP C[NH+](C)CCCC1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255498099 1129116722 /nfs/dbraw/zinc/11/67/22/1129116722.db2.gz FYQMCDGOPVUCFR-TWGQIWQCSA-N 2 0 331.460 3.662 20 5 EHBDRP C[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000105458999 1135947899 /nfs/dbraw/zinc/94/78/99/1135947899.db2.gz HNJMUKHTXXDISX-UHFFFAOYSA-N 2 0 345.468 3.755 20 5 EHBDRP C[NH+](C)C1CCC([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000817414412 1136806519 /nfs/dbraw/zinc/80/65/19/1136806519.db2.gz YWPNANNHVRLYFD-UHFFFAOYSA-N 2 0 346.258 3.864 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000865765468 1137309973 /nfs/dbraw/zinc/30/99/73/1137309973.db2.gz WFUIEFNGKARWBW-NTCAYCPXSA-N 2 0 331.460 3.851 20 5 EHBDRP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000866290661 1137342975 /nfs/dbraw/zinc/34/29/75/1137342975.db2.gz WGGWFXZWRRGMRS-ZDUSSCGKSA-N 2 0 337.439 3.517 20 5 EHBDRP Cc1c(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cccc1[N+](=O)[O-] ZINC000873009926 1137587977 /nfs/dbraw/zinc/58/79/77/1137587977.db2.gz XCIMLSRXQFNSAG-UHFFFAOYSA-N 2 0 339.439 3.789 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449233802 1032328978 /nfs/dbraw/zinc/32/89/78/1032328978.db2.gz NEFQQRHDNBOIIQ-JFIYKMOQSA-N 2 0 345.487 3.768 20 5 EHBDRP CC[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000178039008 1021026521 /nfs/dbraw/zinc/02/65/21/1021026521.db2.gz LOUPBUDTVBBJBF-JTDSTZFVSA-N 2 0 349.475 3.525 20 5 EHBDRP O=[N+]([O-])c1cccc([C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccccc2)c1 ZINC000423476617 1028460619 /nfs/dbraw/zinc/46/06/19/1028460619.db2.gz JCCVIXGFSHFZTJ-AZUAARDMSA-N 2 0 339.439 3.806 20 5 EHBDRP CCOc1ccc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000421882306 1028885082 /nfs/dbraw/zinc/88/50/82/1028885082.db2.gz RWUOOYBSYSYTBK-IUDNXUCKSA-N 2 0 335.448 3.517 20 5 EHBDRP CC[NH+]1CCC(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192904062 1030014916 /nfs/dbraw/zinc/01/49/16/1030014916.db2.gz JATVVFHWBXHCER-IBGZPJMESA-N 2 0 331.460 3.684 20 5 EHBDRP C[N@H+](CCCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000453593091 1030352441 /nfs/dbraw/zinc/35/24/41/1030352441.db2.gz GFWIXTQDYNIXJX-UHFFFAOYSA-N 2 0 343.427 3.819 20 5 EHBDRP C[C@@]1(CNCc2cccc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC000310852780 1036638464 /nfs/dbraw/zinc/63/84/64/1036638464.db2.gz AVXQRNAGHFYDER-FQEVSTJZSA-N 2 0 339.439 3.597 20 5 EHBDRP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCCCC[NH+]1CCCC1 ZINC000595038401 1037190160 /nfs/dbraw/zinc/19/01/60/1037190160.db2.gz NKMBQONEHSFFEV-HNNXBMFYSA-N 2 0 335.448 3.520 20 5 EHBDRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000271785236 1037273896 /nfs/dbraw/zinc/27/38/96/1037273896.db2.gz FIVFICQDRSHVJQ-UHFFFAOYSA-N 2 0 343.452 3.675 20 5 EHBDRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000236859650 1044766328 /nfs/dbraw/zinc/76/63/28/1044766328.db2.gz PWXUKQJWOZRQPA-ZDUSSCGKSA-N 2 0 327.856 3.848 20 5 EHBDRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000123223732 1128703697 /nfs/dbraw/zinc/70/36/97/1128703697.db2.gz BJJNWBCKALLZMR-OXJNMPFZSA-N 2 0 345.487 3.770 20 5 EHBDRP C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C[NH+]1CCCCC1 ZINC000480901979 1120347027 /nfs/dbraw/zinc/34/70/27/1120347027.db2.gz UVIYWUKQCGIIAU-QFBILLFUSA-N 2 0 345.487 3.628 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H]1C[C@@H]1CCC[NH+]1C ZINC001173232842 1132010751 /nfs/dbraw/zinc/01/07/51/1132010751.db2.gz IFTUMZWMXFCADK-UXPWSPDFSA-N 2 0 345.487 3.865 20 5 EHBDRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168998117 1132627338 /nfs/dbraw/zinc/62/73/38/1132627338.db2.gz ILULUGZIBZHFQP-NCXUSEDFSA-N 2 0 337.508 3.584 20 5 EHBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000865765618 1137310063 /nfs/dbraw/zinc/31/00/63/1137310063.db2.gz DSUYIUCLZVOTQB-UHFFFAOYSA-N 2 0 325.840 3.601 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000872079358 1137570241 /nfs/dbraw/zinc/57/02/41/1137570241.db2.gz XVMVBBUPSLMRMV-CYBMUJFWSA-N 2 0 337.489 3.842 20 5 EHBDRP CC[N@H+](CCC[NH+]1CCCC1)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000579776480 1014454845 /nfs/dbraw/zinc/45/48/45/1014454845.db2.gz OVYWTANSNSQQPX-SAPNQHFASA-N 2 0 331.460 3.806 20 5 EHBDRP C[C@@H]([NH2+]CCC[NH+](C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151901139 1032652878 /nfs/dbraw/zinc/65/28/78/1032652878.db2.gz AUKFHQQVZZOJLD-CYBMUJFWSA-N 2 0 333.457 3.926 20 5 EHBDRP CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[NH2+]CC1 ZINC000414715203 1017150757 /nfs/dbraw/zinc/15/07/57/1017150757.db2.gz MSUINIBHQAUMCE-INIZCTEOSA-N 2 0 343.427 3.819 20 5 EHBDRP C[NH2+]CCC[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414857887 1017246541 /nfs/dbraw/zinc/24/65/41/1017246541.db2.gz GLPARWBNPARREP-UHFFFAOYSA-N 2 0 349.818 3.740 20 5 EHBDRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000415029194 1017423453 /nfs/dbraw/zinc/42/34/53/1017423453.db2.gz ZVVPOXMYQKDZMP-OAHLLOKOSA-N 2 0 342.443 3.580 20 5 EHBDRP Cc1nccn1C[C@@H](C)C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000236653719 1017642102 /nfs/dbraw/zinc/64/21/02/1017642102.db2.gz PSZRXAYMKUVHHB-AWEZNQCLSA-N 2 0 330.432 3.649 20 5 EHBDRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000108427928 1023120579 /nfs/dbraw/zinc/12/05/79/1023120579.db2.gz YTVVKTTXXKFSGH-AWEZNQCLSA-N 2 0 345.468 3.755 20 5 EHBDRP CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501776710 1027531977 /nfs/dbraw/zinc/53/19/77/1027531977.db2.gz RDKTXYVXRCGSNI-UHFFFAOYSA-N 2 0 349.475 3.547 20 5 EHBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000423295620 1028353604 /nfs/dbraw/zinc/35/36/04/1028353604.db2.gz XAIURTJHROQGMB-KUHUBIRLSA-N 2 0 339.439 3.725 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423507639 1028472314 /nfs/dbraw/zinc/47/23/14/1028472314.db2.gz JXIZMKXHUKPUSI-QAPCUYQASA-N 2 0 327.428 3.596 20 5 EHBDRP C[NH+](C)C1CCC([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000421879015 1028883965 /nfs/dbraw/zinc/88/39/65/1028883965.db2.gz OFMAPHIIDXOEAH-WTNGLUPJSA-N 2 0 331.460 3.780 20 5 EHBDRP CC(C)c1ccc(C[N@@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)cc1[N+](=O)[O-] ZINC000424386624 1029038505 /nfs/dbraw/zinc/03/85/05/1029038505.db2.gz XRVHDSCBUJLLBL-HNNXBMFYSA-N 2 0 331.460 3.682 20 5 EHBDRP CC(C)c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000446885791 1029846758 /nfs/dbraw/zinc/84/67/58/1029846758.db2.gz WSFUJKNQPQDQPF-UHFFFAOYSA-N 2 0 331.460 3.682 20 5 EHBDRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000599071671 1033713299 /nfs/dbraw/zinc/71/32/99/1033713299.db2.gz SFHPGSYSQCZAHC-ZHALLVOQSA-N 2 0 345.487 3.628 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595900211 1034026622 /nfs/dbraw/zinc/02/66/22/1034026622.db2.gz BERHXONURATMNX-DOTOQJQBSA-N 2 0 331.460 3.676 20 5 EHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596096622 1034079338 /nfs/dbraw/zinc/07/93/38/1034079338.db2.gz VMEDWXJMCQELRH-FUHWJXTLSA-N 2 0 345.487 3.628 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000596092472 1034079766 /nfs/dbraw/zinc/07/97/66/1034079766.db2.gz ANXVASDKIBDLBR-JXFKEZNVSA-N 2 0 343.471 3.684 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000123655226 1040910103 /nfs/dbraw/zinc/91/01/03/1040910103.db2.gz WOTDYZWTHGTIOX-OAHLLOKOSA-N 2 0 327.428 3.816 20 5 EHBDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173350 1040992028 /nfs/dbraw/zinc/99/20/28/1040992028.db2.gz GHBAZFJDXQENIC-KSSFIOAISA-N 2 0 331.460 3.639 20 5 EHBDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000584593642 1041373146 /nfs/dbraw/zinc/37/31/46/1041373146.db2.gz KIRTVSKWOUTVJY-OLZOCXBDSA-N 2 0 347.390 3.742 20 5 EHBDRP CC1CC[NH+](C[C@H]2CCCN(Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000512170713 1043580236 /nfs/dbraw/zinc/58/02/36/1043580236.db2.gz UFVVWLHTVIXYCM-GOSISDBHSA-N 2 0 331.460 3.539 20 5 EHBDRP C[N@H+]1CC=C(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000494987436 1120923873 /nfs/dbraw/zinc/92/38/73/1120923873.db2.gz JGRYGNRJCFJAQX-HXUWFJFHSA-N 2 0 337.423 3.536 20 5 EHBDRP Cc1cc(N2CCC(c3ncc[nH]3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272809810 1124636893 /nfs/dbraw/zinc/63/68/93/1124636893.db2.gz GTNMKCOQJRJXBO-UHFFFAOYSA-N 2 0 337.383 3.559 20 5 EHBDRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902128 1131885171 /nfs/dbraw/zinc/88/51/71/1131885171.db2.gz VQRNALKJSZXVBS-QFBILLFUSA-N 2 0 347.503 3.942 20 5 EHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000788479328 1134130653 /nfs/dbraw/zinc/13/06/53/1134130653.db2.gz SQKXIZVJXZXPJG-UHFFFAOYSA-N 2 0 337.439 3.678 20 5 EHBDRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000173419316 1137095287 /nfs/dbraw/zinc/09/52/87/1137095287.db2.gz KGHAPCFSIXJUNV-ZDUSSCGKSA-N 2 0 331.391 3.646 20 5 EHBDRP C[NH+](C)C1(C)CCC([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000866517350 1137360940 /nfs/dbraw/zinc/36/09/40/1137360940.db2.gz HHTYRWFTTPXTLJ-ZCDLSOSASA-N 2 0 331.460 3.825 20 5 EHBDRP O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1CCCCC12CC[NH2+]CC2 ZINC000873232748 1137594456 /nfs/dbraw/zinc/59/44/56/1137594456.db2.gz KLXWYCYHKLOKKA-FZMUQLTDSA-N 2 0 329.444 3.510 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000449084115 1032139934 /nfs/dbraw/zinc/13/99/34/1032139934.db2.gz WPPJGDBYFZTHER-IAGOWNOFSA-N 2 0 333.476 3.770 20 5 EHBDRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414996527 1017377402 /nfs/dbraw/zinc/37/74/02/1017377402.db2.gz GLEXJJBMZJEOLN-ZFWWWQNUSA-N 2 0 345.468 3.930 20 5 EHBDRP CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703464 1018569653 /nfs/dbraw/zinc/56/96/53/1018569653.db2.gz AVXHJTUINJHSDS-AWEZNQCLSA-N 2 0 325.840 3.554 20 5 EHBDRP CC[NH+]1CCC(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000561161016 1019842985 /nfs/dbraw/zinc/84/29/85/1019842985.db2.gz WQURCTMQCNEORB-LJQANCHMSA-N 2 0 331.460 3.684 20 5 EHBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000423296149 1028354934 /nfs/dbraw/zinc/35/49/34/1028354934.db2.gz YJSKJBKSDTXAOL-YJYMSZOUSA-N 2 0 325.412 3.782 20 5 EHBDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423438291 1028445941 /nfs/dbraw/zinc/44/59/41/1028445941.db2.gz RBWBZFOJENEESY-KXBFYZLASA-N 2 0 327.428 3.791 20 5 EHBDRP CCc1ccc([C@H]([NH2+][C@@H](C)CCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423456742 1028448883 /nfs/dbraw/zinc/44/88/83/1028448883.db2.gz OEPGIVILPAXUCI-SCLBCKFNSA-N 2 0 331.416 3.557 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423507640 1028473109 /nfs/dbraw/zinc/47/31/09/1028473109.db2.gz JXIZMKXHUKPUSI-YJBOKZPZSA-N 2 0 327.428 3.596 20 5 EHBDRP Cc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000192922364 1030452787 /nfs/dbraw/zinc/45/27/87/1030452787.db2.gz OXVAKQYLEXKHSV-IBGZPJMESA-N 2 0 339.439 3.515 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](CC3CC3)CC1)CCC2 ZINC000595104282 1033691031 /nfs/dbraw/zinc/69/10/31/1033691031.db2.gz SDUHJCDWCSPSDQ-HXUWFJFHSA-N 2 0 343.471 3.684 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596059043 1034063507 /nfs/dbraw/zinc/06/35/07/1034063507.db2.gz MCWNNXXUFRHRLP-NXIIHZOPSA-N 2 0 343.471 3.710 20 5 EHBDRP Cc1c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094860 1034079634 /nfs/dbraw/zinc/07/96/34/1034079634.db2.gz NQWOMVHQIHTQEW-DOTOQJQBSA-N 2 0 331.460 3.676 20 5 EHBDRP Cc1c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000596094863 1034080337 /nfs/dbraw/zinc/08/03/37/1034080337.db2.gz NQWOMVHQIHTQEW-WBVHZDCISA-N 2 0 331.460 3.676 20 5 EHBDRP [NH3+]CCC[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000925630059 1040326230 /nfs/dbraw/zinc/32/62/30/1040326230.db2.gz PXUNLRJQYAITQR-KRWDZBQOSA-N 2 0 347.846 3.861 20 5 EHBDRP CC1(C)C[C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433058646 1040597933 /nfs/dbraw/zinc/59/79/33/1040597933.db2.gz QNBIMVWBMLFVFO-IBGZPJMESA-N 2 0 343.471 3.781 20 5 EHBDRP CC1(C)C[C@H](N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000433170622 1040963011 /nfs/dbraw/zinc/96/30/11/1040963011.db2.gz YGOJIYJMFHWIAY-GLJUWKHASA-N 2 0 329.444 3.534 20 5 EHBDRP Cc1cc(N[C@@H]2CCC[C@H]([NH+](C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302087605 1129767755 /nfs/dbraw/zinc/76/77/55/1129767755.db2.gz OAHDQMBRHPHEQD-KGLIPLIRSA-N 2 0 328.416 3.736 20 5 EHBDRP CC(C)[NH+]1CCC(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172899164 1131882773 /nfs/dbraw/zinc/88/27/73/1131882773.db2.gz LKHOXAICMSVQAN-LJQANCHMSA-N 2 0 345.487 3.552 20 5 EHBDRP CCCC[N@H+](C)CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899943 1131884413 /nfs/dbraw/zinc/88/44/13/1131884413.db2.gz QHZTZQNEJMBRMW-GOSISDBHSA-N 2 0 333.476 3.554 20 5 EHBDRP CC(C)C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173229658 1132008496 /nfs/dbraw/zinc/00/84/96/1132008496.db2.gz OQYWHVVXZLBYCP-KBAYOESNSA-N 2 0 333.476 3.754 20 5 EHBDRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000089215529 1138195787 /nfs/dbraw/zinc/19/57/87/1138195787.db2.gz JYUAAFAKESPCTM-OAHLLOKOSA-N 2 0 340.427 3.557 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000449183065 1032298034 /nfs/dbraw/zinc/29/80/34/1032298034.db2.gz KNUYQACQSOTPKO-HNNXBMFYSA-N 2 0 331.460 3.522 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000602023574 1032593374 /nfs/dbraw/zinc/59/33/74/1032593374.db2.gz ZQJSPFZDCCMDIH-XFQXTVEOSA-N 2 0 339.439 3.791 20 5 EHBDRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414999200 1017380246 /nfs/dbraw/zinc/38/02/46/1017380246.db2.gz JBBACTZXKDXSCI-KGLIPLIRSA-N 2 0 345.468 3.930 20 5 EHBDRP CC1(C)C[C@H](N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390418 1019258585 /nfs/dbraw/zinc/25/85/85/1019258585.db2.gz XJCHAXOGYFCURI-BZSNNMDCSA-N 2 0 329.444 3.534 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000572887067 1028196768 /nfs/dbraw/zinc/19/67/68/1028196768.db2.gz JIYGWDOIXGOULX-APEZIOSESA-N 2 0 343.471 3.662 20 5 EHBDRP C[NH+](C)C1CCC([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000421371171 1028329998 /nfs/dbraw/zinc/32/99/98/1028329998.db2.gz KIZBFESAKCKVFL-HJZRJOMTSA-N 2 0 345.487 3.768 20 5 EHBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000594523049 1033431590 /nfs/dbraw/zinc/43/15/90/1033431590.db2.gz VXKGWJGXOAIFQK-AKAXFMLLSA-N 2 0 345.468 3.753 20 5 EHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596096623 1034080424 /nfs/dbraw/zinc/08/04/24/1034080424.db2.gz VMEDWXJMCQELRH-SJLPKXTDSA-N 2 0 345.487 3.628 20 5 EHBDRP C[NH+](C)[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000365462069 1035086464 /nfs/dbraw/zinc/08/64/64/1035086464.db2.gz PMGFHNYVGDAOIV-HNNXBMFYSA-N 2 0 343.427 3.771 20 5 EHBDRP Cc1c(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000057888606 1037242653 /nfs/dbraw/zinc/24/26/53/1037242653.db2.gz UROIOXKSIVTZSL-UHFFFAOYSA-N 2 0 345.487 3.991 20 5 EHBDRP CN(Cc1ccccc1[N+](=O)[O-])C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076110237 1037322614 /nfs/dbraw/zinc/32/26/14/1037322614.db2.gz QCZWISMDYHIKNP-SFHVURJKSA-N 2 0 339.439 3.549 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCC2 ZINC000417369436 1039737768 /nfs/dbraw/zinc/73/77/68/1039737768.db2.gz PHFCUGKYGMBAOY-IBGZPJMESA-N 2 0 336.395 3.800 20 5 EHBDRP C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1CC[NH+](C)CC1 ZINC000132217677 1129883454 /nfs/dbraw/zinc/88/34/54/1129883454.db2.gz WGCZFAHWVJSSMA-UHFFFAOYSA-N 2 0 343.427 3.628 20 5 EHBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902129 1131885045 /nfs/dbraw/zinc/88/50/45/1131885045.db2.gz VQRNALKJSZXVBS-VQIMIIECSA-N 2 0 347.503 3.942 20 5 EHBDRP C[C@H](C[NH3+])C[N@H+](Cc1ccccc1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220892 1132004666 /nfs/dbraw/zinc/00/46/66/1132004666.db2.gz HSRSGIVLFUZHAS-SJORKVTESA-N 2 0 341.455 3.623 20 5 EHBDRP C[NH+](C)Cc1ccc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000809738912 1135883592 /nfs/dbraw/zinc/88/35/92/1135883592.db2.gz OZLUJPPHCXZDCP-SOFGYWHQSA-N 2 0 339.439 3.802 20 5 EHBDRP C[C@H](CN1CC[NH+](C)CC1)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000106485835 1136115025 /nfs/dbraw/zinc/11/50/25/1136115025.db2.gz QFYOOGACGGLSRY-GOSISDBHSA-N 2 0 347.506 3.719 20 5 EHBDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173387610 1136989680 /nfs/dbraw/zinc/98/96/80/1136989680.db2.gz QLWRXOXFRHMFRA-HNNXBMFYSA-N 2 0 327.428 3.897 20 5 EHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000873009277 1137587887 /nfs/dbraw/zinc/58/78/87/1137587887.db2.gz VNKDTRPFOVSZPA-UHFFFAOYSA-N 2 0 327.428 3.563 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873265007 1137595618 /nfs/dbraw/zinc/59/56/18/1137595618.db2.gz SEUQWJUGDNSUJT-LVQVYYBASA-N 2 0 349.500 3.586 20 5 EHBDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000123979930 1138277047 /nfs/dbraw/zinc/27/70/47/1138277047.db2.gz JRJYIFSDXJODIH-OAHLLOKOSA-N 2 0 327.428 3.897 20 5 EHBDRP C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCC[NH2+]C1 ZINC000414858602 1017245379 /nfs/dbraw/zinc/24/53/79/1017245379.db2.gz SCNZIMRILNCILH-UKRRQHHQSA-N 2 0 345.468 3.801 20 5 EHBDRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000414930666 1017325673 /nfs/dbraw/zinc/32/56/73/1017325673.db2.gz TXVKHLAYCHGIDX-NEPJUHHUSA-N 2 0 349.818 3.868 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC[C@H]2CCC[NH2+]2)s1 ZINC000414975619 1017368394 /nfs/dbraw/zinc/36/83/94/1017368394.db2.gz OXUQLPBRIFNJRB-AWEZNQCLSA-N 2 0 345.468 3.945 20 5 EHBDRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000415042430 1017448047 /nfs/dbraw/zinc/44/80/47/1017448047.db2.gz QVKDTVVMTQYJGS-CHWSQXEVSA-N 2 0 331.441 3.540 20 5 EHBDRP CCc1ccccc1[C@H](N)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415070021 1017502190 /nfs/dbraw/zinc/50/21/90/1017502190.db2.gz UEUAZGFSCJSEAB-DNVCBOLYSA-N 2 0 341.455 3.768 20 5 EHBDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000183188367 1020545709 /nfs/dbraw/zinc/54/57/09/1020545709.db2.gz DKNFGLYDYGIMST-YQQAZPJKSA-N 2 0 331.460 3.898 20 5 EHBDRP Cc1c(CN2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475454 1023246823 /nfs/dbraw/zinc/24/68/23/1023246823.db2.gz XAKNSKZHOLWYIM-SJLPKXTDSA-N 2 0 345.487 3.990 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCCC1 ZINC000423176128 1028244045 /nfs/dbraw/zinc/24/40/45/1028244045.db2.gz GGLSKHZMBFEKFD-AWEZNQCLSA-N 2 0 337.489 3.717 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1([NH3+])CCCCC1 ZINC000423176129 1028245984 /nfs/dbraw/zinc/24/59/84/1028245984.db2.gz GGLSKHZMBFEKFD-CQSZACIVSA-N 2 0 337.489 3.717 20 5 EHBDRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000593315812 1034634211 /nfs/dbraw/zinc/63/42/11/1034634211.db2.gz FERGRDKOYKPFCD-UHFFFAOYSA-N 2 0 327.428 3.727 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000414204108 1036053407 /nfs/dbraw/zinc/05/34/07/1036053407.db2.gz ZYPRKYGVNYNYBW-KDOFPFPSSA-N 2 0 331.460 3.639 20 5 EHBDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761506938 1037078267 /nfs/dbraw/zinc/07/82/67/1037078267.db2.gz QAXZXMFNNNCXKO-UHFFFAOYSA-N 2 0 339.867 3.800 20 5 EHBDRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000123223206 1128702632 /nfs/dbraw/zinc/70/26/32/1128702632.db2.gz BJJNWBCKALLZMR-UZLBHIALSA-N 2 0 345.487 3.770 20 5 EHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC000922847105 1129689546 /nfs/dbraw/zinc/68/95/46/1129689546.db2.gz VSJGYUJPVHETLD-UHFFFAOYSA-N 2 0 331.460 3.708 20 5 EHBDRP C[C@@H](C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)CC(C)(C)CC[NH3+] ZINC001172903408 1131886397 /nfs/dbraw/zinc/88/63/97/1131886397.db2.gz QYEVGEJLGRHOMH-CRAIPNDOSA-N 2 0 347.503 3.833 20 5 EHBDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000102423188 1135551109 /nfs/dbraw/zinc/55/11/09/1135551109.db2.gz CKXRLBMWKZJGNO-CQSZACIVSA-N 2 0 345.468 3.755 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811488610 1136092857 /nfs/dbraw/zinc/09/28/57/1136092857.db2.gz FDJFVXNMAZJNDD-UHFFFAOYSA-N 2 0 346.258 3.723 20 5 EHBDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000865765484 1137309998 /nfs/dbraw/zinc/30/99/98/1137309998.db2.gz WYMXJQJQEZVORQ-UHFFFAOYSA-N 2 0 325.840 3.601 20 5 EHBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000866517863 1137360922 /nfs/dbraw/zinc/36/09/22/1137360922.db2.gz PPSHEDNVBDBVEE-IMUUDWKMSA-N 2 0 337.439 3.517 20 5 EHBDRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000459727006 1032432875 /nfs/dbraw/zinc/43/28/75/1032432875.db2.gz GXSZLDMAMFNIOA-HNNXBMFYSA-N 2 0 343.427 3.676 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000459777275 1032463454 /nfs/dbraw/zinc/46/34/54/1032463454.db2.gz KLXAHJAXQUUYRQ-ZHALLVOQSA-N 2 0 345.487 3.628 20 5 EHBDRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414840528 1017232693 /nfs/dbraw/zinc/23/26/93/1017232693.db2.gz KLPJAGSMMDDKII-RDJZCZTQSA-N 2 0 331.460 3.557 20 5 EHBDRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414840530 1017232812 /nfs/dbraw/zinc/23/28/12/1017232812.db2.gz KLPJAGSMMDDKII-WBVHZDCISA-N 2 0 331.460 3.557 20 5 EHBDRP C[C@@H]([NH2+]Cc1cccc(Cn2ccnc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000151351590 1021309005 /nfs/dbraw/zinc/30/90/05/1021309005.db2.gz QBEOIBAYLRBPAX-OAHLLOKOSA-N 2 0 336.395 3.690 20 5 EHBDRP Cc1cc(NC[C@H](C)C[NH+]2CCCC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302054564 1022681465 /nfs/dbraw/zinc/68/14/65/1022681465.db2.gz ACHNLTWTCCXCDO-ZDUSSCGKSA-N 2 0 328.416 3.595 20 5 EHBDRP O=[N+]([O-])c1ccc([C@H]2CCCN(CCC[NH+]3CCCCC3)C2)cc1 ZINC000451545143 1026095249 /nfs/dbraw/zinc/09/52/49/1026095249.db2.gz GLELBJLYDSFWTO-SFHVURJKSA-N 2 0 331.460 3.650 20 5 EHBDRP C[N@H+](CCCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000453390730 1030234379 /nfs/dbraw/zinc/23/43/79/1030234379.db2.gz DIKWEKDPCBEZPB-SFHVURJKSA-N 2 0 331.460 3.781 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000598998913 1033635219 /nfs/dbraw/zinc/63/52/19/1033635219.db2.gz ZCJFANUGNNSFPZ-LSSBLYJVSA-N 2 0 329.444 3.605 20 5 EHBDRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cccc1[N+](=O)[O-] ZINC000595104219 1033691124 /nfs/dbraw/zinc/69/11/24/1033691124.db2.gz QWTQCKOSYPAUTL-HNNXBMFYSA-N 2 0 331.460 3.676 20 5 EHBDRP CC1CC[NH+](CCC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000480169586 1039244916 /nfs/dbraw/zinc/24/49/16/1039244916.db2.gz VMZJCPFIBIRCAB-IBGZPJMESA-N 2 0 345.487 3.628 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417339959 1039687751 /nfs/dbraw/zinc/68/77/51/1039687751.db2.gz JDVXMWAUEHCBFO-GOSISDBHSA-N 2 0 331.460 3.684 20 5 EHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000573526908 1040154377 /nfs/dbraw/zinc/15/43/77/1040154377.db2.gz SRTZUWLCZDBJHF-UHFFFAOYSA-N 2 0 341.455 3.987 20 5 EHBDRP Cc1cc(NC[C@@H]2CC[N@@H+](C(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000326334684 1121649151 /nfs/dbraw/zinc/64/91/51/1121649151.db2.gz IJIYDXWYDQBPOJ-AWEZNQCLSA-N 2 0 328.416 3.594 20 5 EHBDRP CCC[N@@H+]1CC[C@H](CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000302207311 1129773229 /nfs/dbraw/zinc/77/32/29/1129773229.db2.gz XJHPIQVARRZXLT-CQSZACIVSA-N 2 0 328.416 3.595 20 5 EHBDRP CC[NH+](CC)C1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172918204 1131904691 /nfs/dbraw/zinc/90/46/91/1131904691.db2.gz YXVJFGYUSACLML-SFHVURJKSA-N 2 0 345.487 3.648 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](CC(C)(C)C)CC1 ZINC001173220910 1132004681 /nfs/dbraw/zinc/00/46/81/1132004681.db2.gz IAKBWNHUTQFSTE-OAHLLOKOSA-N 2 0 333.476 3.626 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1 ZINC001173226557 1132007043 /nfs/dbraw/zinc/00/70/43/1132007043.db2.gz KJSGJZPSVPNKMY-MJGOQNOKSA-N 2 0 345.487 3.866 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC(C)(C)C[C@](C)(C[NH3+])C1 ZINC001173234104 1132010379 /nfs/dbraw/zinc/01/03/79/1132010379.db2.gz MQHSADHVWXSZDQ-IDHHARJASA-N 2 0 333.476 3.659 20 5 EHBDRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788538971 1134139387 /nfs/dbraw/zinc/13/93/87/1134139387.db2.gz JAJIHOQDKYHSLF-BZUAXINKSA-N 2 0 348.491 3.586 20 5 EHBDRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000102423211 1135551257 /nfs/dbraw/zinc/55/12/57/1135551257.db2.gz ROTMMRPKVDVILH-CQSZACIVSA-N 2 0 345.468 3.755 20 5 EHBDRP C[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1CCC[NH3+] ZINC000852758992 1136483574 /nfs/dbraw/zinc/48/35/74/1136483574.db2.gz IOCKGJWKJWRDAL-IUODEOHRSA-N 2 0 325.840 3.588 20 5 EHBDRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000815586496 1136615058 /nfs/dbraw/zinc/61/50/58/1136615058.db2.gz KEKYFGRZROEWLH-HNNXBMFYSA-N 2 0 348.491 3.586 20 5 EHBDRP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCCC[NH+]1CCCC1 ZINC000866363169 1137349677 /nfs/dbraw/zinc/34/96/77/1137349677.db2.gz KEERIXZHOBHHPE-HNNXBMFYSA-N 2 0 337.439 3.521 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000459777272 1032464233 /nfs/dbraw/zinc/46/42/33/1032464233.db2.gz KLXAHJAXQUUYRQ-AOIWGVFYSA-N 2 0 345.487 3.628 20 5 EHBDRP CC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000414716278 1017149393 /nfs/dbraw/zinc/14/93/93/1017149393.db2.gz NUZKJBJBJYWORT-MRXNPFEDSA-N 2 0 343.427 3.819 20 5 EHBDRP C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCC[NH2+]C1 ZINC000414858597 1017245708 /nfs/dbraw/zinc/24/57/08/1017245708.db2.gz SCNZIMRILNCILH-DZGCQCFKSA-N 2 0 345.468 3.801 20 5 EHBDRP [NH3+]C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000415031558 1017431773 /nfs/dbraw/zinc/43/17/73/1017431773.db2.gz HCNAFCBRNBCKLY-NEPJUHHUSA-N 2 0 349.818 3.725 20 5 EHBDRP CC1(C)C[NH2+]CC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414974006 1023203431 /nfs/dbraw/zinc/20/34/31/1023203431.db2.gz NJWMUQGEAKZSIS-KRWDZBQOSA-N 2 0 345.468 3.801 20 5 EHBDRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548412 1026099194 /nfs/dbraw/zinc/09/91/94/1026099194.db2.gz MXZTZBHSYLMIPB-ZWKOTPCHSA-N 2 0 331.460 3.649 20 5 EHBDRP O=[N+]([O-])c1cccc([C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccccc2)c1 ZINC000423476619 1028460507 /nfs/dbraw/zinc/46/05/07/1028460507.db2.gz JCCVIXGFSHFZTJ-QUCCMNQESA-N 2 0 339.439 3.806 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC[NH+]3CCCC3)s2)cc1 ZINC000237988488 1030710612 /nfs/dbraw/zinc/71/06/12/1030710612.db2.gz YGDIJWMBYUBPMY-UHFFFAOYSA-N 2 0 345.468 3.899 20 5 EHBDRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000192635086 1030874091 /nfs/dbraw/zinc/87/40/91/1030874091.db2.gz LYGYLPWYKTYDJC-HXUWFJFHSA-N 2 0 339.439 3.824 20 5 EHBDRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1[N+](=O)[O-] ZINC000595103955 1033692215 /nfs/dbraw/zinc/69/22/15/1033692215.db2.gz PMYWWOXXDGPDGC-HNNXBMFYSA-N 2 0 331.460 3.676 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000596092477 1034079487 /nfs/dbraw/zinc/07/94/87/1034079487.db2.gz ANXVASDKIBDLBR-OXQOHEQNSA-N 2 0 343.471 3.684 20 5 EHBDRP CC(C)c1ccc(C[N@@H+]2CCCC23CC[NH+](C)CC3)cc1[N+](=O)[O-] ZINC000472612860 1037377161 /nfs/dbraw/zinc/37/71/61/1037377161.db2.gz QRNVJKPXELICTK-UHFFFAOYSA-N 2 0 331.460 3.778 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCC[NH+]1CCCC1 ZINC000549875248 1037514508 /nfs/dbraw/zinc/51/45/08/1037514508.db2.gz IPLLQYFCGDEPCY-SAPNQHFASA-N 2 0 331.460 3.854 20 5 EHBDRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000584593641 1041366916 /nfs/dbraw/zinc/36/69/16/1041366916.db2.gz KIRTVSKWOUTVJY-CHWSQXEVSA-N 2 0 347.390 3.742 20 5 EHBDRP C[NH+]1CCN(CCC[NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000072786139 1126881933 /nfs/dbraw/zinc/88/19/33/1126881933.db2.gz BTJPCNXTDLFKHH-UHFFFAOYSA-N 2 0 347.506 3.720 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC001173222843 1132005532 /nfs/dbraw/zinc/00/55/32/1132005532.db2.gz ZLVXIMSTMMIGGL-MRXNPFEDSA-N 2 0 345.487 3.770 20 5 EHBDRP CC1=CCC[N@H+](CC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC001181253855 1133473379 /nfs/dbraw/zinc/47/33/79/1133473379.db2.gz FMMBAEOUQHGNHL-UHFFFAOYSA-N 2 0 343.471 3.501 20 5 EHBDRP C[NH+](C)C1(C)CCC([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000866515843 1137360733 /nfs/dbraw/zinc/36/07/33/1137360733.db2.gz KAXGCSOUHJNWGN-FDYSRKEFSA-N 2 0 345.487 3.768 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000271128439 1141310269 /nfs/dbraw/zinc/31/02/69/1141310269.db2.gz LAIZTEMBCWBCRL-CABCVRRESA-N 2 0 349.500 3.539 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000449106256 1032185997 /nfs/dbraw/zinc/18/59/97/1032185997.db2.gz LMXFQSSYBOUHMX-MRXNPFEDSA-N 2 0 345.487 3.770 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000449106255 1032186124 /nfs/dbraw/zinc/18/61/24/1032186124.db2.gz LMXFQSSYBOUHMX-INIZCTEOSA-N 2 0 345.487 3.770 20 5 EHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415054958 1017478089 /nfs/dbraw/zinc/47/80/89/1017478089.db2.gz OFPDOIMPOXZVKW-VQIMIIECSA-N 2 0 341.455 3.986 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592491870 1032928598 /nfs/dbraw/zinc/92/85/98/1032928598.db2.gz MQIAAEHXGPLPSC-YESZJQIVSA-N 2 0 331.460 3.676 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@H]3[NH2+]CC[C@@H]3C2)s1 ZINC000427105298 1023216462 /nfs/dbraw/zinc/21/64/62/1023216462.db2.gz XHNPQKXHRIYAGJ-CZUORRHYSA-N 2 0 343.452 3.507 20 5 EHBDRP CCCC[N@H+](C)CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000074319761 1024141875 /nfs/dbraw/zinc/14/18/75/1024141875.db2.gz BJURCKFBNANMMC-UHFFFAOYSA-N 2 0 333.476 3.581 20 5 EHBDRP O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422920461 1028076816 /nfs/dbraw/zinc/07/68/16/1028076816.db2.gz MCZFEYLKIRYUEW-VAMGGRTRSA-N 2 0 345.487 3.818 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000504926265 1029072601 /nfs/dbraw/zinc/07/26/01/1029072601.db2.gz HEYVYOIKRBTDGY-BZUAXINKSA-N 2 0 349.500 3.682 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000160872391 1031124012 /nfs/dbraw/zinc/12/40/12/1031124012.db2.gz UUIWEMYEQDCICS-HNNXBMFYSA-N 2 0 327.428 3.816 20 5 EHBDRP COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000595003485 1033629046 /nfs/dbraw/zinc/62/90/46/1033629046.db2.gz HHZIVLCDHNWNRN-AWEZNQCLSA-N 2 0 343.427 3.516 20 5 EHBDRP C[NH+]1CCC(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433172522 1040971453 /nfs/dbraw/zinc/97/14/53/1040971453.db2.gz CSYIKBRRKQPNCR-GOSISDBHSA-N 2 0 331.460 3.639 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC000922845482 1129688193 /nfs/dbraw/zinc/68/81/93/1129688193.db2.gz RCPAEUBTYNOKIU-DTQAZKPQSA-N 2 0 343.471 3.995 20 5 EHBDRP Cc1ccccc1C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168998341 1132627189 /nfs/dbraw/zinc/62/71/89/1132627189.db2.gz LLZLHXKKHPKGFS-LEAZDLGRSA-N 2 0 345.487 3.512 20 5 EHBDRP CC[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000178039018 1021026685 /nfs/dbraw/zinc/02/66/85/1021026685.db2.gz LOUPBUDTVBBJBF-MDZRGWNJSA-N 2 0 349.475 3.525 20 5 EHBDRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414899287 1021628827 /nfs/dbraw/zinc/62/88/27/1021628827.db2.gz UQKHOFFVXLDUGJ-GFCCVEGCSA-N 2 0 349.818 3.867 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCCN1C1CC1 ZINC000434789379 1024426533 /nfs/dbraw/zinc/42/65/33/1024426533.db2.gz MKTLNDCRAKGUNQ-ILCZHQDMSA-N 2 0 329.444 3.605 20 5 EHBDRP CC[NH2+]CC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000347232051 1025700169 /nfs/dbraw/zinc/70/01/69/1025700169.db2.gz YLHMHMFPLBUSNC-UHFFFAOYSA-N 2 0 343.427 3.676 20 5 EHBDRP O=[N+]([O-])c1ccc([C@@H]2CCCN(CCC[NH+]3CCCCC3)C2)cc1 ZINC000451545142 1026094047 /nfs/dbraw/zinc/09/40/47/1026094047.db2.gz GLELBJLYDSFWTO-GOSISDBHSA-N 2 0 331.460 3.650 20 5 EHBDRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000423296147 1028355525 /nfs/dbraw/zinc/35/55/25/1028355525.db2.gz YJSKJBKSDTXAOL-DJJJIMSYSA-N 2 0 325.412 3.782 20 5 EHBDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587025 1030321835 /nfs/dbraw/zinc/32/18/35/1030321835.db2.gz PWWBJURSHFAEKY-UZLBHIALSA-N 2 0 345.487 3.930 20 5 EHBDRP C[N@H+](CCCC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000453604310 1030392581 /nfs/dbraw/zinc/39/25/81/1030392581.db2.gz ZDEBEZMGHQQYIN-UHFFFAOYSA-N 2 0 343.427 3.819 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCCC[NH+]1CCCC1)CCC2 ZINC000340478017 1031025168 /nfs/dbraw/zinc/02/51/68/1031025168.db2.gz YNNOLZCZGYZSBY-IBGZPJMESA-N 2 0 331.460 3.828 20 5 EHBDRP CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000536652118 1032036698 /nfs/dbraw/zinc/03/66/98/1032036698.db2.gz LPPJBVOOBCNHEU-UHFFFAOYSA-N 2 0 349.475 3.546 20 5 EHBDRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000603857056 1033980744 /nfs/dbraw/zinc/98/07/44/1033980744.db2.gz PHMHRLXLLVSBDY-UHFFFAOYSA-N 2 0 349.475 3.547 20 5 EHBDRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000414204109 1036051772 /nfs/dbraw/zinc/05/17/72/1036051772.db2.gz ZYPRKYGVNYNYBW-KSSFIOAISA-N 2 0 331.460 3.639 20 5 EHBDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000922844873 1129690977 /nfs/dbraw/zinc/69/09/77/1129690977.db2.gz JBCRZSOZKHUQQI-UHFFFAOYSA-N 2 0 337.851 3.745 20 5 EHBDRP CC1CC[NH+](CCC[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172899246 1131882582 /nfs/dbraw/zinc/88/25/82/1131882582.db2.gz NAIKVZVTJJJGLW-IBGZPJMESA-N 2 0 345.487 3.554 20 5 EHBDRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909653 1131917144 /nfs/dbraw/zinc/91/71/44/1131917144.db2.gz UTFRZSUOMSHIGI-XFQXTVEOSA-N 2 0 345.487 3.551 20 5 EHBDRP CCCC[NH+]1CCC([N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173238745 1132028038 /nfs/dbraw/zinc/02/80/38/1132028038.db2.gz XFENHIRWJCVSFV-MRXNPFEDSA-N 2 0 333.476 3.722 20 5 EHBDRP Cc1ccc(C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001168997181 1132627821 /nfs/dbraw/zinc/62/78/21/1132627821.db2.gz BVQVQDKQMNEPSY-WTGUMLROSA-N 2 0 345.487 3.512 20 5 EHBDRP CC(C)[N@H+](Cc1cc2c(s1)CC[NH2+]C2)Cc1ccc([N+](=O)[O-])cc1 ZINC000873203593 1137593956 /nfs/dbraw/zinc/59/39/56/1137593956.db2.gz JDNAGAQTPRASGS-UHFFFAOYSA-N 2 0 345.468 3.713 20 5 EHBDRP C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCC[NH2+]C1 ZINC000414858604 1017245417 /nfs/dbraw/zinc/24/54/17/1017245417.db2.gz SCNZIMRILNCILH-ZFWWWQNUSA-N 2 0 345.468 3.801 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000415021061 1017405873 /nfs/dbraw/zinc/40/58/73/1017405873.db2.gz HBJHBVCNHQXPFP-SHTZXODSSA-N 2 0 343.427 3.710 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000415022669 1017410754 /nfs/dbraw/zinc/41/07/54/1017410754.db2.gz JFYSNETYGVCKBB-YWTNHNAXSA-N 2 0 345.487 3.661 20 5 EHBDRP [NH3+]CCC[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000415060695 1017487855 /nfs/dbraw/zinc/48/78/55/1017487855.db2.gz XHZLGPVIEADLRL-VTSXBNNFSA-N 2 0 325.412 3.678 20 5 EHBDRP C[C@@H]([NH3+])C[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000592439051 1032844251 /nfs/dbraw/zinc/84/42/51/1032844251.db2.gz YTLRXHSYSYLSJH-MNOVXSKESA-N 2 0 337.807 3.724 20 5 EHBDRP Cc1c(CN2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000506475452 1023246290 /nfs/dbraw/zinc/24/62/90/1023246290.db2.gz XAKNSKZHOLWYIM-AEFFLSMTSA-N 2 0 345.487 3.990 20 5 EHBDRP CC(C)[N@H+](C)CC1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000535811318 1023651711 /nfs/dbraw/zinc/65/17/11/1023651711.db2.gz CTRABTBPFIUHSK-VURMDHGXSA-N 2 0 331.460 3.660 20 5 EHBDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423398883 1028413254 /nfs/dbraw/zinc/41/32/54/1028413254.db2.gz PDHVOOPINYJCKS-IPYPFGDCSA-N 2 0 345.468 3.972 20 5 EHBDRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423476731 1028459994 /nfs/dbraw/zinc/45/99/94/1028459994.db2.gz RDDGYHJLPTUXJF-QKYXUNIQSA-N 2 0 339.439 3.791 20 5 EHBDRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000414204107 1036052747 /nfs/dbraw/zinc/05/27/47/1036052747.db2.gz ZYPRKYGVNYNYBW-KBXCAEBGSA-N 2 0 331.460 3.639 20 5 EHBDRP C[C@H](C[C@H](C)[NH3+])[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000584593643 1039351452 /nfs/dbraw/zinc/35/14/52/1039351452.db2.gz KIRTVSKWOUTVJY-QWHCGFSZSA-N 2 0 347.390 3.742 20 5 EHBDRP C[NH+]1CCC(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433172523 1040970155 /nfs/dbraw/zinc/97/01/55/1040970155.db2.gz CSYIKBRRKQPNCR-SFHVURJKSA-N 2 0 331.460 3.639 20 5 EHBDRP CCC[N@H+](CCC[NH+](C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914063 1131902498 /nfs/dbraw/zinc/90/24/98/1131902498.db2.gz YSDCBOREFJZZCY-SFHVURJKSA-N 2 0 333.476 3.506 20 5 EHBDRP CC[C@H]1CCC[N@@H+]1CC1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001179863573 1133295048 /nfs/dbraw/zinc/29/50/48/1133295048.db2.gz PKOJNLBHPQUQAO-IBGZPJMESA-N 2 0 345.487 3.724 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000449082543 1032137700 /nfs/dbraw/zinc/13/77/00/1032137700.db2.gz OBRAWBAETVBAGJ-QGZVFWFLSA-N 2 0 333.476 3.628 20 5 EHBDRP CC1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]CC1 ZINC000414904642 1017298835 /nfs/dbraw/zinc/29/88/35/1017298835.db2.gz NQJVIBFAIUCDOA-UHFFFAOYSA-N 2 0 345.468 3.803 20 5 EHBDRP CC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1[NH3+] ZINC000592427624 1032815465 /nfs/dbraw/zinc/81/54/65/1032815465.db2.gz JFBZSKYVLDHTCJ-XJKSGUPXSA-N 2 0 345.468 3.883 20 5 EHBDRP [NH3+]C1CCC([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000423229214 1028294328 /nfs/dbraw/zinc/29/43/28/1028294328.db2.gz GWAJNNGGOMGTPI-FAFZWHIHSA-N 2 0 325.412 3.544 20 5 EHBDRP CC1(C)C[C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2cc([N+](=O)[O-])ccc21 ZINC000423385989 1028402051 /nfs/dbraw/zinc/40/20/51/1028402051.db2.gz LPWAWQCAJMCWTI-IBGZPJMESA-N 2 0 337.423 3.710 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CN)C1CCCC1 ZINC000423504701 1028469296 /nfs/dbraw/zinc/46/92/96/1028469296.db2.gz NUHVEZGIOZDESX-GJZGRUSLSA-N 2 0 337.489 3.573 20 5 EHBDRP C[C@H](CC[NH+](C)C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237446656 1029310743 /nfs/dbraw/zinc/31/07/43/1029310743.db2.gz JZKGWBQGDUNAEK-CYBMUJFWSA-N 2 0 333.457 3.753 20 5 EHBDRP C[N@@H+]1CCCC[C@@H](C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068692 1033709070 /nfs/dbraw/zinc/70/90/70/1033709070.db2.gz CJHMXCIVKJMZTQ-KSSFIOAISA-N 2 0 331.460 3.639 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000595900799 1034026978 /nfs/dbraw/zinc/02/69/78/1034026978.db2.gz LNFMZPAGKPWGCM-WBVHZDCISA-N 2 0 331.460 3.676 20 5 EHBDRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000442925059 1036741951 /nfs/dbraw/zinc/74/19/51/1036741951.db2.gz TXUDZVHWARJFPT-AWEZNQCLSA-N 2 0 345.468 3.884 20 5 EHBDRP Cc1nccn1C[C@H](C)C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314605 1039669206 /nfs/dbraw/zinc/66/92/06/1039669206.db2.gz RMKMAWOBCIGZOC-AUUYWEPGSA-N 2 0 342.443 3.793 20 5 EHBDRP C[NH+]1CCC(CCC[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172903216 1131884793 /nfs/dbraw/zinc/88/47/93/1131884793.db2.gz PMFYFZZDGXOULA-IBGZPJMESA-N 2 0 345.487 3.554 20 5 EHBDRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000106485831 1136114647 /nfs/dbraw/zinc/11/46/47/1136114647.db2.gz QFYOOGACGGLSRY-SFHVURJKSA-N 2 0 347.506 3.719 20 5 EHBDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1 ZINC000872034007 1137566582 /nfs/dbraw/zinc/56/65/82/1137566582.db2.gz KYDBAUKLGPAZET-CYBMUJFWSA-N 2 0 337.489 3.699 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449233805 1032328216 /nfs/dbraw/zinc/32/82/16/1032328216.db2.gz NEFQQRHDNBOIIQ-SOLBZPMBSA-N 2 0 345.487 3.768 20 5 EHBDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]1 ZINC000414952392 1017351441 /nfs/dbraw/zinc/35/14/41/1017351441.db2.gz QQRGAABWCLIUQZ-TZMCWYRMSA-N 2 0 331.441 3.553 20 5 EHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000340598136 1018614983 /nfs/dbraw/zinc/61/49/83/1018614983.db2.gz QCRAHTHFYQPWEC-UHFFFAOYSA-N 2 0 327.428 3.679 20 5 EHBDRP [NH3+]CCCC[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414913606 1022143979 /nfs/dbraw/zinc/14/39/79/1022143979.db2.gz WJHBOADMOWGUBH-UHFFFAOYSA-N 2 0 349.818 3.869 20 5 EHBDRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423398889 1028412084 /nfs/dbraw/zinc/41/20/84/1028412084.db2.gz PDHVOOPINYJCKS-YDHLFZDLSA-N 2 0 345.468 3.972 20 5 EHBDRP CC(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)cc1[N+](=O)[O-] ZINC000414785340 1029026452 /nfs/dbraw/zinc/02/64/52/1029026452.db2.gz SMSWCTHUKXSGKG-IAGOWNOFSA-N 2 0 331.460 3.540 20 5 EHBDRP [NH3+]CC1(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000593314845 1034629582 /nfs/dbraw/zinc/62/95/82/1034629582.db2.gz GEXIHVFVVXUEGH-UHFFFAOYSA-N 2 0 349.818 3.727 20 5 EHBDRP C[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000180459949 1036864047 /nfs/dbraw/zinc/86/40/47/1036864047.db2.gz OORMJKXIBOJDMT-HXUWFJFHSA-N 2 0 339.439 3.616 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000468643842 1037786586 /nfs/dbraw/zinc/78/65/86/1037786586.db2.gz UTBRHHVKBARQMA-MHWRWJLKSA-N 2 0 339.439 3.850 20 5 EHBDRP O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000255210931 1129046193 /nfs/dbraw/zinc/04/61/93/1129046193.db2.gz IDEGDDWVSWEWHK-GNJLHFKMSA-N 2 0 329.444 3.558 20 5 EHBDRP C[C@H](CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCCC1 ZINC000543416017 1129475373 /nfs/dbraw/zinc/47/53/73/1129475373.db2.gz ICHLUNSTOGDQEH-APWZRJJASA-N 2 0 345.487 3.770 20 5 EHBDRP CC1([NH+]2CCC2)CCC([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000922848354 1129690604 /nfs/dbraw/zinc/69/06/04/1129690604.db2.gz SCPZYIPINQYJPF-DAXSKMNVSA-N 2 0 329.444 3.605 20 5 EHBDRP CC[NH+](CC)CCCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900725 1131884335 /nfs/dbraw/zinc/88/43/35/1131884335.db2.gz YRJXXVPLHSNAPG-SFHVURJKSA-N 2 0 333.476 3.554 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC001173220075 1132003579 /nfs/dbraw/zinc/00/35/79/1132003579.db2.gz SVWGFCPQOKIJHU-HNNXBMFYSA-N 2 0 331.460 3.522 20 5 EHBDRP CC1CC[NH+](CC[C@@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001175353472 1132647543 /nfs/dbraw/zinc/64/75/43/1132647543.db2.gz ZTTDOXYWBWQQDH-IBGZPJMESA-N 2 0 345.487 3.724 20 5 EHBDRP C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000866517862 1137361113 /nfs/dbraw/zinc/36/11/13/1137361113.db2.gz PPSHEDNVBDBVEE-BELGNNRLSA-N 2 0 337.439 3.517 20 5 EHBDRP CC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1[NH3+] ZINC000592427639 1032815119 /nfs/dbraw/zinc/81/51/19/1032815119.db2.gz LTBKCWBPURVAGN-GUYCJALGSA-N 2 0 345.468 3.883 20 5 EHBDRP Cc1ccc(Sc2ccc(C[NH2+]CCCC[NH3+])cc2[N+](=O)[O-])cc1 ZINC000414904320 1021809671 /nfs/dbraw/zinc/80/96/71/1021809671.db2.gz MWIKOQLUWOWIRG-UHFFFAOYSA-N 2 0 345.468 3.883 20 5 EHBDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414923651 1022432995 /nfs/dbraw/zinc/43/29/95/1022432995.db2.gz IXIHJQPKQSLYMR-STQMWFEESA-N 2 0 331.441 3.683 20 5 EHBDRP [NH3+]C1CCC([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000423229215 1028294201 /nfs/dbraw/zinc/29/42/01/1028294201.db2.gz GWAJNNGGOMGTPI-TVPLGVNVSA-N 2 0 325.412 3.544 20 5 EHBDRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423350395 1028381860 /nfs/dbraw/zinc/38/18/60/1028381860.db2.gz ZGHZQQMMTAQPFF-ZDUSSCGKSA-N 2 0 343.452 3.894 20 5 EHBDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423438285 1028446812 /nfs/dbraw/zinc/44/68/12/1028446812.db2.gz RBWBZFOJENEESY-BEFAXECRSA-N 2 0 327.428 3.791 20 5 EHBDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587023 1030321228 /nfs/dbraw/zinc/32/12/28/1030321228.db2.gz PWWBJURSHFAEKY-OXJNMPFZSA-N 2 0 345.487 3.930 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC3CC3)C1)CCC2 ZINC000596092480 1034077600 /nfs/dbraw/zinc/07/76/00/1034077600.db2.gz ANXVASDKIBDLBR-UZLBHIALSA-N 2 0 343.471 3.684 20 5 EHBDRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095280 1034078593 /nfs/dbraw/zinc/07/85/93/1034078593.db2.gz OOSGJCXCQWEPIK-LPHOPBHVSA-N 2 0 331.460 3.758 20 5 EHBDRP CC[N@H+](CCC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1)CC1CC1 ZINC000539957448 1037405473 /nfs/dbraw/zinc/40/54/73/1037405473.db2.gz UJLPWCOLQVKHCZ-UHFFFAOYSA-N 2 0 345.487 3.929 20 5 EHBDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000566474632 1039768532 /nfs/dbraw/zinc/76/85/32/1039768532.db2.gz IDQPXRFVRWWLAH-MAUKXSAKSA-N 2 0 331.460 3.540 20 5 EHBDRP C[NH+](C)CCCC1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000093688392 1129599323 /nfs/dbraw/zinc/59/93/23/1129599323.db2.gz FYQMCDGOPVUCFR-RMKNXTFCSA-N 2 0 331.460 3.662 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000245522034 1130230944 /nfs/dbraw/zinc/23/09/44/1130230944.db2.gz LHMOJWQCRRULKB-YRNRMSPPSA-N 2 0 343.471 3.913 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC001173222841 1132005380 /nfs/dbraw/zinc/00/53/80/1132005380.db2.gz ZLVXIMSTMMIGGL-INIZCTEOSA-N 2 0 345.487 3.770 20 5 EHBDRP C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1 ZINC001173226553 1132006667 /nfs/dbraw/zinc/00/66/67/1132006667.db2.gz KJSGJZPSVPNKMY-IEBWSBKVSA-N 2 0 345.487 3.866 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177294665 1133047157 /nfs/dbraw/zinc/04/71/57/1133047157.db2.gz ONJUDYXXJUPIEV-BOLKPDSISA-N 2 0 345.487 3.956 20 5 EHBDRP O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC001182061562 1133569843 /nfs/dbraw/zinc/56/98/43/1133569843.db2.gz GRNXFXJMCDPUFJ-UHFFFAOYSA-N 2 0 325.840 3.604 20 5 EHBDRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017298 1137564765 /nfs/dbraw/zinc/56/47/65/1137564765.db2.gz YZRKLMIVOTXLBM-KBPBESRZSA-N 2 0 325.428 3.895 20 5 EHBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017301 1137564768 /nfs/dbraw/zinc/56/47/68/1137564768.db2.gz YZRKLMIVOTXLBM-ZIAGYGMSSA-N 2 0 325.428 3.895 20 5 EHBDRP CC1([NH+]2CCCC2)CCC([NH2+]CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000886556468 1138095941 /nfs/dbraw/zinc/09/59/41/1138095941.db2.gz CILCISWYMKSQFC-UHFFFAOYSA-N 2 0 331.460 3.524 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000449155730 1032257367 /nfs/dbraw/zinc/25/73/67/1032257367.db2.gz QJALSZDIOJRGOX-AWEZNQCLSA-N 2 0 345.418 3.516 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000459726044 1032431165 /nfs/dbraw/zinc/43/11/65/1032431165.db2.gz FZPHFERXFPLMEJ-OAHLLOKOSA-N 2 0 343.427 3.676 20 5 EHBDRP [NH3+]CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000415050588 1017460163 /nfs/dbraw/zinc/46/01/63/1017460163.db2.gz ISGMFVANTPTVAR-KRWDZBQOSA-N 2 0 333.819 3.818 20 5 EHBDRP C[C@@H](C[NH3+])C[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414887144 1025866452 /nfs/dbraw/zinc/86/64/52/1025866452.db2.gz YVBCKKDXPDCHMK-LBPRGKRZSA-N 2 0 349.818 3.725 20 5 EHBDRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000423036614 1028143583 /nfs/dbraw/zinc/14/35/83/1028143583.db2.gz ATJNWJJHZIOVDD-CVEARBPZSA-N 2 0 331.803 3.525 20 5 EHBDRP O=[N+]([O-])c1cccc([C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2ccccc2)c1 ZINC000423263104 1028300578 /nfs/dbraw/zinc/30/05/78/1028300578.db2.gz WNWHWDVTJMYDIR-OXQOHEQNSA-N 2 0 339.439 3.664 20 5 EHBDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000423295618 1028353274 /nfs/dbraw/zinc/35/32/74/1028353274.db2.gz XAIURTJHROQGMB-AUUYWEPGSA-N 2 0 339.439 3.725 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596059045 1034063976 /nfs/dbraw/zinc/06/39/76/1034063976.db2.gz MCWNNXXUFRHRLP-OUQXZNHLSA-N 2 0 343.471 3.710 20 5 EHBDRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000596095278 1034079945 /nfs/dbraw/zinc/07/99/45/1034079945.db2.gz OOSGJCXCQWEPIK-APWZRJJASA-N 2 0 331.460 3.758 20 5 EHBDRP CC1(C)C[C@H]([NH2+]Cc2ccc(C[NH3+])cc2F)c2cc([N+](=O)[O-])ccc21 ZINC000593320260 1034659666 /nfs/dbraw/zinc/65/96/66/1034659666.db2.gz BTARHFIOIGAARP-SFHVURJKSA-N 2 0 343.402 3.705 20 5 EHBDRP O=[N+]([O-])c1ccc(C[NH2+]CCCCC[NH+]2CCCC2)c(Cl)c1 ZINC000590193598 1036792635 /nfs/dbraw/zinc/79/26/35/1036792635.db2.gz FCHKKNGECIBQMT-UHFFFAOYSA-N 2 0 325.840 3.604 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCC2 ZINC000417316064 1039655331 /nfs/dbraw/zinc/65/53/31/1039655331.db2.gz ALXZOZWYIFVVTO-HXUWFJFHSA-N 2 0 343.471 3.826 20 5 EHBDRP CC1CC[NH+](C[C@@H]2CCCN(Cc3cccc([N+](=O)[O-])c3)C2)CC1 ZINC000512170714 1043580172 /nfs/dbraw/zinc/58/01/72/1043580172.db2.gz UFVVWLHTVIXYCM-SFHVURJKSA-N 2 0 331.460 3.539 20 5 EHBDRP C[NH+](C)C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000125499520 1129696608 /nfs/dbraw/zinc/69/66/08/1129696608.db2.gz QRDCCLOQDHXOBP-CQSZACIVSA-N 2 0 345.468 3.707 20 5 EHBDRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909654 1131917098 /nfs/dbraw/zinc/91/70/98/1131917098.db2.gz UTFRZSUOMSHIGI-ZTNFWEORSA-N 2 0 345.487 3.551 20 5 EHBDRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000873257260 1137595583 /nfs/dbraw/zinc/59/55/83/1137595583.db2.gz GJCIKYFGQSGZRC-JHJVBQTASA-N 2 0 331.441 3.711 20 5 EHBDRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000123639303 1138272591 /nfs/dbraw/zinc/27/25/91/1138272591.db2.gz YUYGMZGLWDDVFM-OAHLLOKOSA-N 2 0 327.428 3.816 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000449174807 1032269926 /nfs/dbraw/zinc/26/99/26/1032269926.db2.gz IQINDTZOHCAGBH-MRXNPFEDSA-N 2 0 345.487 3.913 20 5 EHBDRP CCC[NH+]1CCC(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000468631621 1018553641 /nfs/dbraw/zinc/55/36/41/1018553641.db2.gz PSWDRWWPMCDRKY-FOWTUZBSSA-N 2 0 331.460 3.710 20 5 EHBDRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000442925060 1025602568 /nfs/dbraw/zinc/60/25/68/1025602568.db2.gz TXUDZVHWARJFPT-CQSZACIVSA-N 2 0 345.468 3.884 20 5 EHBDRP [NH3+][C@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc21 ZINC000423036617 1028143788 /nfs/dbraw/zinc/14/37/88/1028143788.db2.gz ATJNWJJHZIOVDD-JKSUJKDBSA-N 2 0 331.803 3.525 20 5 EHBDRP C[NH+](C)C1CCC([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000421367482 1028323635 /nfs/dbraw/zinc/32/36/35/1028323635.db2.gz DTGSJWQZXWIXMT-UHFFFAOYSA-N 2 0 343.427 3.817 20 5 EHBDRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423438290 1028445993 /nfs/dbraw/zinc/44/59/93/1028445993.db2.gz RBWBZFOJENEESY-HNAYVOBHSA-N 2 0 327.428 3.791 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423469609 1028455056 /nfs/dbraw/zinc/45/50/56/1028455056.db2.gz CUZDJXLVIAKQLR-LSDHHAIUSA-N 2 0 337.489 3.587 20 5 EHBDRP C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C[NH+]1CCCCC1 ZINC000480901976 1120347252 /nfs/dbraw/zinc/34/72/52/1120347252.db2.gz UVIYWUKQCGIIAU-APWZRJJASA-N 2 0 345.487 3.628 20 5 EHBDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000922848837 1129690520 /nfs/dbraw/zinc/69/05/20/1129690520.db2.gz ZIFJNYLQXWLRCR-UHFFFAOYSA-N 2 0 337.851 3.745 20 5 EHBDRP CC[N@@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H](C)C1 ZINC000245444202 1130208508 /nfs/dbraw/zinc/20/85/08/1130208508.db2.gz XUPBLFHDHOYJRW-YJBOKZPZSA-N 2 0 349.475 3.544 20 5 EHBDRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC2 ZINC000877685041 1137685776 /nfs/dbraw/zinc/68/57/76/1137685776.db2.gz JCBOIVOKIMPSEL-UHFFFAOYSA-N 2 0 337.851 3.556 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000449082279 1032174115 /nfs/dbraw/zinc/17/41/15/1032174115.db2.gz MDCYZVZSRODXPK-SJORKVTESA-N 2 0 333.476 3.628 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000459777274 1032463539 /nfs/dbraw/zinc/46/35/39/1032463539.db2.gz KLXAHJAXQUUYRQ-LMMKCTJWSA-N 2 0 345.487 3.628 20 5 EHBDRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000414670066 1017117949 /nfs/dbraw/zinc/11/79/49/1017117949.db2.gz KHRPWVSXRIJUSN-CYBMUJFWSA-N 2 0 345.468 3.883 20 5 EHBDRP CC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]CC1 ZINC000414895979 1017291775 /nfs/dbraw/zinc/29/17/75/1017291775.db2.gz AFIZMCPYKHPMQO-UHFFFAOYSA-N 2 0 345.468 3.803 20 5 EHBDRP C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415054957 1017479400 /nfs/dbraw/zinc/47/94/00/1017479400.db2.gz OFPDOIMPOXZVKW-QFBILLFUSA-N 2 0 341.455 3.986 20 5 EHBDRP CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C[NH+](CC)CC)CC1 ZINC000506862934 1022956866 /nfs/dbraw/zinc/95/68/66/1022956866.db2.gz UPXUSWLVKUDMRK-UHFFFAOYSA-N 2 0 349.475 3.547 20 5 EHBDRP CC(C)(C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C[NH+]1CCCC1 ZINC000477922039 1023574117 /nfs/dbraw/zinc/57/41/17/1023574117.db2.gz YOOKJHMPEMLNAI-SFHVURJKSA-N 2 0 345.487 3.628 20 5 EHBDRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414656207 1027719655 /nfs/dbraw/zinc/71/96/55/1027719655.db2.gz HZWKOUGIYNJYFY-DZGCQCFKSA-N 2 0 345.468 3.883 20 5 EHBDRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423241088 1028303451 /nfs/dbraw/zinc/30/34/51/1028303451.db2.gz CYCDYVUAKYUWRG-ZIAGYGMSSA-N 2 0 345.468 3.974 20 5 EHBDRP CCc1ccc([C@@H]([NH2+][C@H](C)CCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423456738 1028448443 /nfs/dbraw/zinc/44/84/43/1028448443.db2.gz OEPGIVILPAXUCI-ACJLOTCBSA-N 2 0 331.416 3.557 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[NH+]1CCCC1 ZINC000504905802 1029051484 /nfs/dbraw/zinc/05/14/84/1029051484.db2.gz OARJGCVSWNFMMT-OAHLLOKOSA-N 2 0 337.489 3.541 20 5 EHBDRP CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000609029870 1033985013 /nfs/dbraw/zinc/98/50/13/1033985013.db2.gz YLOKYRFEMCITRI-UHFFFAOYSA-N 2 0 341.455 3.721 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596059041 1034064235 /nfs/dbraw/zinc/06/42/35/1034064235.db2.gz MCWNNXXUFRHRLP-LZOLKVDOSA-N 2 0 343.471 3.710 20 5 EHBDRP O=[N+]([O-])c1cccc([C@H]([NH2+]CCC2CC[NH2+]CC2)c2ccccc2)c1 ZINC000593321298 1034644166 /nfs/dbraw/zinc/64/41/66/1034644166.db2.gz HUOBUNIOSHBMOI-HXUWFJFHSA-N 2 0 339.439 3.664 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCC[NH2+]CC3)s2)cc1 ZINC000591278460 1037316454 /nfs/dbraw/zinc/31/64/54/1037316454.db2.gz DMJRJUQDMHGJPU-AWEZNQCLSA-N 2 0 331.441 3.555 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000480927667 1040179203 /nfs/dbraw/zinc/17/92/03/1040179203.db2.gz BPOIRSWGCLYQLC-LFIBNONCSA-N 2 0 331.460 3.710 20 5 EHBDRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H](C)C1 ZINC001172909651 1131917057 /nfs/dbraw/zinc/91/70/57/1131917057.db2.gz UTFRZSUOMSHIGI-BPAFIMBUSA-N 2 0 345.487 3.551 20 5 EHBDRP CC(C)C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173229660 1132008039 /nfs/dbraw/zinc/00/80/39/1132008039.db2.gz OQYWHVVXZLBYCP-SZMVWBNQSA-N 2 0 333.476 3.754 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC001183257370 1133786159 /nfs/dbraw/zinc/78/61/59/1133786159.db2.gz YZLWJLXCNWMEGM-SAPNQHFASA-N 2 0 343.471 3.806 20 5 EHBDRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788538977 1134139460 /nfs/dbraw/zinc/13/94/60/1134139460.db2.gz JAJIHOQDKYHSLF-XHSDSOJGSA-N 2 0 348.491 3.586 20 5 EHBDRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000873255329 1137595435 /nfs/dbraw/zinc/59/54/35/1137595435.db2.gz GJCIKYFGQSGZRC-UPJWGTAASA-N 2 0 331.441 3.711 20 5 EHBDRP CC[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000178039030 1021026605 /nfs/dbraw/zinc/02/66/05/1021026605.db2.gz LOUPBUDTVBBJBF-GPMSIDNRSA-N 2 0 349.475 3.525 20 5 EHBDRP CC(C)[C@H]([NH3+])CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414802270 1033067781 /nfs/dbraw/zinc/06/77/81/1033067781.db2.gz VJYBTVYDTFGZNJ-MRXNPFEDSA-N 2 0 347.390 3.599 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@H]4[NH2+]CC[C@H]4C3)s2)cc1 ZINC000427128685 1023237244 /nfs/dbraw/zinc/23/72/44/1023237244.db2.gz OQJAOUIRYFJEKE-WMLDXEAASA-N 2 0 343.452 3.507 20 5 EHBDRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451548411 1026099636 /nfs/dbraw/zinc/09/96/36/1026099636.db2.gz MXZTZBHSYLMIPB-ROUUACIJSA-N 2 0 331.460 3.649 20 5 EHBDRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423241086 1028305214 /nfs/dbraw/zinc/30/52/14/1028305214.db2.gz CYCDYVUAKYUWRG-KGLIPLIRSA-N 2 0 345.468 3.974 20 5 EHBDRP CCc1ccc([C@@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423438987 1028446800 /nfs/dbraw/zinc/44/68/00/1028446800.db2.gz RWWVTGUBHYVZOG-LIRRHRJNSA-N 2 0 345.443 3.947 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CN)C1CCCC1 ZINC000423504700 1028470131 /nfs/dbraw/zinc/47/01/31/1028470131.db2.gz NUHVEZGIOZDESX-CABCVRRESA-N 2 0 337.489 3.573 20 5 EHBDRP CC[NH+]1CCC(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000121655227 1029611315 /nfs/dbraw/zinc/61/13/15/1029611315.db2.gz MCRNTZZHAFNBRY-IBGZPJMESA-N 2 0 345.487 3.628 20 5 EHBDRP COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000595003486 1033627514 /nfs/dbraw/zinc/62/75/14/1033627514.db2.gz HHZIVLCDHNWNRN-CQSZACIVSA-N 2 0 343.427 3.516 20 5 EHBDRP O=[N+]([O-])c1ccc(CC[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC000443602311 1036659022 /nfs/dbraw/zinc/65/90/22/1036659022.db2.gz IQVQDQYGEPITRA-UHFFFAOYSA-N 2 0 345.487 3.725 20 5 EHBDRP O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCC2 ZINC000417369440 1039738547 /nfs/dbraw/zinc/73/85/47/1039738547.db2.gz PHFCUGKYGMBAOY-LJQANCHMSA-N 2 0 336.395 3.800 20 5 EHBDRP CCc1ccc([C@H]([NH2+]CCCC[NH+](C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543403883 1129464007 /nfs/dbraw/zinc/46/40/07/1129464007.db2.gz FIBGCEGNJREGCX-LJQANCHMSA-N 2 0 345.443 3.771 20 5 EHBDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000125742899 1129713417 /nfs/dbraw/zinc/71/34/17/1129713417.db2.gz GOCYNTSAKDXIKP-LPHOPBHVSA-N 2 0 345.487 3.626 20 5 EHBDRP C[NH+](C)C1(C)CCC([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000866517349 1137360893 /nfs/dbraw/zinc/36/08/93/1137360893.db2.gz HHTYRWFTTPXTLJ-OBONGRFPSA-N 2 0 331.460 3.825 20 5 EHBDRP O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)cc1Cl ZINC000873232325 1137594565 /nfs/dbraw/zinc/59/45/65/1137594565.db2.gz FHOSMTSCNRNLMF-MRXNPFEDSA-N 2 0 337.851 3.650 20 5 EHBDRP C[C@H]([NH3+])C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000414670067 1017117374 /nfs/dbraw/zinc/11/73/74/1017117374.db2.gz KHRPWVSXRIJUSN-ZDUSSCGKSA-N 2 0 345.468 3.883 20 5 EHBDRP C[C@H]1C[C@@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371217 1024856914 /nfs/dbraw/zinc/85/69/14/1024856914.db2.gz LYFSNRFNLKWPGL-RYUDHWBXSA-N 2 0 349.818 3.677 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000503909291 1028223906 /nfs/dbraw/zinc/22/39/06/1028223906.db2.gz LPGBIJIBROBJSR-UHFFFAOYSA-N 2 0 343.427 3.676 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423507637 1028472244 /nfs/dbraw/zinc/47/22/44/1028472244.db2.gz JXIZMKXHUKPUSI-CRAIPNDOSA-N 2 0 327.428 3.596 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[NH+](C)C ZINC000504911815 1029052016 /nfs/dbraw/zinc/05/20/16/1029052016.db2.gz LWDXRVYVJYQILU-AWEZNQCLSA-N 2 0 339.505 3.643 20 5 EHBDRP O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000591282859 1037318763 /nfs/dbraw/zinc/31/87/63/1037318763.db2.gz WCFYJPUOXPXGEW-CGTJXYLNSA-N 2 0 343.471 3.570 20 5 EHBDRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000470180257 1038582630 /nfs/dbraw/zinc/58/26/30/1038582630.db2.gz LCIHWSIQINPIEG-RZQYTQJMSA-N 2 0 331.460 3.660 20 5 EHBDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433173347 1040992256 /nfs/dbraw/zinc/99/22/56/1040992256.db2.gz GHBAZFJDXQENIC-KBXCAEBGSA-N 2 0 331.460 3.639 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC000922845485 1129688801 /nfs/dbraw/zinc/68/88/01/1129688801.db2.gz RCPAEUBTYNOKIU-SSZFMOIBSA-N 2 0 343.471 3.995 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC[NH+](CC(C)(C)C)CC1 ZINC001173220909 1132003938 /nfs/dbraw/zinc/00/39/38/1132003938.db2.gz IAKBWNHUTQFSTE-HNNXBMFYSA-N 2 0 333.476 3.626 20 5 EHBDRP CCC(CC)[NH+]1CCC([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173220828 1132004172 /nfs/dbraw/zinc/00/41/72/1132004172.db2.gz HCMYWBZEHNUSIP-OAHLLOKOSA-N 2 0 333.476 3.768 20 5 EHBDRP O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000815152043 1136557415 /nfs/dbraw/zinc/55/74/15/1136557415.db2.gz XSYPNVIVJAFWOT-UHFFFAOYSA-N 2 0 325.840 3.604 20 5 EHBDRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000123667050 1138273040 /nfs/dbraw/zinc/27/30/40/1138273040.db2.gz KYFPUPFSNIVRLF-LJQANCHMSA-N 2 0 327.428 3.897 20 5 EHBDRP C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000449200837 1032324510 /nfs/dbraw/zinc/32/45/10/1032324510.db2.gz FXAZKCHFOUXECI-AWEZNQCLSA-N 2 0 345.418 3.516 20 5 EHBDRP CC1(C)[NH2+]CC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000415039975 1017445015 /nfs/dbraw/zinc/44/50/15/1017445015.db2.gz NVTQXQHCQWFZRK-MRXNPFEDSA-N 2 0 331.441 3.553 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC[NH2+]C2CC2)s1 ZINC000415069232 1017501718 /nfs/dbraw/zinc/50/17/18/1017501718.db2.gz OMNPDSQYONTYKE-UHFFFAOYSA-N 2 0 331.441 3.555 20 5 EHBDRP C[C@]1(C[NH3+])CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000261918146 1019716721 /nfs/dbraw/zinc/71/67/21/1019716721.db2.gz YIXNMTQWACCGRF-QGZVFWFLSA-N 2 0 349.818 3.679 20 5 EHBDRP O=[N+]([O-])c1cccc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000090910095 1021684922 /nfs/dbraw/zinc/68/49/22/1021684922.db2.gz YMBOMTONVFURHK-UHFFFAOYSA-N 2 0 331.460 3.524 20 5 EHBDRP C[NH+](C)CC1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000506926548 1023012306 /nfs/dbraw/zinc/01/23/06/1023012306.db2.gz KNNKNQOZIVGHFW-UHFFFAOYSA-N 2 0 343.427 3.628 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@@H]3[NH2+]CC[C@H]3C2)s1 ZINC000427105296 1023217978 /nfs/dbraw/zinc/21/79/78/1023217978.db2.gz XHNPQKXHRIYAGJ-BBRMVZONSA-N 2 0 343.452 3.507 20 5 EHBDRP C[NH2+]CC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000435392672 1024876741 /nfs/dbraw/zinc/87/67/41/1024876741.db2.gz HHUKBGPXEOWXMG-UHFFFAOYSA-N 2 0 345.468 3.755 20 5 EHBDRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423476733 1028459743 /nfs/dbraw/zinc/45/97/43/1028459743.db2.gz RDDGYHJLPTUXJF-ZTNFWEORSA-N 2 0 339.439 3.791 20 5 EHBDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447587024 1030321319 /nfs/dbraw/zinc/32/13/19/1030321319.db2.gz PWWBJURSHFAEKY-OXQOHEQNSA-N 2 0 345.487 3.930 20 5 EHBDRP CCC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc([N+](=O)[O-])c1 ZINC000593321507 1034645636 /nfs/dbraw/zinc/64/56/36/1034645636.db2.gz YEYIMXJKOHVLSZ-GOSISDBHSA-N 2 0 331.391 3.824 20 5 EHBDRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH2+]C)cc1[N+](=O)[O-] ZINC000593324763 1034650940 /nfs/dbraw/zinc/65/09/40/1034650940.db2.gz ZNBGOZZDCYVZLV-CQSZACIVSA-N 2 0 343.427 3.564 20 5 EHBDRP CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH2+]C)cc1[N+](=O)[O-] ZINC000593324762 1034651020 /nfs/dbraw/zinc/65/10/20/1034651020.db2.gz ZNBGOZZDCYVZLV-AWEZNQCLSA-N 2 0 343.427 3.564 20 5 EHBDRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000123285340 1040799394 /nfs/dbraw/zinc/79/93/94/1040799394.db2.gz KZKWPOPXTVQVTK-OXQOHEQNSA-N 2 0 345.487 3.770 20 5 EHBDRP C[C@@H](CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)[NH+]1CCCCC1 ZINC000543416018 1129475345 /nfs/dbraw/zinc/47/53/45/1129475345.db2.gz ICHLUNSTOGDQEH-LPHOPBHVSA-N 2 0 345.487 3.770 20 5 EHBDRP Cc1cc(NC[C@H](c2ccco2)[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302151054 1129770799 /nfs/dbraw/zinc/77/07/99/1129770799.db2.gz HRWLHRPFOJNIMP-QGZVFWFLSA-N 2 0 340.383 3.759 20 5 EHBDRP CC(C)C[NH+]1CCC([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172901711 1131884642 /nfs/dbraw/zinc/88/46/42/1131884642.db2.gz JLHWSXIPFXNYPE-SFHVURJKSA-N 2 0 345.487 3.552 20 5 EHBDRP CC(C)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902929 1131885421 /nfs/dbraw/zinc/88/54/21/1131885421.db2.gz CQTBOVIMYYTDCZ-FHWLQOOXSA-N 2 0 345.487 3.823 20 5 EHBDRP C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1CC[NH+](CC2CCC2)CC1 ZINC001173221522 1132004723 /nfs/dbraw/zinc/00/47/23/1132004723.db2.gz NRJIHROWEDVUGA-INIZCTEOSA-N 2 0 345.487 3.628 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCCC[N@H+](C)C1 ZINC000872088543 1137570614 /nfs/dbraw/zinc/57/06/14/1137570614.db2.gz RSJLEVUPXPQVSF-UONOGXRCSA-N 2 0 337.489 3.699 20 5 EHBDRP CC1([NH+]2CCCC2)CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000886522424 1138089450 /nfs/dbraw/zinc/08/94/50/1138089450.db2.gz IVLDHBGLGNOOTH-UHFFFAOYSA-N 2 0 331.460 3.524 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000602023573 1032593528 /nfs/dbraw/zinc/59/35/28/1032593528.db2.gz ZQJSPFZDCCMDIH-QSFXBCCZSA-N 2 0 339.439 3.791 20 5 EHBDRP CC[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1[NH3+] ZINC000592427637 1032816601 /nfs/dbraw/zinc/81/66/01/1032816601.db2.gz LTBKCWBPURVAGN-CXAGYDPISA-N 2 0 345.468 3.883 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000182658784 1019718571 /nfs/dbraw/zinc/71/85/71/1019718571.db2.gz KNSOUFRPJOIBIK-INIZCTEOSA-N 2 0 331.460 3.772 20 5 EHBDRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000108427925 1023121759 /nfs/dbraw/zinc/12/17/59/1023121759.db2.gz YTVVKTTXXKFSGH-CQSZACIVSA-N 2 0 345.468 3.755 20 5 EHBDRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000896952329 1026150350 /nfs/dbraw/zinc/15/03/50/1026150350.db2.gz WWVNVRJLCWAMPX-UHFFFAOYSA-N 2 0 337.851 3.745 20 5 EHBDRP O=[N+]([O-])c1cccc([C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccccc2)c1 ZINC000423476618 1028459602 /nfs/dbraw/zinc/45/96/02/1028459602.db2.gz JCCVIXGFSHFZTJ-ICSRJNTNSA-N 2 0 339.439 3.806 20 5 EHBDRP CCOc1ccc([C@H](C)NCCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504894984 1029038911 /nfs/dbraw/zinc/03/89/11/1029038911.db2.gz PXPUHKBCKIBBHX-CVEARBPZSA-N 2 0 349.475 3.909 20 5 EHBDRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192616965 1030791150 /nfs/dbraw/zinc/79/11/50/1030791150.db2.gz VXUAMXMZNWDNLB-HXUWFJFHSA-N 2 0 339.439 3.824 20 5 EHBDRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000594518044 1033423372 /nfs/dbraw/zinc/42/33/72/1033423372.db2.gz BKZBXUFZIDQKJC-OKILXGFUSA-N 2 0 345.468 3.753 20 5 EHBDRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000599068693 1033709916 /nfs/dbraw/zinc/70/99/16/1033709916.db2.gz CJHMXCIVKJMZTQ-RDTXWAMCSA-N 2 0 331.460 3.639 20 5 EHBDRP C[N@@H+]1CCCC[C@H](C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000599071672 1033712227 /nfs/dbraw/zinc/71/22/27/1033712227.db2.gz SFHPGSYSQCZAHC-ZIFCJYIRSA-N 2 0 345.487 3.628 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCC[NH2+]CC2)s1 ZINC000591278507 1037318425 /nfs/dbraw/zinc/31/84/25/1037318425.db2.gz JJOFXAZZKLBCDT-CYBMUJFWSA-N 2 0 331.441 3.555 20 5 EHBDRP CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000591582970 1037516972 /nfs/dbraw/zinc/51/69/72/1037516972.db2.gz VXCPDAPOVZBUNT-LSDHHAIUSA-N 2 0 349.500 3.730 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000591582969 1037517038 /nfs/dbraw/zinc/51/70/38/1037517038.db2.gz VXCPDAPOVZBUNT-HUUCEWRRSA-N 2 0 349.500 3.730 20 5 EHBDRP Cc1ccc(CN2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000512171371 1043610157 /nfs/dbraw/zinc/61/01/57/1043610157.db2.gz WWVGNJGPMVWXCJ-IEBWSBKVSA-N 2 0 345.487 3.990 20 5 EHBDRP C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000468622475 1129644400 /nfs/dbraw/zinc/64/44/00/1129644400.db2.gz RNRBONOQDBGUBA-NTCAYCPXSA-N 2 0 331.460 3.851 20 5 EHBDRP C[C@H](C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)CC(C)(C)CC[NH3+] ZINC001172903414 1131886960 /nfs/dbraw/zinc/88/69/60/1131886960.db2.gz QYEVGEJLGRHOMH-YJBOKZPZSA-N 2 0 347.503 3.833 20 5 EHBDRP Cc1ccccc1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168998340 1132627590 /nfs/dbraw/zinc/62/75/90/1132627590.db2.gz LLZLHXKKHPKGFS-FRYIKTPZSA-N 2 0 345.487 3.512 20 5 EHBDRP COc1ccc(C[C@@H](C)[NH+]2C(C)(C)CC([NH3+])CC2(C)C)c([N+](=O)[O-])c1 ZINC001170309759 1134752992 /nfs/dbraw/zinc/75/29/92/1134752992.db2.gz SNYSJPQPGHOYQN-CYBMUJFWSA-N 2 0 349.475 3.515 20 5 EHBDRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000102423214 1135551052 /nfs/dbraw/zinc/55/10/52/1135551052.db2.gz ROTMMRPKVDVILH-AWEZNQCLSA-N 2 0 345.468 3.755 20 5 EHBDRP C[NH+](C)C1(C)CCC([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000866515844 1137360698 /nfs/dbraw/zinc/36/06/98/1137360698.db2.gz KAXGCSOUHJNWGN-QPIRBTGLSA-N 2 0 345.487 3.768 20 5 EHBDRP C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000866516267 1137360830 /nfs/dbraw/zinc/36/08/30/1137360830.db2.gz NWGUHEBJBHPRNL-LSJNQWAISA-N 2 0 333.476 3.768 20 5 EHBDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449131926 1032227166 /nfs/dbraw/zinc/22/71/66/1032227166.db2.gz QJQXSFDJTICKHQ-MRXNPFEDSA-N 2 0 341.455 3.767 20 5 EHBDRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000414840523 1017232341 /nfs/dbraw/zinc/23/23/41/1017232341.db2.gz KLPJAGSMMDDKII-DOTOQJQBSA-N 2 0 331.460 3.557 20 5 EHBDRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414899288 1017295802 /nfs/dbraw/zinc/29/58/02/1017295802.db2.gz UQKHOFFVXLDUGJ-LBPRGKRZSA-N 2 0 349.818 3.867 20 5 EHBDRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000414930672 1017326427 /nfs/dbraw/zinc/32/64/27/1017326427.db2.gz TXVKHLAYCHGIDX-RYUDHWBXSA-N 2 0 349.818 3.868 20 5 EHBDRP [NH3+]C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000415042438 1017446938 /nfs/dbraw/zinc/44/69/38/1017446938.db2.gz QVKDTVVMTQYJGS-STQMWFEESA-N 2 0 331.441 3.540 20 5 EHBDRP [NH3+]CCC[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000415060693 1017487974 /nfs/dbraw/zinc/48/79/74/1017487974.db2.gz XHZLGPVIEADLRL-RLGIIYIFSA-N 2 0 325.412 3.678 20 5 EHBDRP Cc1nccn1CCCCNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000302153486 1022434413 /nfs/dbraw/zinc/43/44/13/1022434413.db2.gz IHVWHEVBNYPZAN-UHFFFAOYSA-N 2 0 339.399 3.849 20 5 EHBDRP C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248392858 1023011794 /nfs/dbraw/zinc/01/17/94/1023011794.db2.gz DKNFGLYDYGIMST-UXLLHSPISA-N 2 0 331.460 3.898 20 5 EHBDRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000108427959 1023128362 /nfs/dbraw/zinc/12/83/62/1023128362.db2.gz NITYVFKZEREGIY-CQSZACIVSA-N 2 0 345.468 3.755 20 5 EHBDRP C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000572887069 1028196379 /nfs/dbraw/zinc/19/63/79/1028196379.db2.gz JIYGWDOIXGOULX-KVVHSQDJSA-N 2 0 343.471 3.662 20 5 EHBDRP C[NH+](C)C1CCC([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000421371170 1028328119 /nfs/dbraw/zinc/32/81/19/1028328119.db2.gz KIZBFESAKCKVFL-GWFLUQINSA-N 2 0 345.487 3.768 20 5 EHBDRP CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000423274417 1028338518 /nfs/dbraw/zinc/33/85/18/1028338518.db2.gz KKMLWPKESUEOMO-ZNMIVQPWSA-N 2 0 337.489 3.573 20 5 EHBDRP CCc1ccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2ccc([N+](=O)[O-])cc2)o1 ZINC000423456743 1028449126 /nfs/dbraw/zinc/44/91/26/1028449126.db2.gz OEPGIVILPAXUCI-UGSOOPFHSA-N 2 0 331.416 3.557 20 5 EHBDRP CC[NH+]1CCC(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000121655391 1029611179 /nfs/dbraw/zinc/61/11/79/1029611179.db2.gz MCRNTZZHAFNBRY-LJQANCHMSA-N 2 0 345.487 3.628 20 5 EHBDRP Cc1c([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cccc1[N+](=O)[O-] ZINC000160872656 1031125166 /nfs/dbraw/zinc/12/51/66/1031125166.db2.gz UXJLOWRILSVENT-HNNXBMFYSA-N 2 0 327.428 3.816 20 5 EHBDRP O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CC34CC[NH2+]CC4)s2)cc1 ZINC000591281933 1037320272 /nfs/dbraw/zinc/32/02/72/1037320272.db2.gz XPRZWPKAKOWXMX-KRWDZBQOSA-N 2 0 343.452 3.555 20 5 EHBDRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000195136462 1123167577 /nfs/dbraw/zinc/16/75/77/1123167577.db2.gz IWCAWLSRKOURNS-AEFFLSMTSA-N 2 0 339.439 3.768 20 5 EHBDRP C[NH+](C)Cc1ccc(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1 ZINC000809738913 1135883352 /nfs/dbraw/zinc/88/33/52/1135883352.db2.gz OZLUJPPHCXZDCP-VURMDHGXSA-N 2 0 339.439 3.802 20 5 EHBDRP C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000866290660 1137342947 /nfs/dbraw/zinc/34/29/47/1137342947.db2.gz WGGWFXZWRRGMRS-CYBMUJFWSA-N 2 0 337.439 3.517 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCCC[N@H+](C)C1 ZINC000872088538 1137570595 /nfs/dbraw/zinc/57/05/95/1137570595.db2.gz RSJLEVUPXPQVSF-KBPBESRZSA-N 2 0 337.489 3.699 20 5 EHBDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000123979700 1138276997 /nfs/dbraw/zinc/27/69/97/1138276997.db2.gz JRJYIFSDXJODIH-HNNXBMFYSA-N 2 0 327.428 3.897 20 5 EHBDRP C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000449082276 1032174088 /nfs/dbraw/zinc/17/40/88/1032174088.db2.gz MDCYZVZSRODXPK-DLBZAZTESA-N 2 0 333.476 3.628 20 5 EHBDRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000414675802 1017119671 /nfs/dbraw/zinc/11/96/71/1017119671.db2.gz RQZNZEQOGZBASN-CYBMUJFWSA-N 2 0 345.468 3.883 20 5 EHBDRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000415025608 1017417912 /nfs/dbraw/zinc/41/79/12/1017417912.db2.gz RJJXBPRIXYMXGQ-LLVKDONJSA-N 2 0 337.807 3.725 20 5 EHBDRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000060773981 1032865649 /nfs/dbraw/zinc/86/56/49/1032865649.db2.gz VTKJFQOWVWPUQV-CYBMUJFWSA-N 2 0 327.856 3.848 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000592491869 1032927060 /nfs/dbraw/zinc/92/70/60/1032927060.db2.gz MQIAAEHXGPLPSC-ULQDDVLXSA-N 2 0 331.460 3.676 20 5 EHBDRP Cc1c(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000443600719 1024221926 /nfs/dbraw/zinc/22/19/26/1024221926.db2.gz MCXDEDWSLPADGQ-UHFFFAOYSA-N 2 0 345.487 3.991 20 5 EHBDRP C[C@H]1C[C@H](C[NH3+])C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000435371216 1024856781 /nfs/dbraw/zinc/85/67/81/1024856781.db2.gz LYFSNRFNLKWPGL-NWDGAFQWSA-N 2 0 349.818 3.677 20 5 EHBDRP Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000521847962 1025717549 /nfs/dbraw/zinc/71/75/49/1025717549.db2.gz CHPUTPHEIWYELX-GDBMZVCRSA-N 2 0 340.427 3.514 20 5 EHBDRP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479918887 1026890970 /nfs/dbraw/zinc/89/09/70/1026890970.db2.gz WICPTAHVWFSSIU-QFBILLFUSA-N 2 0 345.487 3.770 20 5 EHBDRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000503918647 1028209651 /nfs/dbraw/zinc/20/96/51/1028209651.db2.gz CIOJZUQMEAJXNB-UHFFFAOYSA-N 2 0 343.427 3.676 20 5 EHBDRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000423295621 1028353475 /nfs/dbraw/zinc/35/34/75/1028353475.db2.gz XAIURTJHROQGMB-LIRRHRJNSA-N 2 0 339.439 3.725 20 5 EHBDRP O=[N+]([O-])c1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC000533098423 1029301564 /nfs/dbraw/zinc/30/15/64/1029301564.db2.gz SYAMLENQTBFLAU-UHFFFAOYSA-N 2 0 331.460 3.683 20 5 EHBDRP Cc1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1[N+](=O)[O-] ZINC001168316724 1033984505 /nfs/dbraw/zinc/98/45/05/1033984505.db2.gz FJWJAZZMTJNSCY-UHFFFAOYSA-N 2 0 345.487 3.991 20 5 EHBDRP Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000595900212 1034026651 /nfs/dbraw/zinc/02/66/51/1034026651.db2.gz BERHXONURATMNX-NVXWUHKLSA-N 2 0 331.460 3.676 20 5 EHBDRP O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)s1 ZINC000591281890 1037319546 /nfs/dbraw/zinc/31/95/46/1037319546.db2.gz RYDKVGMVMGXSFQ-QGZVFWFLSA-N 2 0 343.452 3.555 20 5 EHBDRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000417358003 1039718422 /nfs/dbraw/zinc/71/84/22/1039718422.db2.gz HIUQUHHQQKWJLM-DNVCBOLYSA-N 2 0 331.460 3.684 20 5 EHBDRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000123223400 1128703183 /nfs/dbraw/zinc/70/31/83/1128703183.db2.gz BJJNWBCKALLZMR-JXFKEZNVSA-N 2 0 345.487 3.770 20 5 EHBDRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131957 1123165572 /nfs/dbraw/zinc/16/55/72/1123165572.db2.gz BTHPXNWILXEPAA-FUHWJXTLSA-N 2 0 339.439 3.768 20 5 EHBDRP C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768209610 1133107919 /nfs/dbraw/zinc/10/79/19/1133107919.db2.gz SFNKWSYRDFLPRO-OAHLLOKOSA-N 2 0 327.428 3.849 20 5 EHBDRP Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC[N@H+]1CCC[C@@H](C)C1 ZINC001199344081 1135896622 /nfs/dbraw/zinc/89/66/22/1135896622.db2.gz DPJWDNSWIJRBKQ-OAHLLOKOSA-N 2 0 333.476 3.813 20 5 EHBDRP CC[NH+]1CCC(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811479103 1136096906 /nfs/dbraw/zinc/09/69/06/1136096906.db2.gz XGIDCHSMGUGVBZ-UHFFFAOYSA-N 2 0 346.258 3.723 20 5 EHBDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000859997056 1137039966 /nfs/dbraw/zinc/03/99/66/1137039966.db2.gz NGODIDJKZXHLHE-UHFFFAOYSA-N 2 0 345.418 3.818 20 5 EHBDRP CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000872079460 1137570212 /nfs/dbraw/zinc/57/02/12/1137570212.db2.gz MYLGMJGGZDZBCE-UONOGXRCSA-N 2 0 337.489 3.699 20 5 EHBDRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872089334 1137570712 /nfs/dbraw/zinc/57/07/12/1137570712.db2.gz XDIIKMRXMWGHAT-ZDUSSCGKSA-N 2 0 335.423 3.507 20 5 EHBDRP CC(C)(C)[NH+]1CCC([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000089512897 1138200560 /nfs/dbraw/zinc/20/05/60/1138200560.db2.gz FSLOGTBHGSZDAU-GOSISDBHSA-N 2 0 345.487 3.768 20 5 EHBDRP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000123666894 1138272915 /nfs/dbraw/zinc/27/29/15/1138272915.db2.gz KYFPUPFSNIVRLF-IBGZPJMESA-N 2 0 327.428 3.897 20 5 EHBDRP