smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000112675822 1118084243 /nfs/dbraw/zinc/08/42/43/1118084243.db2.gz VCPGGAXAKODDNL-OLZOCXBDSA-N 1 0 282.409 3.961 20 5 CHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542003454 1121012006 /nfs/dbraw/zinc/01/20/06/1121012006.db2.gz YDWBENZPLTZNPU-JTQLQIEISA-N 1 0 268.744 3.623 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccccn1 ZINC000729679154 1125543143 /nfs/dbraw/zinc/54/31/43/1125543143.db2.gz RGEBZLRVPXFMND-HNNXBMFYSA-N 1 0 299.374 3.929 20 5 CHBDRO CCC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC000886105216 1125650556 /nfs/dbraw/zinc/65/05/56/1125650556.db2.gz USLXRFQNPDMJLZ-HNNXBMFYSA-N 1 0 285.347 3.621 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[NH2+][C@H]1CCCCC12CCCC2 ZINC000886212651 1125660984 /nfs/dbraw/zinc/66/09/84/1125660984.db2.gz BVUWGKNGVZSWLG-AWEZNQCLSA-N 1 0 289.379 3.582 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3cccnc32)cc1[N+](=O)[O-] ZINC000886550121 1125689997 /nfs/dbraw/zinc/68/99/97/1125689997.db2.gz SLUYATTVMKDVFR-WFASDCNBSA-N 1 0 297.358 3.636 20 5 CHBDRO CO[C@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000886650165 1125702337 /nfs/dbraw/zinc/70/23/37/1125702337.db2.gz QRWVRCZBWNDYOC-MJBXVCDLSA-N 1 0 292.379 3.593 20 5 CHBDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000121989606 1125782755 /nfs/dbraw/zinc/78/27/55/1125782755.db2.gz XYANAXZWLQOXEY-WCQYABFASA-N 1 0 294.395 3.757 20 5 CHBDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000159723563 1126751528 /nfs/dbraw/zinc/75/15/28/1126751528.db2.gz PGVCRDFOLJPGKR-QGZVFWFLSA-N 1 0 297.358 3.635 20 5 CHBDRO C[C@H]1C[C@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473712 1130614487 /nfs/dbraw/zinc/61/44/87/1130614487.db2.gz JERFMMXTLSTJAQ-YUMQZZPRSA-N 1 0 289.162 3.647 20 5 CHBDRO Cc1cncc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000189805435 1126935363 /nfs/dbraw/zinc/93/53/63/1126935363.db2.gz NYTBPRBPWMIEFD-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO Cc1cscc1C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000487202020 1127023837 /nfs/dbraw/zinc/02/38/37/1127023837.db2.gz KOGMWECDARWNTM-GQCTYLIASA-N 1 0 288.372 3.768 20 5 CHBDRO Cc1cscc1C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000487202021 1127024210 /nfs/dbraw/zinc/02/42/10/1127024210.db2.gz KOGMWECDARWNTM-XQRVVYSFSA-N 1 0 288.372 3.768 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000487967777 1127051247 /nfs/dbraw/zinc/05/12/47/1127051247.db2.gz DETYEFKYJSLLEO-FRRDWIJNSA-N 1 0 262.353 3.634 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccnc1 ZINC000270552635 1127057704 /nfs/dbraw/zinc/05/77/04/1127057704.db2.gz BRIKLTGVUIJAFR-ZDUSSCGKSA-N 1 0 285.347 3.573 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000042814603 1127077247 /nfs/dbraw/zinc/07/72/47/1127077247.db2.gz FTTYANXRPQTOMD-HZPDHXFCSA-N 1 0 292.379 3.595 20 5 CHBDRO CC(C)C([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)C ZINC000586768986 1127139569 /nfs/dbraw/zinc/13/95/69/1127139569.db2.gz MFGKCFUJOLKLSS-UHFFFAOYSA-N 1 0 286.322 3.643 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000572780342 1127225964 /nfs/dbraw/zinc/22/59/64/1127225964.db2.gz HUENQAGAWRSYEL-GWCFXTLKSA-N 1 0 296.317 3.607 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CC(C3CC3)C2)o1 ZINC000589736889 1127235115 /nfs/dbraw/zinc/23/51/15/1127235115.db2.gz YIASLONMUOIWRH-UHFFFAOYSA-N 1 0 298.342 3.697 20 5 CHBDRO COCC(C)(C)CCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000287013243 1127281557 /nfs/dbraw/zinc/28/15/57/1127281557.db2.gz KSHQGFXXGOVBTL-ZDUSSCGKSA-N 1 0 294.395 3.698 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2CCCSC2)cccc1[N+](=O)[O-] ZINC000287124134 1127290597 /nfs/dbraw/zinc/29/05/97/1127290597.db2.gz RIJUVAOAYZAPCZ-QWHCGFSZSA-N 1 0 294.420 3.697 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C1(c2ccccc2)CC1 ZINC000573266166 1127305364 /nfs/dbraw/zinc/30/53/64/1127305364.db2.gz VIPLTOIIPBZYDC-INIZCTEOSA-N 1 0 294.354 3.861 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](C)CC(F)F)cccc1[N+](=O)[O-] ZINC000592392418 1127344828 /nfs/dbraw/zinc/34/48/28/1127344828.db2.gz SPBOBISJYHCXHR-ONGXEEELSA-N 1 0 286.322 3.845 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1N(C)C)c1ccccc1[N+](=O)[O-] ZINC000358058404 1127399272 /nfs/dbraw/zinc/39/92/72/1127399272.db2.gz GLVDOUDQXACSPD-ZDUSSCGKSA-N 1 0 299.374 3.512 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000594511318 1127420524 /nfs/dbraw/zinc/42/05/24/1127420524.db2.gz FTAKRJOYBMSPTR-GRYCIOLGSA-N 1 0 280.393 3.530 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000594515400 1127421310 /nfs/dbraw/zinc/42/13/10/1127421310.db2.gz PPHCTDKFIAUEPD-TZMCWYRMSA-N 1 0 299.374 3.580 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC1(C)CCCC1 ZINC001308712700 1127434697 /nfs/dbraw/zinc/43/46/97/1127434697.db2.gz QVWDZLXFMNTTEW-UHFFFAOYSA-N 1 0 276.380 3.649 20 5 CHBDRO C[C@@]1(CC[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC1(F)F ZINC000594977376 1127438305 /nfs/dbraw/zinc/43/83/05/1127438305.db2.gz KZVLOCGDHDNECL-YVARQFDVSA-N 1 0 296.317 3.633 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1C[C@H](OCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000595066530 1127448243 /nfs/dbraw/zinc/44/82/43/1127448243.db2.gz IDNGCLVUTGVLQW-BPUTZDHNSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)c1ccccn1 ZINC000595051997 1127451290 /nfs/dbraw/zinc/45/12/90/1127451290.db2.gz ZZERNHVODBFYAP-KGLIPLIRSA-N 1 0 299.374 3.753 20 5 CHBDRO CCSC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000595100216 1127452478 /nfs/dbraw/zinc/45/24/78/1127452478.db2.gz PKUBERYGTUZQNA-LBPRGKRZSA-N 1 0 294.420 3.840 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C(C)C)C1CC1 ZINC000595097950 1127452560 /nfs/dbraw/zinc/45/25/60/1127452560.db2.gz AGAIQMHABXIKSG-BZNIZROVSA-N 1 0 292.379 3.689 20 5 CHBDRO C[C@H]([NH2+]CC[C@]1(C)CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595081267 1127453403 /nfs/dbraw/zinc/45/34/03/1127453403.db2.gz RFOMZYOUEFMZGK-GXFFZTMASA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC(C)(C)F ZINC000595091179 1127454771 /nfs/dbraw/zinc/45/47/71/1127454771.db2.gz WMQAVSMJRXDTFY-LLVKDONJSA-N 1 0 268.332 3.692 20 5 CHBDRO CC[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CC(F)F ZINC000595413705 1127461492 /nfs/dbraw/zinc/46/14/92/1127461492.db2.gz GBQMSDZJDJOAJQ-WDEREUQCSA-N 1 0 286.322 3.927 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](CC2CC=CC2)C2CC2)cc1 ZINC000595405218 1127461847 /nfs/dbraw/zinc/46/18/47/1127461847.db2.gz VUDUKQIABFDACA-UHFFFAOYSA-N 1 0 272.348 3.525 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(c3ccco3)CC2)c1 ZINC000595616418 1127467651 /nfs/dbraw/zinc/46/76/51/1127467651.db2.gz BWYIBBCTJXQOGJ-UHFFFAOYSA-N 1 0 286.331 3.567 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(C3CCC3)CC2)c(Cl)c1 ZINC000593083785 1127468680 /nfs/dbraw/zinc/46/86/80/1127468680.db2.gz YGIHUPDECOJPDS-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1(C2CCC2)CC1 ZINC000593083809 1127468906 /nfs/dbraw/zinc/46/89/06/1127468906.db2.gz YOHYJKUGVSPGDC-LBPRGKRZSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1noc(C[N@@H+]2CCC(C)(C)CC(C)(C)C2)c1[N+](=O)[O-] ZINC000595747684 1127475306 /nfs/dbraw/zinc/47/53/06/1127475306.db2.gz BWKRTOBTHCCZJX-UHFFFAOYSA-N 1 0 295.383 3.539 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CC1(C2CC2)CC1 ZINC000228718993 1127596626 /nfs/dbraw/zinc/59/66/26/1127596626.db2.gz XDPILNSROYMYIM-UHFFFAOYSA-N 1 0 280.755 3.528 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000361922464 1127599179 /nfs/dbraw/zinc/59/91/79/1127599179.db2.gz IXTUJTIYGDQQOK-LRDDRELGSA-N 1 0 288.347 3.860 20 5 CHBDRO Cc1c(C[N@@H+](CC(C)C)C(C)C)cccc1[N+](=O)[O-] ZINC000060857082 1127607687 /nfs/dbraw/zinc/60/76/87/1127607687.db2.gz IITRVNMYFBVHOS-UHFFFAOYSA-N 1 0 264.369 3.770 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc2c1CCC2)c1cccc([N+](=O)[O-])c1 ZINC000593585334 1127629872 /nfs/dbraw/zinc/62/98/72/1127629872.db2.gz FZZOEILBVDHRFH-CYBMUJFWSA-N 1 0 296.370 3.934 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CC1(F)F ZINC000598677582 1127631321 /nfs/dbraw/zinc/63/13/21/1127631321.db2.gz PLLBRNXBXSIEBM-AAEUAGOBSA-N 1 0 298.333 3.551 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC12CCCC2 ZINC000593646402 1127647435 /nfs/dbraw/zinc/64/74/35/1127647435.db2.gz WGZRJSAFSJMHFK-ALCCZGGFSA-N 1 0 272.348 3.627 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000598954695 1127647582 /nfs/dbraw/zinc/64/75/82/1127647582.db2.gz FCKFHYGUVLMAAL-OVTCNUJSSA-N 1 0 274.364 3.680 20 5 CHBDRO Cc1ncccc1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000598996700 1127650967 /nfs/dbraw/zinc/65/09/67/1127650967.db2.gz YWWUGWJZYZKMLH-UHFFFAOYSA-N 1 0 299.374 3.711 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC2(CCC2)C1 ZINC000593688386 1127659117 /nfs/dbraw/zinc/65/91/17/1127659117.db2.gz QCASGOYOEYYJSR-MDWZMJQESA-N 1 0 286.375 3.920 20 5 CHBDRO CC[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCCC1 ZINC000603629364 1127662995 /nfs/dbraw/zinc/66/29/95/1127662995.db2.gz BVEZMRLIQPTWQM-LLVKDONJSA-N 1 0 297.786 3.535 20 5 CHBDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1F ZINC000296129722 1127663900 /nfs/dbraw/zinc/66/39/00/1127663900.db2.gz UKBMIEFTIGFHGG-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@@H]([NH2+]C1(C2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000593725255 1127666361 /nfs/dbraw/zinc/66/63/61/1127666361.db2.gz WMJFNCGIHHSUIU-OAHLLOKOSA-N 1 0 274.364 3.968 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cccs1 ZINC000603847835 1127676084 /nfs/dbraw/zinc/67/60/84/1127676084.db2.gz ZOGBHRQRDWWURN-UHFFFAOYSA-N 1 0 290.388 3.721 20 5 CHBDRO C[C@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000296615782 1127678506 /nfs/dbraw/zinc/67/85/06/1127678506.db2.gz WOBIKVAURYJAGW-ZDUSSCGKSA-N 1 0 299.374 3.618 20 5 CHBDRO CC1CCC([N@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000061799065 1127718380 /nfs/dbraw/zinc/71/83/80/1127718380.db2.gz ADHVQKJQSYNGSZ-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2)[NH+](C)C)cc1 ZINC000064114250 1127899018 /nfs/dbraw/zinc/89/90/18/1127899018.db2.gz VHMHWAVVGJLUGX-KRWDZBQOSA-N 1 0 299.374 3.618 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000539835791 1127946518 /nfs/dbraw/zinc/94/65/18/1127946518.db2.gz VUESTZQSZSIENC-UHFFFAOYSA-N 1 0 262.353 3.703 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1Cc2ccccc2C1 ZINC000544609135 1127978516 /nfs/dbraw/zinc/97/85/16/1127978516.db2.gz FRLCZECJWDPJTH-UHFFFAOYSA-N 1 0 296.370 3.502 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)CC1 ZINC000468148320 1127994449 /nfs/dbraw/zinc/99/44/49/1127994449.db2.gz VJCCREBXFCUBJF-STQMWFEESA-N 1 0 262.353 3.778 20 5 CHBDRO COc1ccc(C[N@H+](C)[C@@H]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000468409055 1128007889 /nfs/dbraw/zinc/00/78/89/1128007889.db2.gz RGYCBMFHTNKNCU-CYBMUJFWSA-N 1 0 292.379 3.614 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC(C)C ZINC000468639674 1128014347 /nfs/dbraw/zinc/01/43/47/1128014347.db2.gz GKIOKKXMGLZNID-LCYFTJDESA-N 1 0 262.353 3.634 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)CC1(C)C ZINC000541771856 1128038561 /nfs/dbraw/zinc/03/85/61/1128038561.db2.gz RWMASAPNIZTRPO-LLVKDONJSA-N 1 0 262.353 3.524 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H](C)C(C)C ZINC000470169059 1128064299 /nfs/dbraw/zinc/06/42/99/1128064299.db2.gz BCJHJOKMTWWYTF-KADHNRKRSA-N 1 0 276.380 3.974 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H](C)C1CC1 ZINC000470176946 1128064829 /nfs/dbraw/zinc/06/48/29/1128064829.db2.gz ZFZILGASWFLYQI-KIWPFMIBSA-N 1 0 274.364 3.728 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](C)C1 ZINC000470175902 1128065494 /nfs/dbraw/zinc/06/54/94/1128065494.db2.gz TUGRBAIGFWBRIG-GFAPJHNFSA-N 1 0 274.364 3.730 20 5 CHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000471022908 1128085224 /nfs/dbraw/zinc/08/52/24/1128085224.db2.gz QRSIAWROHQMFIE-KDOFPFPSSA-N 1 0 296.370 3.830 20 5 CHBDRO CCOc1cc(C[N@@H+]2[C@@H](C)CC[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492603723 1128105974 /nfs/dbraw/zinc/10/59/74/1128105974.db2.gz CGQNTPDDSIPKTK-JSGCOSHPSA-N 1 0 292.379 3.756 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000492732758 1128110510 /nfs/dbraw/zinc/11/05/10/1128110510.db2.gz ZBJHANRHZVRYGK-UHFFFAOYSA-N 1 0 280.368 3.662 20 5 CHBDRO CCOc1cc(C[NH+]2[C@H](C)CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000492789005 1128113029 /nfs/dbraw/zinc/11/30/29/1128113029.db2.gz KCUBHLLCROAKCE-CHWSQXEVSA-N 1 0 292.379 3.756 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1Cl ZINC000761510150 1128132316 /nfs/dbraw/zinc/13/23/16/1128132316.db2.gz DSFLXQNLKFODEV-BETUJISGSA-N 1 0 294.782 3.870 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CCC1 ZINC000761510113 1128132452 /nfs/dbraw/zinc/13/24/52/1128132452.db2.gz CVOXXRDWOMCBBR-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CC(C)[C@H]1CCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493333130 1128138427 /nfs/dbraw/zinc/13/84/27/1128138427.db2.gz FDFYXFKACJATAB-CYBMUJFWSA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCS[C@H](C)C1 ZINC000927028514 1128208648 /nfs/dbraw/zinc/20/86/48/1128208648.db2.gz ARSJMKNNWUIVQE-AGIUHOORSA-N 1 0 294.420 3.838 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCS[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000927029294 1128209581 /nfs/dbraw/zinc/20/95/81/1128209581.db2.gz CKFUOSZLXIVRMS-WXHSDQCUSA-N 1 0 294.420 3.838 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1CF)c1ccc([N+](=O)[O-])cc1 ZINC000930594393 1128327713 /nfs/dbraw/zinc/32/77/13/1128327713.db2.gz KVMPYZLZJJCHKK-LBPRGKRZSA-N 1 0 288.322 3.915 20 5 CHBDRO CC[C@@H](CO)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000214760504 1128358235 /nfs/dbraw/zinc/35/82/35/1128358235.db2.gz KKBQLHDHLRUTGI-INIZCTEOSA-N 1 0 279.383 3.854 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1F ZINC000153933130 1128415734 /nfs/dbraw/zinc/41/57/34/1128415734.db2.gz VQOSJCZJBFWEFG-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)F ZINC000932179273 1128398375 /nfs/dbraw/zinc/39/83/75/1128398375.db2.gz YBXMHHQKHLNGRO-GHMZBOCLSA-N 1 0 286.322 3.927 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000932176458 1128398431 /nfs/dbraw/zinc/39/84/31/1128398431.db2.gz FPXAWOZRLKILOI-XYHOJCAOSA-N 1 0 296.317 3.537 20 5 CHBDRO Cc1nsc(C)c1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000932178563 1128399051 /nfs/dbraw/zinc/39/90/51/1128399051.db2.gz QAJAYHIIOBWBPH-SECBINFHSA-N 1 0 291.376 3.519 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)C(C)(C)C ZINC000562854875 1128424730 /nfs/dbraw/zinc/42/47/30/1128424730.db2.gz PMIPMZNGRQKLRS-UHFFFAOYSA-N 1 0 264.369 3.818 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C2(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000566669137 1128549260 /nfs/dbraw/zinc/54/92/60/1128549260.db2.gz RQYPGLKCTNKDTM-GFCCVEGCSA-N 1 0 262.353 3.742 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CCC[C@@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000556251466 1128568754 /nfs/dbraw/zinc/56/87/54/1128568754.db2.gz ARSKLKJTAZNXCQ-RRFJBIMHSA-N 1 0 280.343 3.916 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1Cc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000037565825 1128620069 /nfs/dbraw/zinc/62/00/69/1128620069.db2.gz GXNOQFMEHLDAMP-SWLSCSKDSA-N 1 0 282.343 3.585 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037562581 1128620461 /nfs/dbraw/zinc/62/04/61/1128620461.db2.gz SZIFZJOUWBIGJN-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccs1 ZINC000156512502 1128636654 /nfs/dbraw/zinc/63/66/54/1128636654.db2.gz OLWOJCPPPMRJPE-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1cc(OCc2cccc([N+](=O)[O-])c2C)c(C)c(C)[nH+]1 ZINC000574948999 1128664797 /nfs/dbraw/zinc/66/47/97/1128664797.db2.gz BHICBJRUHBCAKE-UHFFFAOYSA-N 1 0 286.331 3.802 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2cc3ccccc3o2)c1 ZINC000048068291 1128679025 /nfs/dbraw/zinc/67/90/25/1128679025.db2.gz KGQOTKXJEXTWNO-UHFFFAOYSA-N 1 0 282.299 3.631 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc(C)n1 ZINC000577855762 1128693169 /nfs/dbraw/zinc/69/31/69/1128693169.db2.gz UYIVFTPEUAJVHI-AWEZNQCLSA-N 1 0 299.374 3.766 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCc2sccc2C1 ZINC000609323470 1128701718 /nfs/dbraw/zinc/70/17/18/1128701718.db2.gz QCIJJPAKTPINSR-UHFFFAOYSA-N 1 0 288.372 3.605 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC12CC2)c1ccc([N+](=O)[O-])cc1 ZINC000601289236 1128709064 /nfs/dbraw/zinc/70/90/64/1128709064.db2.gz JYHOESUIAUWXET-SMDDNHRTSA-N 1 0 260.337 3.578 20 5 CHBDRO CC[C@H](C)C[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705056 1128722880 /nfs/dbraw/zinc/72/28/80/1128722880.db2.gz LPPYOOYNJYTCGX-JTQLQIEISA-N 1 0 270.760 3.726 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000036721076 1117746050 /nfs/dbraw/zinc/74/60/50/1117746050.db2.gz OKIZXDCZWDZXEW-RISCZKNCSA-N 1 0 250.342 3.824 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000072555222 1117762505 /nfs/dbraw/zinc/76/25/05/1117762505.db2.gz RVBHUEBHNYAHFJ-CYBMUJFWSA-N 1 0 270.332 3.788 20 5 CHBDRO Cc1ccc(C[NH+](C2CCC2)C2CCC2)cc1[N+](=O)[O-] ZINC000430142187 1117766735 /nfs/dbraw/zinc/76/67/35/1117766735.db2.gz AWMUUKWGQDDKSK-UHFFFAOYSA-N 1 0 274.364 3.810 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+](C1CCC1)C1CCC1 ZINC000430149564 1117782770 /nfs/dbraw/zinc/78/27/70/1117782770.db2.gz WWZFRRLILGKKRN-UHFFFAOYSA-N 1 0 274.364 3.810 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1C(C)(C)C ZINC000430222295 1117892347 /nfs/dbraw/zinc/89/23/47/1117892347.db2.gz VFUQXLLYKSOOQG-HNNXBMFYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[NH+](CC)CCS[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000083093064 1117939274 /nfs/dbraw/zinc/93/92/74/1117939274.db2.gz RBEQBTNEAZUYCL-GFCCVEGCSA-N 1 0 282.409 3.731 20 5 CHBDRO CCCC(C)(C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000134520017 1117964049 /nfs/dbraw/zinc/96/40/49/1117964049.db2.gz GZGMKQHWHDYYIK-UHFFFAOYSA-N 1 0 270.760 3.917 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[NH+]1C2CCCC1CCC2 ZINC000610370134 1118361950 /nfs/dbraw/zinc/36/19/50/1118361950.db2.gz WZWVERGENLDNMO-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH+]2C3CCCC2CCC3)c1 ZINC000610369950 1118362049 /nfs/dbraw/zinc/36/20/49/1118362049.db2.gz DPELBGYNUVRSSX-UHFFFAOYSA-N 1 0 260.337 3.502 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000610420448 1118419789 /nfs/dbraw/zinc/41/97/89/1118419789.db2.gz KDVHHHJJEAJWPB-CYBMUJFWSA-N 1 0 299.374 3.512 20 5 CHBDRO CC(C)(C[NH2+]Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000083601838 1118456046 /nfs/dbraw/zinc/45/60/46/1118456046.db2.gz IXBOQWQIWSKMRM-UHFFFAOYSA-N 1 0 290.388 3.724 20 5 CHBDRO C[C@H]([NH2+]C[C@@H](C)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000098005624 1118686852 /nfs/dbraw/zinc/68/68/52/1118686852.db2.gz LNSOHVPZSDGHHI-NEPJUHHUSA-N 1 0 264.369 3.928 20 5 CHBDRO CCc1ccc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)o1 ZINC000090910056 1118688746 /nfs/dbraw/zinc/68/87/46/1118688746.db2.gz ZXIIFCFUPBXWMD-GFCCVEGCSA-N 1 0 288.347 3.644 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCC[C@H]2CCCF)cc1 ZINC000510696562 1118788597 /nfs/dbraw/zinc/78/85/97/1118788597.db2.gz RESFNKGNUXZNKJ-ZFWWWQNUSA-N 1 0 280.343 3.603 20 5 CHBDRO CCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000510780950 1118815192 /nfs/dbraw/zinc/81/51/92/1118815192.db2.gz LXSLCWAPUDPQFL-UHFFFAOYSA-N 1 0 299.374 3.862 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@@H](OC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000361815862 1118815896 /nfs/dbraw/zinc/81/58/96/1118815896.db2.gz VSDOHWHDAFEPEE-HZPDHXFCSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1occc1C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000610805288 1118893613 /nfs/dbraw/zinc/89/36/13/1118893613.db2.gz SSBLZGDDSHIXFB-GFCCVEGCSA-N 1 0 288.347 3.607 20 5 CHBDRO C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CC1 ZINC000610805352 1118893721 /nfs/dbraw/zinc/89/37/21/1118893721.db2.gz VVDRCJWFNDSVSZ-BLLLJJGKSA-N 1 0 288.391 3.552 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H](C)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000342274636 1118965630 /nfs/dbraw/zinc/96/56/30/1118965630.db2.gz WPANWJNAPIVMJJ-JOYOIKCWSA-N 1 0 290.285 3.834 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000342295662 1118969325 /nfs/dbraw/zinc/96/93/25/1118969325.db2.gz IPZGSEXOIPGVOR-OLZOCXBDSA-N 1 0 280.343 3.698 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CC2(C)C)cccc1[N+](=O)[O-] ZINC000540174591 1119029408 /nfs/dbraw/zinc/02/94/08/1119029408.db2.gz GARJQGHLKBKQML-RYUDHWBXSA-N 1 0 262.353 3.600 20 5 CHBDRO CCC[C@@H]([NH2+]CC[C@@H](C)F)c1cccc([N+](=O)[O-])c1 ZINC000340465755 1119418414 /nfs/dbraw/zinc/41/84/14/1119418414.db2.gz XLVCVHXXUIIMTE-BXUZGUMPSA-N 1 0 268.332 3.774 20 5 CHBDRO CC[C@H]([NH2+]C1(C(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000340480436 1119429543 /nfs/dbraw/zinc/42/95/43/1119429543.db2.gz ZGHFHKSZRRDQIZ-AWEZNQCLSA-N 1 0 262.353 3.824 20 5 CHBDRO C/C(=C\c1ccccc1)C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000536163252 1119436259 /nfs/dbraw/zinc/43/62/59/1119436259.db2.gz OXCVJYODUNGRER-NTCAYCPXSA-N 1 0 296.370 3.830 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1CCCc2occc21 ZINC000584063068 1119469578 /nfs/dbraw/zinc/46/95/78/1119469578.db2.gz GTKQWDIJGGCKEK-LSDHHAIUSA-N 1 0 298.342 3.842 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435772599 1119485471 /nfs/dbraw/zinc/48/54/71/1119485471.db2.gz QGIHJHPYHGGXNZ-DANOYGIBSA-N 1 0 297.358 3.773 20 5 CHBDRO CCCC[NH+](CCCC)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000062351407 1119779423 /nfs/dbraw/zinc/77/94/23/1119779423.db2.gz XULIINCJBQBRGF-MRXNPFEDSA-N 1 0 294.395 3.530 20 5 CHBDRO CC1(C)CC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000612416757 1119785684 /nfs/dbraw/zinc/78/56/84/1119785684.db2.gz FFHAGFIEGDPMLL-CYBMUJFWSA-N 1 0 296.798 3.959 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580240076 1119874294 /nfs/dbraw/zinc/87/42/94/1119874294.db2.gz BFMYYOQJNXVENO-RYUDHWBXSA-N 1 0 289.379 3.643 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)nc1C ZINC000414165988 1119923059 /nfs/dbraw/zinc/92/30/59/1119923059.db2.gz MTRQNGZLYIPZJI-AWEZNQCLSA-N 1 0 299.374 3.766 20 5 CHBDRO CC[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000180266616 1119966923 /nfs/dbraw/zinc/96/69/23/1119966923.db2.gz BGBQBRFHGWCAQR-JKSUJKDBSA-N 1 0 292.379 3.595 20 5 CHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1CC1 ZINC000122924686 1120054136 /nfs/dbraw/zinc/05/41/36/1120054136.db2.gz GBOCEABAXDLVQQ-UHFFFAOYSA-N 1 0 286.331 3.697 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cc(C)ccn1)c1cccc([N+](=O)[O-])c1 ZINC000328141429 1120163924 /nfs/dbraw/zinc/16/39/24/1120163924.db2.gz BUJQEBGTTOEKJF-MRXNPFEDSA-N 1 0 285.347 3.539 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC1(C)C ZINC000468634659 1120231269 /nfs/dbraw/zinc/23/12/69/1120231269.db2.gz GYESPZHANZEXPA-WEKMIXOTSA-N 1 0 274.364 3.634 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@H+](C2CC2)C2CCCC2)cc1 ZINC000103466175 1120252660 /nfs/dbraw/zinc/25/26/60/1120252660.db2.gz BRIVNSHUEUSSNC-UHFFFAOYSA-N 1 0 274.364 3.544 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C2CCCCCCC2)cc1 ZINC000035677574 1120303437 /nfs/dbraw/zinc/30/34/37/1120303437.db2.gz UALFMWNOQZAVRS-UHFFFAOYSA-N 1 0 276.380 3.840 20 5 CHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]21 ZINC000542974917 1120305290 /nfs/dbraw/zinc/30/52/90/1120305290.db2.gz FWFFUPCSSBJMNE-XOKHGSTOSA-N 1 0 288.391 3.648 20 5 CHBDRO CSCC[C@@H](C)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255173092 1120340418 /nfs/dbraw/zinc/34/04/18/1120340418.db2.gz JBKZEONLYGMVAS-FWPCIQOSSA-N 1 0 294.420 3.681 20 5 CHBDRO CSC[C@@H](C)[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417307184 1120424504 /nfs/dbraw/zinc/42/45/04/1120424504.db2.gz GTPPRIRFMNHMNC-ABAIWWIYSA-N 1 0 294.420 3.703 20 5 CHBDRO C[C@@H](F)CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417346900 1120430789 /nfs/dbraw/zinc/43/07/89/1120430789.db2.gz GALWASQGRUCXBE-ABAIWWIYSA-N 1 0 280.343 3.700 20 5 CHBDRO C[C@@H](CC[NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000315522870 1120461077 /nfs/dbraw/zinc/46/10/77/1120461077.db2.gz GGBPCGKJQHPOLU-HNNXBMFYSA-N 1 0 298.386 3.921 20 5 CHBDRO Cc1ccc(C[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000154469778 1120547081 /nfs/dbraw/zinc/54/70/81/1120547081.db2.gz CZPLQEQOLDUBIJ-UHFFFAOYSA-N 1 0 270.332 3.535 20 5 CHBDRO CC[C@H](C[C@@](C)(O)CC)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000925690770 1120599455 /nfs/dbraw/zinc/59/94/55/1120599455.db2.gz HBPLJNYLLCKQLZ-ZENOOKHLSA-N 1 0 294.395 3.575 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000282179900 1120629210 /nfs/dbraw/zinc/62/92/10/1120629210.db2.gz ZILITEHFZCJWHJ-LLVKDONJSA-N 1 0 284.306 3.510 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[NH+](C1CCC1)C1CCC1 ZINC000429132419 1120672068 /nfs/dbraw/zinc/67/20/68/1120672068.db2.gz ZUIXUASIDDGHBE-UHFFFAOYSA-N 1 0 290.363 3.510 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)o1 ZINC000044729824 1120730809 /nfs/dbraw/zinc/73/08/09/1120730809.db2.gz VUKYBTQJLPHEEY-GFCCVEGCSA-N 1 0 288.347 3.964 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000070113343 1128941499 /nfs/dbraw/zinc/94/14/99/1128941499.db2.gz YJFOYVKQPGHZIF-GYSYKLTISA-N 1 0 280.343 3.648 20 5 CHBDRO C[N@@H+]1CCCC[C@@H]1CCSc1ccc([N+](=O)[O-])cc1F ZINC000585732540 1121022221 /nfs/dbraw/zinc/02/22/21/1121022221.db2.gz SSMPMHUHPNPPHS-LLVKDONJSA-N 1 0 298.383 3.700 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)C[C@@H]1CC1(C)C ZINC001174908301 1121086908 /nfs/dbraw/zinc/08/69/08/1121086908.db2.gz ZAACLRWAYGBKJU-STQMWFEESA-N 1 0 276.380 3.942 20 5 CHBDRO CC[C@H]1CC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000571053538 1121124813 /nfs/dbraw/zinc/12/48/13/1121124813.db2.gz SMNGGUOFGGCBPN-UMSPYCQHSA-N 1 0 268.382 3.715 20 5 CHBDRO C/C=C\C[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001175043989 1121157163 /nfs/dbraw/zinc/15/71/63/1121157163.db2.gz AYAJJOMMZZCGOK-RXYHWBRQSA-N 1 0 288.391 3.816 20 5 CHBDRO CC[C@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000509535927 1121388039 /nfs/dbraw/zinc/38/80/39/1121388039.db2.gz AEDVNCQHEJFENM-PIZKADEWSA-N 1 0 274.364 3.730 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2C2CC2)ccc1Cl ZINC000706685039 1121434562 /nfs/dbraw/zinc/43/45/62/1121434562.db2.gz PBMMDCXTXADJEV-ZDUSSCGKSA-N 1 0 280.755 3.623 20 5 CHBDRO C[C@H](CC1CCC1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000710230271 1121474400 /nfs/dbraw/zinc/47/44/00/1121474400.db2.gz YAYDGMFCGKYAQD-NEPJUHHUSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1cccc2[nH+]cc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)n21 ZINC001175902838 1121494686 /nfs/dbraw/zinc/49/46/86/1121494686.db2.gz UJRNFHRTQLZWJW-MDZDMXLPSA-N 1 0 294.314 3.634 20 5 CHBDRO C[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@H]1C ZINC000512647833 1121507336 /nfs/dbraw/zinc/50/73/36/1121507336.db2.gz HTGBOAZWEOWWIW-CHOOUNKSSA-N 1 0 274.364 3.728 20 5 CHBDRO C[C@@H]1CC2(CCC2)C[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000433020745 1121520394 /nfs/dbraw/zinc/52/03/94/1121520394.db2.gz DIVYSIPSQKBRST-BTKRWWFXSA-N 1 0 286.375 3.873 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000509377978 1121559439 /nfs/dbraw/zinc/55/94/39/1121559439.db2.gz GZKWOTGRBCCWCN-FNOHHLHBSA-N 1 0 262.353 3.586 20 5 CHBDRO CCC(C)(C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000429430962 1121580190 /nfs/dbraw/zinc/58/01/90/1121580190.db2.gz MAPKWMQVKPRHRT-LBPRGKRZSA-N 1 0 264.369 3.990 20 5 CHBDRO Cc1occc1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000067217924 1121669374 /nfs/dbraw/zinc/66/93/74/1121669374.db2.gz VVXYSKWQCKLXAW-UHFFFAOYSA-N 1 0 288.347 3.909 20 5 CHBDRO CC/C=C\C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001178801260 1121817421 /nfs/dbraw/zinc/81/74/21/1121817421.db2.gz ZLTDZUMBWPFLJV-UTCJRWHESA-N 1 0 286.331 3.911 20 5 CHBDRO COc1ccc(C[N@H+](C)C[C@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000619843971 1129015088 /nfs/dbraw/zinc/01/50/88/1129015088.db2.gz JUPIXWYWVKOXTE-LBPRGKRZSA-N 1 0 294.395 3.717 20 5 CHBDRO COc1ccc(C[N@H+](C)C[C@@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000619843970 1129015108 /nfs/dbraw/zinc/01/51/08/1129015108.db2.gz JUPIXWYWVKOXTE-GFCCVEGCSA-N 1 0 294.395 3.717 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000034995553 1122136812 /nfs/dbraw/zinc/13/68/12/1122136812.db2.gz MFPWQQYHXPRTDF-CORIIIEPSA-N 1 0 276.380 3.818 20 5 CHBDRO CSCC[C@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774198459 1122139408 /nfs/dbraw/zinc/13/94/08/1122139408.db2.gz BDMRZZUVNDABCK-NHYWBVRUSA-N 1 0 294.420 3.703 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CC[C@H](C)C1 ZINC000429591128 1122143056 /nfs/dbraw/zinc/14/30/56/1122143056.db2.gz QQQSEONJPUQIDO-JSGCOSHPSA-N 1 0 292.379 3.614 20 5 CHBDRO CCC(CC)[C@H](CNc1cc(C)ccc1[N+](=O)[O-])[NH+](C)C ZINC001184740498 1122295266 /nfs/dbraw/zinc/29/52/66/1122295266.db2.gz QREIRYYAZWKMLP-INIZCTEOSA-N 1 0 293.411 3.682 20 5 CHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000505605134 1122434943 /nfs/dbraw/zinc/43/49/43/1122434943.db2.gz GDCZOMLDKNLAKD-QPJJXVBHSA-N 1 0 288.372 3.802 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000515260953 1122487274 /nfs/dbraw/zinc/48/72/74/1122487274.db2.gz YPPQNCCWVACLPJ-MRXNPFEDSA-N 1 0 286.375 3.668 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C)CCC[C@@H]1C ZINC001191070299 1122568498 /nfs/dbraw/zinc/56/84/98/1122568498.db2.gz KCQGVHJGDCZCOV-OLZOCXBDSA-N 1 0 292.379 3.614 20 5 CHBDRO CCCCOCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000516296714 1122585166 /nfs/dbraw/zinc/58/51/66/1122585166.db2.gz ZMYWBDIFVRZVLP-UHFFFAOYSA-N 1 0 294.395 3.622 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@@H](C)C1 ZINC000437044208 1122606891 /nfs/dbraw/zinc/60/68/91/1122606891.db2.gz LEZLCPZIOFNTQM-UMVBOHGHSA-N 1 0 276.380 3.694 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC=C(C)C1 ZINC000437351112 1122629604 /nfs/dbraw/zinc/62/96/04/1122629604.db2.gz YQOJDGUGSWURLR-ZROIWOOFSA-N 1 0 272.348 3.650 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@H]1C ZINC001193413272 1122690537 /nfs/dbraw/zinc/69/05/37/1122690537.db2.gz MJIUBKZDGMADSN-CJNGLKHVSA-N 1 0 276.380 3.995 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC3(CCCC3)C2)cc1 ZINC000438362714 1122694437 /nfs/dbraw/zinc/69/44/37/1122694437.db2.gz IGBVJMNEKJBWNJ-UHFFFAOYSA-N 1 0 274.364 3.751 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC1CC(C)(C)C1 ZINC001193743756 1122712123 /nfs/dbraw/zinc/71/21/23/1122712123.db2.gz TWWGOSPIICQNEA-UHFFFAOYSA-N 1 0 276.380 3.505 20 5 CHBDRO CC[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(C)C ZINC000506356364 1122724618 /nfs/dbraw/zinc/72/46/18/1122724618.db2.gz OEHFJTQSLGUDIN-UHFFFAOYSA-N 1 0 264.369 3.949 20 5 CHBDRO CSCCC[N@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000439472200 1122782583 /nfs/dbraw/zinc/78/25/83/1122782583.db2.gz RMZCURCGQVIUHM-GFCCVEGCSA-N 1 0 282.409 3.649 20 5 CHBDRO Cc1cccc(C[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)c1C ZINC001194615102 1122788496 /nfs/dbraw/zinc/78/84/96/1122788496.db2.gz BHISWZYZQUQOKD-UHFFFAOYSA-N 1 0 298.386 3.886 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001195808817 1122890956 /nfs/dbraw/zinc/89/09/56/1122890956.db2.gz CTNOQHCNJUICHA-AWEZNQCLSA-N 1 0 296.370 3.757 20 5 CHBDRO Cc1cccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1C ZINC000507152241 1122934027 /nfs/dbraw/zinc/93/40/27/1122934027.db2.gz QRSLGGAJXUYWEE-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO CCCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000507189807 1122937795 /nfs/dbraw/zinc/93/77/95/1122937795.db2.gz CAALWRIXAYRCST-SOFGYWHQSA-N 1 0 274.364 3.873 20 5 CHBDRO CC(C)[C@H](C)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507227184 1122941754 /nfs/dbraw/zinc/94/17/54/1122941754.db2.gz DNXCDEOHKKKZBO-XOVSCCBYSA-N 1 0 262.353 3.584 20 5 CHBDRO C[C@H](c1ccncc1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183715039 1129089858 /nfs/dbraw/zinc/08/98/58/1129089858.db2.gz OZYXHTYTCBKHLD-HZRUHFOJSA-N 1 0 297.358 3.696 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H](C3CCCC3)C2)c1 ZINC001198706124 1123008950 /nfs/dbraw/zinc/00/89/50/1123008950.db2.gz OJTBEGGSPXFGHV-INIZCTEOSA-N 1 0 288.391 3.997 20 5 CHBDRO CC1(C)CC[C@@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000507789559 1123192512 /nfs/dbraw/zinc/19/25/12/1123192512.db2.gz UFALBXRDVDLUMR-HZRUHFOJSA-N 1 0 274.364 3.776 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C=CCC2)o1 ZINC000850359121 1123256301 /nfs/dbraw/zinc/25/63/01/1123256301.db2.gz XHLODILQGVYJTJ-GFCCVEGCSA-N 1 0 284.315 3.663 20 5 CHBDRO C[C@H](Nc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccccc1)[NH+](C)C ZINC000439129604 1123362789 /nfs/dbraw/zinc/36/27/89/1123362789.db2.gz QYDYVZDAMCEEDZ-GUYCJALGSA-N 1 0 299.374 3.698 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC000544611784 1123377941 /nfs/dbraw/zinc/37/79/41/1123377941.db2.gz JQWMETQZWWHCJH-KRWDZBQOSA-N 1 0 296.370 3.893 20 5 CHBDRO C[NH2+]C[C@@H](C)NCc1c2ccccc2cc2ccccc21 ZINC000853249503 1123429752 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O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCCC2(CCC2)C1 ZINC000475269056 1123832884 /nfs/dbraw/zinc/83/28/84/1123832884.db2.gz JYBVTSWXMWRCSL-CLTKARDFSA-N 1 0 286.375 3.874 20 5 CHBDRO C[C@H]1CCCCC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000088512767 1124063748 /nfs/dbraw/zinc/06/37/48/1124063748.db2.gz PMPNHTOSGRVKQH-XJKSGUPXSA-N 1 0 276.380 3.696 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC1(C)C ZINC000525124836 1124115699 /nfs/dbraw/zinc/11/56/99/1124115699.db2.gz IHLOQNHLSCDOQU-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO CC(C)[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000446737377 1124121269 /nfs/dbraw/zinc/12/12/69/1124121269.db2.gz VCQVMJXFHTURLP-LLVKDONJSA-N 1 0 282.771 3.726 20 5 CHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000525637137 1124451524 /nfs/dbraw/zinc/45/15/24/1124451524.db2.gz ZVKMQFGYLFLHPB-STQMWFEESA-N 1 0 262.353 3.605 20 5 CHBDRO CC1(C)CCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000525639696 1124452763 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CCSCCC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872069156 1124673267 /nfs/dbraw/zinc/67/32/67/1124673267.db2.gz LPGKAXQANCMHOG-SNVBAGLBSA-N 1 0 286.372 3.528 20 5 CHBDRO C[C@@H](CCC1CC1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449246524 1124680123 /nfs/dbraw/zinc/68/01/23/1124680123.db2.gz BVPYSFWMCPPHGK-STQMWFEESA-N 1 0 276.380 3.694 20 5 CHBDRO CC(C)OC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000872118147 1124688334 /nfs/dbraw/zinc/68/83/34/1124688334.db2.gz ZNMDMMIXLRQYNE-CYBMUJFWSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(F)F ZINC000449354086 1124708637 /nfs/dbraw/zinc/70/86/37/1124708637.db2.gz JZSHHCRBUOMLQC-LLVKDONJSA-N 1 0 286.322 3.551 20 5 CHBDRO Cc1cccc(F)c1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000873063233 1124736751 /nfs/dbraw/zinc/73/67/51/1124736751.db2.gz OCXYRQOIUJHZOF-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO CC[C@H]([NH2+]C[C@H](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000129919347 1124914343 /nfs/dbraw/zinc/91/43/43/1124914343.db2.gz UGXYSEHFPVBYIX-NHYWBVRUSA-N 1 0 262.353 3.682 20 5 CHBDRO Cc1cc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc[nH+]1 ZINC000450752068 1125102334 /nfs/dbraw/zinc/10/23/34/1125102334.db2.gz FSQJZGVMSAOLKO-OAHLLOKOSA-N 1 0 297.358 3.682 20 5 CHBDRO Cc1cc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc[nH+]1 ZINC000450752062 1125102496 /nfs/dbraw/zinc/10/24/96/1125102496.db2.gz FSQJZGVMSAOLKO-HNNXBMFYSA-N 1 0 297.358 3.682 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](C)CCCCO)c1cccc([N+](=O)[O-])c1 ZINC000295841978 1125164228 /nfs/dbraw/zinc/16/42/28/1125164228.db2.gz ANSOGGPODKUWTH-BBRMVZONSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1OC1CC[NH+](C(C)(C)C)CC1 ZINC001228922391 1125321464 /nfs/dbraw/zinc/32/14/64/1125321464.db2.gz ZUQJPCOKOXQANQ-UHFFFAOYSA-N 1 0 292.379 3.545 20 5 CHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000212970180 1125357233 /nfs/dbraw/zinc/35/72/33/1125357233.db2.gz IRYMPEBZKSADFE-CYBMUJFWSA-N 1 0 280.343 3.889 20 5 CHBDRO CC1(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC(F)(F)C1 ZINC000883250136 1125384728 /nfs/dbraw/zinc/38/47/28/1125384728.db2.gz CRECIJXHJANZBK-GQCTYLIASA-N 1 0 296.317 3.633 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC[C@H]2CCCC2(F)F)cc1 ZINC000883266780 1125389079 /nfs/dbraw/zinc/38/90/79/1125389079.db2.gz JIHUXWQSVCDMIF-GFCCVEGCSA-N 1 0 284.306 3.510 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000614822431 1125389119 /nfs/dbraw/zinc/38/91/19/1125389119.db2.gz LWSCFXYHOYJIOH-UHFFFAOYSA-N 1 0 290.285 3.724 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCc2ccccc2CC1 ZINC000532586248 1125416325 /nfs/dbraw/zinc/41/63/25/1125416325.db2.gz WYQDZMUSJZBNHU-AWEZNQCLSA-N 1 0 296.370 3.757 20 5 CHBDRO C[C@@H](C[NH2+][C@H]1CCC12CCC2)c1ccccc1[N+](=O)[O-] ZINC000897465034 1125424688 /nfs/dbraw/zinc/42/46/88/1125424688.db2.gz QZOMXYSXDSUYFJ-WFASDCNBSA-N 1 0 274.364 3.621 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000090359869 1129281163 /nfs/dbraw/zinc/28/11/63/1129281163.db2.gz QXCARSNEKUTGTG-UHFFFAOYSA-N 1 0 295.339 3.561 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)[C@H](C)C1 ZINC000094773746 1129451889 /nfs/dbraw/zinc/45/18/89/1129451889.db2.gz AAJFWANJSHYBTM-GYSYKLTISA-N 1 0 280.343 3.648 20 5 CHBDRO CC[N@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774521 1129451974 /nfs/dbraw/zinc/45/19/74/1129451974.db2.gz KKYSSBGPCWLGBI-UHFFFAOYSA-N 1 0 294.351 3.818 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC2(CCCC2)C1 ZINC000743864082 1129541691 /nfs/dbraw/zinc/54/16/91/1129541691.db2.gz UUNZZWYYAHSVCW-ZDUSSCGKSA-N 1 0 274.364 3.922 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(CCCC2)C1 ZINC000743864069 1129542022 /nfs/dbraw/zinc/54/20/22/1129542022.db2.gz IBHKRVIDJLXQBF-CYBMUJFWSA-N 1 0 274.364 3.922 20 5 CHBDRO Cc1ccc(C[NH2+]CCCCC(C)C)cc1[N+](=O)[O-] ZINC000096867592 1129561713 /nfs/dbraw/zinc/56/17/13/1129561713.db2.gz CKJZKNLUUUQZRI-UHFFFAOYSA-N 1 0 264.369 3.819 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])[C@H]1C ZINC000252438161 1129576635 /nfs/dbraw/zinc/57/66/35/1129576635.db2.gz ZVMAWDMFZNVNAK-UHIISALHSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2C[C@H]2C2CCC2)cc1Cl ZINC000822498299 1131384789 /nfs/dbraw/zinc/38/47/89/1131384789.db2.gz XPGCXFYQNWCLQH-WCQYABFASA-N 1 0 280.755 3.526 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]CCC2CCCCCCC2)C1 ZINC001168976995 1129686350 /nfs/dbraw/zinc/68/63/50/1129686350.db2.gz GQEDNBXQJZGGMY-HZPDHXFCSA-N 1 0 282.428 3.772 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc2ccccc21 ZINC001168964773 1129687561 /nfs/dbraw/zinc/68/75/61/1129687561.db2.gz WBQAWSPSNPLKAM-FMKPAKJESA-N 1 0 298.386 3.936 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc2ccccc21 ZINC001168964775 1129687661 /nfs/dbraw/zinc/68/76/61/1129687661.db2.gz WBQAWSPSNPLKAM-IJEWVQPXSA-N 1 0 298.386 3.936 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc2ccccc21 ZINC001168964776 1129687868 /nfs/dbraw/zinc/68/78/68/1129687868.db2.gz WBQAWSPSNPLKAM-YCPHGPKFSA-N 1 0 298.386 3.936 20 5 CHBDRO CC(C)(C)[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168975222 1129688664 /nfs/dbraw/zinc/68/86/64/1129688664.db2.gz UWLXBSWVEUEXDM-VNQPRFMTSA-N 1 0 290.407 3.809 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H]([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169006534 1129689006 /nfs/dbraw/zinc/68/90/06/1129689006.db2.gz YRYILSXOBWFOSK-BYNSBNAKSA-N 1 0 282.428 3.626 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCCC[C@H]2c2ccccc2)C1 ZINC001169006019 1129689414 /nfs/dbraw/zinc/68/94/14/1129689414.db2.gz FIPBYULVNOJYAP-OIISXLGYSA-N 1 0 288.391 3.659 20 5 CHBDRO CCc1ccc([C@@H](CC)[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169005894 1129689490 /nfs/dbraw/zinc/68/94/90/1129689490.db2.gz VQAAZRRNSREIOO-USXIJHARSA-N 1 0 290.407 3.735 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C)c(C)c1 ZINC001168988570 1129689854 /nfs/dbraw/zinc/68/98/54/1129689854.db2.gz SNPJGAULMRQIEZ-BHYGNILZSA-N 1 0 290.407 3.790 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168987184 1129690124 /nfs/dbraw/zinc/69/01/24/1129690124.db2.gz HGUAUMWNWMHEMD-VBNZEHGJSA-N 1 0 294.370 3.558 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C)c(C)c1 ZINC001168988571 1129690167 /nfs/dbraw/zinc/69/01/67/1129690167.db2.gz SNPJGAULMRQIEZ-DJIMGWMZSA-N 1 0 290.407 3.790 20 5 CHBDRO CNc1ccc(C)cc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000902460306 1130013644 /nfs/dbraw/zinc/01/36/44/1130013644.db2.gz GPAWPAVJYVAJNQ-CYBMUJFWSA-N 1 0 299.374 3.796 20 5 CHBDRO CCNc1ccccc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000902523424 1130019791 /nfs/dbraw/zinc/01/97/91/1130019791.db2.gz JRJVQRUIEZCQTE-UHFFFAOYSA-N 1 0 299.374 3.625 20 5 CHBDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001461846991 1130060078 /nfs/dbraw/zinc/06/00/78/1130060078.db2.gz CXLYGYBDLRBHCU-WDEREUQCSA-N 1 0 282.771 3.869 20 5 CHBDRO [NH3+]Cc1cncc(-c2nc3ccccc3c3ccccc32)c1 ZINC001239787164 1130107224 /nfs/dbraw/zinc/10/72/24/1130107224.db2.gz UQNUSTOIFZYYSO-UHFFFAOYSA-N 1 0 285.350 3.909 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746666078 1130142750 /nfs/dbraw/zinc/14/27/50/1130142750.db2.gz IJMUDUJTCZQUBZ-GFCCVEGCSA-N 1 0 268.744 3.623 20 5 CHBDRO CO[C@H]1CCC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000903286806 1130147004 /nfs/dbraw/zinc/14/70/04/1130147004.db2.gz HCHPRUNKFNAXJQ-INWMFGNUSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000903428004 1130175450 /nfs/dbraw/zinc/17/54/50/1130175450.db2.gz LOQJJMUHNQNJDW-YVEFUNNKSA-N 1 0 297.358 3.792 20 5 CHBDRO CCc1ccccc1C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788602771 1130197458 /nfs/dbraw/zinc/19/74/58/1130197458.db2.gz NZXGOKIEWMKCAN-LBPRGKRZSA-N 1 0 299.374 3.590 20 5 CHBDRO Cc1cccc(C)c1C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788671830 1130201939 /nfs/dbraw/zinc/20/19/39/1130201939.db2.gz ZJEWQFQBWPYLNR-CYBMUJFWSA-N 1 0 299.374 3.645 20 5 CHBDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000748820391 1130249641 /nfs/dbraw/zinc/24/96/41/1130249641.db2.gz YHZNOUUAWLCJSK-QGZVFWFLSA-N 1 0 296.370 3.989 20 5 CHBDRO CCC[NH+](CCC)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170327252 1130482008 /nfs/dbraw/zinc/48/20/08/1130482008.db2.gz GJYAPTMFUXBGBR-ZDUSSCGKSA-N 1 0 294.395 3.656 20 5 CHBDRO C[C@@H]1C[C@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473711 1130614507 /nfs/dbraw/zinc/61/45/07/1130614507.db2.gz JERFMMXTLSTJAQ-SFYZADRCSA-N 1 0 289.162 3.647 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811505767 1130617465 /nfs/dbraw/zinc/61/74/65/1130617465.db2.gz HSWYTNOMLNOHPP-HQJQHLMTSA-N 1 0 289.162 3.790 20 5 CHBDRO CC(C)[C@@H]1CC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000796837512 1130937740 /nfs/dbraw/zinc/93/77/40/1130937740.db2.gz DFBDGDMSTVNOJY-GXTWGEPZSA-N 1 0 282.771 3.772 20 5 CHBDRO CC[C@H](C)C[C@@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815595217 1131005756 /nfs/dbraw/zinc/00/57/56/1131005756.db2.gz KXKJPNQNJARBCU-QJPTWQEYSA-N 1 0 279.384 3.652 20 5 CHBDRO C[C@@H]([NH2+]C1CC(C(C)(C)C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815643319 1131015326 /nfs/dbraw/zinc/01/53/26/1131015326.db2.gz ZJXJVBOXURFNEF-QFWMXSHPSA-N 1 0 291.395 3.652 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437070 1131563712 /nfs/dbraw/zinc/56/37/12/1131563712.db2.gz SCJROEOKMWIUEV-SMDDNHRTSA-N 1 0 296.317 3.777 20 5 CHBDRO OC[C@@H](CCF)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000846097687 1131689250 /nfs/dbraw/zinc/68/92/50/1131689250.db2.gz UFUNFBRYLSHRAQ-MRXNPFEDSA-N 1 0 297.373 3.803 20 5 CHBDRO CC[N@@H+]1CC[C@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001227764357 1131739562 /nfs/dbraw/zinc/73/95/62/1131739562.db2.gz NSQOLWSGTUIROC-INIZCTEOSA-N 1 0 292.382 3.861 20 5 CHBDRO CC[N@@H+]1CC[C@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001228176773 1131823391 /nfs/dbraw/zinc/82/33/91/1131823391.db2.gz RMBHEBNKBPEYAQ-INIZCTEOSA-N 1 0 292.382 3.861 20 5 CHBDRO Cc1ccc(C(C)(C)C)c(O[C@@H](C)C[N+](C)(C)C)c1 ZINC001228193220 1131827208 /nfs/dbraw/zinc/82/72/08/1131827208.db2.gz RIMXYWUJFUXZEV-AWEZNQCLSA-N 1 0 264.433 3.766 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000773122461 1131951998 /nfs/dbraw/zinc/95/19/98/1131951998.db2.gz UABKRYRGDRXJPS-NWDGAFQWSA-N 1 0 273.336 3.643 20 5 CHBDRO CCCCCCc1ccc(O)cc1O[C@H](C)C[N+](C)(C)C ZINC001228850324 1131965555 /nfs/dbraw/zinc/96/55/55/1131965555.db2.gz KCCBVVQTGRJKAG-OAHLLOKOSA-O 1 0 294.459 3.989 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036790524 1131974831 /nfs/dbraw/zinc/97/48/31/1131974831.db2.gz KVOCMIHSZWOMDX-SNVBAGLBSA-N 1 0 270.760 3.869 20 5 CHBDRO C[C@@H](CCc1ccco1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000037177117 1132007115 /nfs/dbraw/zinc/00/71/15/1132007115.db2.gz DDFUMHACGGFHNJ-STQMWFEESA-N 1 0 288.347 3.860 20 5 CHBDRO C[NH+]1CCC(Oc2nccc3c4ccccc4ccc32)CC1 ZINC001230201155 1132159957 /nfs/dbraw/zinc/15/99/57/1132159957.db2.gz PYXQGXGZJICXNV-UHFFFAOYSA-N 1 0 292.382 3.861 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1nccc2c3ccccc3ccc21 ZINC001230202702 1132159979 /nfs/dbraw/zinc/15/99/79/1132159979.db2.gz BEPVTWUUNXYHHD-CQSZACIVSA-N 1 0 295.406 3.862 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)ccc1Cl ZINC000839186931 1132188462 /nfs/dbraw/zinc/18/84/62/1132188462.db2.gz SVQVCCGWXHIATF-MDZLAQPJSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1c(Cl)cccc1C(F)(F)F ZINC001230826540 1132219311 /nfs/dbraw/zinc/21/93/11/1132219311.db2.gz OOZOJUNINNDBCR-VIFPVBQESA-N 1 0 296.740 3.832 20 5 CHBDRO CC[N@H+](C(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907668 1132349881 /nfs/dbraw/zinc/34/98/81/1132349881.db2.gz HJYJRKQRVLEAOK-OAHLLOKOSA-N 1 0 276.380 3.573 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC001173215740 1132411626 /nfs/dbraw/zinc/41/16/26/1132411626.db2.gz ZBVRFRMDAFHESF-NWDGAFQWSA-N 1 0 264.369 3.550 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H](C)C1 ZINC001173226058 1132412199 /nfs/dbraw/zinc/41/21/99/1132412199.db2.gz KXAXSWUDWPDTLK-ZIAGYGMSSA-N 1 0 276.380 3.648 20 5 CHBDRO CCCC[N@H+](CC)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225420 1132412922 /nfs/dbraw/zinc/41/29/22/1132412922.db2.gz JWHFLLGLFPQPJW-ZDUSSCGKSA-N 1 0 264.369 3.648 20 5 CHBDRO CCC1CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173223140 1132412948 /nfs/dbraw/zinc/41/29/48/1132412948.db2.gz YMGNPPMTOYCBCS-ZDUSSCGKSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1cccs1 ZINC001173225914 1132412992 /nfs/dbraw/zinc/41/29/92/1132412992.db2.gz GRHPBRPBTCKDCS-LBPRGKRZSA-N 1 0 290.388 3.719 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC12CCC2 ZINC001173229445 1132413613 /nfs/dbraw/zinc/41/36/13/1132413613.db2.gz VANYKMTWTBMOJZ-CZUORRHYSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCc1ccccc1 ZINC001173229890 1132413683 /nfs/dbraw/zinc/41/36/83/1132413683.db2.gz WBCABZYIBKESJG-OAHLLOKOSA-N 1 0 298.386 3.700 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)[C@@H](C)C1 ZINC001173230482 1132413757 /nfs/dbraw/zinc/41/37/57/1132413757.db2.gz YJKMVHSBWKVOHC-ILXRZTDVSA-N 1 0 290.407 3.894 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC001173233589 1132413824 /nfs/dbraw/zinc/41/38/24/1132413824.db2.gz JQVGBYHUUDBPHH-DYVFJYSZSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1CC(C)(C)C1 ZINC001173230666 1132413988 /nfs/dbraw/zinc/41/39/88/1132413988.db2.gz TXNQTTSOZOVBOW-GFCCVEGCSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001173209356 1132416618 /nfs/dbraw/zinc/41/66/18/1132416618.db2.gz BRKVBYYUIRLSAO-YPMHNXCESA-N 1 0 298.333 3.551 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC001173211921 1132416718 /nfs/dbraw/zinc/41/67/18/1132416718.db2.gz VLASKHXTFCMBHM-NWDGAFQWSA-N 1 0 290.388 3.938 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC001173211115 1132416742 /nfs/dbraw/zinc/41/67/42/1132416742.db2.gz PKPULPWHKKWTQA-LZWOXQAQSA-N 1 0 290.407 3.942 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C[N@@H+]3CCC[C@@H]4C[C@@H]43)nc12 ZINC001232222342 1132438948 /nfs/dbraw/zinc/43/89/48/1132438948.db2.gz AYBYNTOJBQWMLG-WBVHZDCISA-N 1 0 289.382 3.767 20 5 CHBDRO Cc1cc(NCC2([NH+](C)C)CCCCC2)c([N+](=O)[O-])s1 ZINC001161947470 1133040745 /nfs/dbraw/zinc/04/07/45/1133040745.db2.gz GMQRRISVFVHCIN-UHFFFAOYSA-N 1 0 297.424 3.641 20 5 CHBDRO CC(C)(C)c1ccc(N[C@@H]2CCC[C@H]([NH3+])C2)c([N+](=O)[O-])c1 ZINC001162400302 1133075562 /nfs/dbraw/zinc/07/55/62/1133075562.db2.gz GVLAYHNEEKUXQS-QWHCGFSZSA-N 1 0 291.395 3.574 20 5 CHBDRO Cc1cccc([N+](=O)[O-])c1-n1ccc2cc([C@@H](C)[NH3+])ccc21 ZINC001162909820 1133121625 /nfs/dbraw/zinc/12/16/25/1133121625.db2.gz OJRCTTSOSDSAPM-GFCCVEGCSA-N 1 0 295.342 3.867 20 5 CHBDRO CCC[C@@H](C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)OCC ZINC001203249640 1133308765 /nfs/dbraw/zinc/30/87/65/1133308765.db2.gz TYTYRKVOCOIUIC-AWEZNQCLSA-N 1 0 294.395 3.506 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCSCC[C@@H]1C ZINC001205405597 1133574111 /nfs/dbraw/zinc/57/41/11/1133574111.db2.gz KWMOUQYOJHPBIE-LBPRGKRZSA-N 1 0 294.420 3.539 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC001205403255 1133574702 /nfs/dbraw/zinc/57/47/02/1133574702.db2.gz WKCVLGMQFAELGS-HUUCEWRRSA-N 1 0 276.380 3.818 20 5 CHBDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001205489670 1133582623 /nfs/dbraw/zinc/58/26/23/1133582623.db2.gz WVLZQHRUDVDPMW-DOMZBBRYSA-N 1 0 276.380 3.832 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@H](C3CC3)[C@@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001205875832 1133625102 /nfs/dbraw/zinc/62/51/02/1133625102.db2.gz PNHOAPBNFIKFGD-WBVHZDCISA-N 1 0 286.375 3.524 20 5 CHBDRO Cc1ccc(Nc2ccc(CC[NH+](C)C)cc2)c([N+](=O)[O-])c1 ZINC001214174239 1134516701 /nfs/dbraw/zinc/51/67/01/1134516701.db2.gz MFFXDSPCHQNSRA-UHFFFAOYSA-N 1 0 299.374 3.751 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000403327878 1134757123 /nfs/dbraw/zinc/75/71/23/1134757123.db2.gz AZNOHYCEYCPMQS-MXYBEHONSA-N 1 0 274.364 3.682 20 5 CHBDRO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1cccc([N+](=O)[O-])c1 ZINC000403504428 1134790598 /nfs/dbraw/zinc/79/05/98/1134790598.db2.gz JCCUROGBBSFHNB-UFBLJUAHSA-N 1 0 292.404 3.672 20 5 CHBDRO C[NH2+][C@H]1C[C@@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001217957896 1135031274 /nfs/dbraw/zinc/03/12/74/1135031274.db2.gz VYSMJSYGGKBGTQ-OKILXGFUSA-N 1 0 278.355 3.517 20 5 CHBDRO c1ccc2c(c1)nc(O[C@H]1CCCC[NH2+]C1)c1ccccc21 ZINC001217972195 1135034182 /nfs/dbraw/zinc/03/41/82/1135034182.db2.gz QMGRSOXSAQDMGQ-AWEZNQCLSA-N 1 0 292.382 3.909 20 5 CHBDRO c1ccc2c(c1)nc(OC1CC3(C[NH2+]C3)C1)c1ccccc21 ZINC001218053810 1135051272 /nfs/dbraw/zinc/05/12/72/1135051272.db2.gz FMYGPKPUNRWHDT-UHFFFAOYSA-N 1 0 290.366 3.519 20 5 CHBDRO Oc1c2ccccc2c(O[C@H]2CCC[NH2+]C2)c2ccccc12 ZINC001218284910 1135079056 /nfs/dbraw/zinc/07/90/56/1135079056.db2.gz YOGQEUJRVVOJHM-ZDUSSCGKSA-N 1 0 293.366 3.829 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2O[C@@H]1C[C@H]2C[NH2+]C[C@H]21 ZINC001218329312 1135088968 /nfs/dbraw/zinc/08/89/68/1135088968.db2.gz BENSNRHFCDKCJV-KFKAGJAMSA-N 1 0 289.378 3.980 20 5 CHBDRO c1ccc2cc3cc(O[C@@H]4C[C@@H]5C[NH2+]C[C@@H]45)ccc3cc2c1 ZINC001218332967 1135089626 /nfs/dbraw/zinc/08/96/26/1135089626.db2.gz XOMSHUJRTYKFQK-MISYRCLQSA-N 1 0 289.378 3.980 20 5 CHBDRO C[C@@H]1CC[NH2+]C[C@@H]1Oc1cccc2cc3ccccc3nc21 ZINC001218481747 1135112420 /nfs/dbraw/zinc/11/24/20/1135112420.db2.gz WBSCMWSMKDFAGI-ACJLOTCBSA-N 1 0 292.382 3.765 20 5 CHBDRO CC(C)C[NH+](Cc1ccc([N+](=O)[O-])cc1F)CC(C)C ZINC000313568809 1135139184 /nfs/dbraw/zinc/13/91/84/1135139184.db2.gz VPHJRLZGDOUXKE-UHFFFAOYSA-N 1 0 282.359 3.848 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1cccc([N+](=O)[O-])c1 ZINC000316885951 1135170782 /nfs/dbraw/zinc/17/07/82/1135170782.db2.gz VYNDSWCDHTZGTR-WBMJQRKESA-N 1 0 297.358 3.718 20 5 CHBDRO C[C@@H](C[NH+](C)C)OCc1c2ccccc2nc2ccccc21 ZINC001223334037 1135329972 /nfs/dbraw/zinc/32/99/72/1135329972.db2.gz GLCMVAMIXIHKFP-AWEZNQCLSA-N 1 0 294.398 3.855 20 5 CHBDRO C[C@@H](O[C@H]1CC[C@H]([NH+](C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC001224021609 1135411122 /nfs/dbraw/zinc/41/11/22/1135411122.db2.gz ASXWKHOCVWMHCN-XNRPHZJLSA-N 1 0 292.379 3.545 20 5 CHBDRO CCC[C@@H](OCCC[N+](C)(C)C)c1ccc(OC)cc1 ZINC001224621430 1135462698 /nfs/dbraw/zinc/46/26/98/1135462698.db2.gz UXPFOPKVMABENB-QGZVFWFLSA-N 1 0 280.432 3.649 20 5 CHBDRO C[C@H](OCC[N+](C)(C)C)c1c(Cl)ccc(F)c1Cl ZINC001224772218 1135480556 /nfs/dbraw/zinc/48/05/56/1135480556.db2.gz XEFPDZPQVPFEPZ-VIFPVBQESA-N 1 0 295.205 3.916 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(Cl)c2ccccc12 ZINC001225269246 1135532053 /nfs/dbraw/zinc/53/20/53/1135532053.db2.gz MXTSFKPHERELEO-LBPRGKRZSA-N 1 0 278.803 3.967 20 5 CHBDRO CCCCCc1cc(O)cc(O[C@@H](C)C[N+](C)(C)C)c1 ZINC001227190873 1135798135 /nfs/dbraw/zinc/79/81/35/1135798135.db2.gz RHMWLSBDLCDIJV-AWEZNQCLSA-O 1 0 280.432 3.598 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000070101810 260152132 /nfs/dbraw/zinc/15/21/32/260152132.db2.gz SJLPQEYFDDQFNH-NHYWBVRUSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+]CC1(C)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000104437712 186002128 /nfs/dbraw/zinc/00/21/28/186002128.db2.gz BFTUISJQTKSDBP-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000094322268 261184373 /nfs/dbraw/zinc/18/43/73/261184373.db2.gz HSQKIHKEPQIOHD-BXUZGUMPSA-N 1 0 262.353 3.824 20 5 CHBDRO CCC(C)(C)C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000574862878 335052987 /nfs/dbraw/zinc/05/29/87/335052987.db2.gz YOPLAPLOYGZAID-LBPRGKRZSA-N 1 0 264.369 3.990 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000020126326 171010621 /nfs/dbraw/zinc/01/06/21/171010621.db2.gz FPWGGIJDPANVAO-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO CCC(CC)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000020133031 171020923 /nfs/dbraw/zinc/02/09/23/171020923.db2.gz FBWVAJFABKHQLA-LLVKDONJSA-N 1 0 250.342 3.742 20 5 CHBDRO CCC(CC)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000020133029 171021008 /nfs/dbraw/zinc/02/10/08/171021008.db2.gz FBWVAJFABKHQLA-NSHDSACASA-N 1 0 250.342 3.742 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000020148041 171034911 /nfs/dbraw/zinc/03/49/11/171034911.db2.gz UIYBCFRJLWOKFO-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000020148563 171036971 /nfs/dbraw/zinc/03/69/71/171036971.db2.gz POVDMOJKBCVEIG-JTQLQIEISA-N 1 0 262.334 3.507 20 5 CHBDRO CCC[C@H]([NH2+]CCCOC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000020198387 171062279 /nfs/dbraw/zinc/06/22/79/171062279.db2.gz SEJKYGMIRLVAKZ-INIZCTEOSA-N 1 0 294.395 3.841 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000035053172 171953757 /nfs/dbraw/zinc/95/37/57/171953757.db2.gz LKAOFDSXBNWNJF-KRWDZBQOSA-N 1 0 282.343 3.836 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCCc3occc32)cc1[N+](=O)[O-] ZINC000035273639 172094393 /nfs/dbraw/zinc/09/43/93/172094393.db2.gz DDVHOFOCGQHIBL-AWEZNQCLSA-N 1 0 286.331 3.663 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCC(C)C)cc1[N+](=O)[O-] ZINC000038093519 174107554 /nfs/dbraw/zinc/10/75/54/174107554.db2.gz HXZHCMNZBOSOKS-CYBMUJFWSA-N 1 0 264.369 3.990 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000417944637 227381806 /nfs/dbraw/zinc/38/18/06/227381806.db2.gz QGZDHAMZWDPDOD-IRXDYDNUSA-N 1 0 296.370 3.531 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC=CCC1)CCC2 ZINC000193001780 227417616 /nfs/dbraw/zinc/41/76/16/227417616.db2.gz QTMGCCBTYAMDRH-BBRMVZONSA-N 1 0 272.348 3.671 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000037177084 260073011 /nfs/dbraw/zinc/07/30/11/260073011.db2.gz XILDLRVBJSVJET-PXAZEXFGSA-N 1 0 282.343 3.933 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000222503937 260223314 /nfs/dbraw/zinc/22/33/14/260223314.db2.gz SZCGAHQZXRTWFN-BZPMIXESSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H]1CCC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C1 ZINC000085064651 260370054 /nfs/dbraw/zinc/37/00/54/260370054.db2.gz KJUKOJUBVQURJW-JQWIXIFHSA-N 1 0 268.382 3.715 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000128507707 260376079 /nfs/dbraw/zinc/37/60/79/260376079.db2.gz OEJHSVQCNOBEHI-MRXNPFEDSA-N 1 0 285.347 3.539 20 5 CHBDRO CC[C@@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000409454255 260410154 /nfs/dbraw/zinc/41/01/54/260410154.db2.gz AKTPYPVOUYXTKH-LLVKDONJSA-N 1 0 274.320 3.743 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)c(C)o1 ZINC000044729509 260648090 /nfs/dbraw/zinc/64/80/90/260648090.db2.gz ASVSTYUGISKSSC-NSHDSACASA-N 1 0 274.320 3.655 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1ccccn1 ZINC000152366635 261063553 /nfs/dbraw/zinc/06/35/53/261063553.db2.gz GPIOEYGOWKVQQX-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)c2cccnc2)cccc1[N+](=O)[O-] ZINC000158518818 261166552 /nfs/dbraw/zinc/16/65/52/261166552.db2.gz YPXAFGPBMXKADJ-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)c2cccnc2)cccc1[N+](=O)[O-] ZINC000158518548 261166699 /nfs/dbraw/zinc/16/66/99/261166699.db2.gz YPXAFGPBMXKADJ-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000019981538 262210043 /nfs/dbraw/zinc/21/00/43/262210043.db2.gz LYYPYCLMZKZCLM-TYNCELHUSA-N 1 0 262.353 3.824 20 5 CHBDRO CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000189484159 264302551 /nfs/dbraw/zinc/30/25/51/264302551.db2.gz GFAXIZYSWAETHL-UKRRQHHQSA-N 1 0 294.420 3.749 20 5 CHBDRO CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000189484124 264302786 /nfs/dbraw/zinc/30/27/86/264302786.db2.gz GFAXIZYSWAETHL-DZGCQCFKSA-N 1 0 294.420 3.749 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(F)cc(F)c1 ZINC000094826955 265260147 /nfs/dbraw/zinc/26/01/47/265260147.db2.gz HQIDPAJRGKQIJN-JTQLQIEISA-N 1 0 292.285 3.724 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000357022467 266232998 /nfs/dbraw/zinc/23/29/98/266232998.db2.gz JUVWEABDGAAESX-ZDUSSCGKSA-N 1 0 274.364 3.607 20 5 CHBDRO CC(C)[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000359376202 266572768 /nfs/dbraw/zinc/57/27/68/266572768.db2.gz VBHFJKHJEXZIIE-QGZVFWFLSA-N 1 0 299.374 3.519 20 5 CHBDRO Cc1cc(NCCC(F)(F)F)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000228485675 327921163 /nfs/dbraw/zinc/92/11/63/327921163.db2.gz ZHFKXLZOZIPICF-UHFFFAOYSA-N 1 0 299.252 3.816 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000531562284 328017939 /nfs/dbraw/zinc/01/79/39/328017939.db2.gz KNYUGZYLZAECHD-ZDUSSCGKSA-N 1 0 262.353 3.607 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)c2ccccc2F)cccc1[N+](=O)[O-] ZINC000048335023 328053203 /nfs/dbraw/zinc/05/32/03/328053203.db2.gz FELYBNHHUAWHCR-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1cccnc1CCC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296627541 328291461 /nfs/dbraw/zinc/29/14/61/328291461.db2.gz XGNCXTBTEBNYNP-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO CCC1CCC([N@H+](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000514094489 328302955 /nfs/dbraw/zinc/30/29/55/328302955.db2.gz NKSYFPPRIPIYDI-UHFFFAOYSA-N 1 0 276.380 3.995 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000048557150 328314814 /nfs/dbraw/zinc/31/48/14/328314814.db2.gz LVHVYUFTNIPTGX-LBPRGKRZSA-N 1 0 290.388 3.686 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000049529160 328367654 /nfs/dbraw/zinc/36/76/54/328367654.db2.gz FSCMEKYPUPQGCK-GFCCVEGCSA-N 1 0 276.361 3.897 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000051634366 328626352 /nfs/dbraw/zinc/62/63/52/328626352.db2.gz NWHHXKPBASGHCD-RYUDHWBXSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000037770945 326861043 /nfs/dbraw/zinc/86/10/43/326861043.db2.gz JGFWULIGRZJXQI-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000398232963 326875910 /nfs/dbraw/zinc/87/59/10/326875910.db2.gz UIYDYZJXNVOUHE-VXGBXAGGSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc(C[NH2+]CC(C)(C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000558680855 327113605 /nfs/dbraw/zinc/11/36/05/327113605.db2.gz WDCNCWZPLHNEBB-UHFFFAOYSA-N 1 0 290.285 3.581 20 5 CHBDRO Cc1ccccc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558738967 327118204 /nfs/dbraw/zinc/11/82/04/327118204.db2.gz AJXFZPDKGUKBPA-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO CCC(CC)C[N@H+](CC)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000559066833 327139516 /nfs/dbraw/zinc/13/95/16/327139516.db2.gz BROKACYVLRAZBB-UHFFFAOYSA-N 1 0 294.395 3.862 20 5 CHBDRO C[C@@H](F)CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000559332848 327160921 /nfs/dbraw/zinc/16/09/21/327160921.db2.gz UDRXYHRYNWLLFE-LLVKDONJSA-N 1 0 292.310 3.693 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000559418268 327244504 /nfs/dbraw/zinc/24/45/04/327244504.db2.gz PQXHUHAVCRLIRI-OCCSQVGLSA-N 1 0 274.364 3.778 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCC2(F)CCC2)cc1[N+](=O)[O-] ZINC000562061662 327444205 /nfs/dbraw/zinc/44/42/05/327444205.db2.gz DEICOBQZCHVEBM-LBPRGKRZSA-N 1 0 280.343 3.836 20 5 CHBDRO CSC1(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000193809255 329063165 /nfs/dbraw/zinc/06/31/65/329063165.db2.gz OXEQAYMNVVBOGC-LBPRGKRZSA-N 1 0 294.420 3.840 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCO1 ZINC000181743262 329236337 /nfs/dbraw/zinc/23/63/37/329236337.db2.gz JSHPTOIXFZQDJX-XHSDSOJGSA-N 1 0 292.379 3.593 20 5 CHBDRO CC(F)(F)CCC[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000583092904 329314767 /nfs/dbraw/zinc/31/47/67/329314767.db2.gz BEUFYKFRSHCJBR-LBPRGKRZSA-N 1 0 284.306 3.607 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCCC23CCCC3)cc1 ZINC000392828652 329388409 /nfs/dbraw/zinc/38/84/09/329388409.db2.gz DPLVQXPNXVSQBO-MRXNPFEDSA-N 1 0 288.391 3.840 20 5 CHBDRO CCC[C@H](CC)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000564124778 329697593 /nfs/dbraw/zinc/69/75/93/329697593.db2.gz QWRONPFWZOPWSX-ZDUSSCGKSA-N 1 0 289.379 3.787 20 5 CHBDRO CC[C@H](C)C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000421387302 329819459 /nfs/dbraw/zinc/81/94/59/329819459.db2.gz SJMNZBSDYBHHJV-OEMOTLHWSA-N 1 0 262.353 3.634 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C[C@H]1C ZINC000251966691 329937200 /nfs/dbraw/zinc/93/72/00/329937200.db2.gz XYATZFKNFFDMML-CKYFFXLPSA-N 1 0 268.382 3.571 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc(C)n1 ZINC000421883783 330102678 /nfs/dbraw/zinc/10/26/78/330102678.db2.gz QIHBJCXLNKADED-CQSZACIVSA-N 1 0 299.374 3.766 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000536831567 330229324 /nfs/dbraw/zinc/22/93/24/330229324.db2.gz GBEMVDYMRZPOKD-CRWXNKLISA-N 1 0 292.379 3.510 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000396933640 330231601 /nfs/dbraw/zinc/23/16/01/330231601.db2.gz BWIWFHUHNHVNAT-VHSXEESVSA-N 1 0 290.285 3.834 20 5 CHBDRO CC1(C)C[C@H]1C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000536865793 330253704 /nfs/dbraw/zinc/25/37/04/330253704.db2.gz WUPLNNZSQQFHGF-LSDHHAIUSA-N 1 0 288.391 3.552 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC(F)(F)F ZINC000536879738 330318078 /nfs/dbraw/zinc/31/80/78/330318078.db2.gz ZPYLAWYPSSTOSW-VIFPVBQESA-N 1 0 276.258 3.506 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1ccc([N+](=O)[O-])cc1C ZINC000036950028 330321837 /nfs/dbraw/zinc/32/18/37/330321837.db2.gz FYCQCDARNNSXHN-AWEZNQCLSA-N 1 0 293.411 3.826 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)cc1[N+](=O)[O-] ZINC000424203855 330327083 /nfs/dbraw/zinc/32/70/83/330327083.db2.gz LGUSOULIWSNVFT-BTTYYORXSA-N 1 0 274.364 3.606 20 5 CHBDRO CC(C)(C)CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000536882174 330360979 /nfs/dbraw/zinc/36/09/79/330360979.db2.gz KCAPHFMNHZVQHC-OAHLLOKOSA-N 1 0 290.407 3.942 20 5 CHBDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000121988981 330410637 /nfs/dbraw/zinc/41/06/37/330410637.db2.gz IICBFLLBLDOIKE-STQMWFEESA-N 1 0 294.395 3.757 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC12CCCC2 ZINC000429434233 330546504 /nfs/dbraw/zinc/54/65/04/330546504.db2.gz HHKSZFVDRIMRIB-BBRMVZONSA-N 1 0 288.391 3.838 20 5 CHBDRO CC(C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433137172 330617961 /nfs/dbraw/zinc/61/79/61/330617961.db2.gz SDCVAYGLZQFKQO-CQSZACIVSA-N 1 0 262.353 3.563 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC13CCCC3)CCC2 ZINC000447599010 330873000 /nfs/dbraw/zinc/87/30/00/330873000.db2.gz IODNHCUPKCBYCP-HZPDHXFCSA-N 1 0 286.375 3.895 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000162481729 330919201 /nfs/dbraw/zinc/91/92/01/330919201.db2.gz MXHCGDFPCLENPZ-NEPJUHHUSA-N 1 0 262.353 3.824 20 5 CHBDRO CSCCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451542893 331033166 /nfs/dbraw/zinc/03/31/66/331033166.db2.gz AQJKKBSAYBWYKK-CQSZACIVSA-N 1 0 294.420 3.527 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000453368792 331123558 /nfs/dbraw/zinc/12/35/58/331123558.db2.gz PIQDTMBIKAOUFC-UGFHNGPFSA-N 1 0 274.364 3.600 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1(C2CCC2)CCC1 ZINC000459750575 331298309 /nfs/dbraw/zinc/29/83/09/331298309.db2.gz PZXVTRNKKSWGDG-QPJJXVBHSA-N 1 0 286.375 3.920 20 5 CHBDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000464743415 331365750 /nfs/dbraw/zinc/36/57/50/331365750.db2.gz YJGBKONLDFYXLW-DZGCQCFKSA-N 1 0 276.380 3.995 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC=CCC1 ZINC000468650540 331438359 /nfs/dbraw/zinc/43/83/59/331438359.db2.gz YUBCSTGZFDHHMP-YVGNARHYSA-N 1 0 286.375 3.944 20 5 CHBDRO C[C@@H](CCC1CC1)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000469127628 331446215 /nfs/dbraw/zinc/44/62/15/331446215.db2.gz YVCSGALHNQZPNH-AGLBCWCQSA-N 1 0 274.364 3.776 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@H]2CCCF)cc1 ZINC000510731210 332913992 /nfs/dbraw/zinc/91/39/92/332913992.db2.gz HRIRZFDSTXBPGZ-GOEBONIOSA-N 1 0 294.370 3.645 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC1(C)CC1 ZINC000475189838 331617210 /nfs/dbraw/zinc/61/72/10/331617210.db2.gz ICNFJBRMPHRKRE-RAXLEYEMSA-N 1 0 274.364 3.778 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000481182429 331800268 /nfs/dbraw/zinc/80/02/68/331800268.db2.gz PRGNZDWJGFVDNT-OAHLLOKOSA-N 1 0 292.379 3.532 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H](C)C(C)C)cccc1[N+](=O)[O-] ZINC000484183355 331894495 /nfs/dbraw/zinc/89/44/95/331894495.db2.gz ZVAPDWYKELRFHE-AAEUAGOBSA-N 1 0 264.369 3.846 20 5 CHBDRO Cc1c(C[NH2+]Cc2ccc3occc3c2)cccc1[N+](=O)[O-] ZINC000511763732 332941736 /nfs/dbraw/zinc/94/17/36/332941736.db2.gz UNWNVNPWWXZXBS-UHFFFAOYSA-N 1 0 296.326 3.939 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H]1C ZINC000490067357 332079919 /nfs/dbraw/zinc/07/99/19/332079919.db2.gz MGHMCNSXHMFOMY-WXHSDQCUSA-N 1 0 262.353 3.695 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490087506 332080950 /nfs/dbraw/zinc/08/09/50/332080950.db2.gz JETSUOFGPUVACL-ZDUSSCGKSA-N 1 0 292.379 3.616 20 5 CHBDRO CCOc1cc(C[NH2+][C@H]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000491813154 332365020 /nfs/dbraw/zinc/36/50/20/332365020.db2.gz LTCHXTHXRLNUHK-JSGCOSHPSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000492400788 332395595 /nfs/dbraw/zinc/39/55/95/332395595.db2.gz TXAQPYVQFNYNHU-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000494483942 332475428 /nfs/dbraw/zinc/47/54/28/332475428.db2.gz OYFDXFKDOPVVRH-JGGQBBKZSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000495440168 332519028 /nfs/dbraw/zinc/51/90/28/332519028.db2.gz PNPGOUSHQQXXTA-WDEREUQCSA-N 1 0 284.787 3.815 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCC[C@H]1OC)c1cccc([N+](=O)[O-])c1 ZINC000251135938 334356943 /nfs/dbraw/zinc/35/69/43/334356943.db2.gz KIERCRVRXGXKPN-ARFHVFGLSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+]CCOC(C)(C)CC)c1cccc([N+](=O)[O-])c1 ZINC000308541920 333034742 /nfs/dbraw/zinc/03/47/42/333034742.db2.gz KJBLJZUVXCPGJC-HNNXBMFYSA-N 1 0 294.395 3.841 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC3(CCCC3)CC2)c1 ZINC000513726333 333035846 /nfs/dbraw/zinc/03/58/46/333035846.db2.gz YZTXZZLEOWWGIN-UHFFFAOYSA-N 1 0 274.364 3.751 20 5 CHBDRO CC1CC[NH+](CCSCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000513815453 333040932 /nfs/dbraw/zinc/04/09/32/333040932.db2.gz UOELOCYXVSYXQB-UHFFFAOYSA-N 1 0 294.420 3.560 20 5 CHBDRO CC[C@@H](C)C[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000088295552 333088026 /nfs/dbraw/zinc/08/80/26/333088026.db2.gz XXVPFXLBBSQMQH-NEPJUHHUSA-N 1 0 250.342 3.509 20 5 CHBDRO CC[N@H+](Cc1ccc(C)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000521222495 333115635 /nfs/dbraw/zinc/11/56/35/333115635.db2.gz CJSUMKLDHKBXPV-UHFFFAOYSA-N 1 0 284.359 3.925 20 5 CHBDRO C[C@H]([NH2+]Cc1cc(F)cc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000219148725 333142996 /nfs/dbraw/zinc/14/29/96/333142996.db2.gz YXEHXUVCPOXRNG-JTQLQIEISA-N 1 0 292.285 3.724 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000219148662 333142998 /nfs/dbraw/zinc/14/29/98/333142998.db2.gz YXEHXUVCPOXRNG-SNVBAGLBSA-N 1 0 292.285 3.724 20 5 CHBDRO COC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000186510621 333162362 /nfs/dbraw/zinc/16/23/62/333162362.db2.gz ONUHTDGLEHIQKQ-CYBMUJFWSA-N 1 0 292.379 3.595 20 5 CHBDRO CCOC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C(C)C ZINC000189360346 333190829 /nfs/dbraw/zinc/19/08/29/333190829.db2.gz DMDGBNPBCQNELJ-HIFRSBDPSA-N 1 0 294.395 3.615 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CCOC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000336894089 335122777 /nfs/dbraw/zinc/12/27/77/335122777.db2.gz LMKXCVYACRWSHX-CABCVRRESA-N 1 0 292.379 3.593 20 5 CHBDRO COc1ccc(C[NH2+]C[C@@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000223449258 333208090 /nfs/dbraw/zinc/20/80/90/333208090.db2.gz SZGMZCULASPXBA-QWHCGFSZSA-N 1 0 292.379 3.519 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCS[C@@H](C)CC1 ZINC000192181663 333231792 /nfs/dbraw/zinc/23/17/92/333231792.db2.gz JXUUGIIWKZZXEB-QWHCGFSZSA-N 1 0 294.420 3.792 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCS[C@@H](C)CC1 ZINC000192181670 333231947 /nfs/dbraw/zinc/23/19/47/333231947.db2.gz JXUUGIIWKZZXEB-STQMWFEESA-N 1 0 294.420 3.792 20 5 CHBDRO C[N@H+](Cc1cc2ccccc2o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000195676236 333260522 /nfs/dbraw/zinc/26/05/22/333260522.db2.gz NGVOLMOMWCXACW-UHFFFAOYSA-N 1 0 296.326 3.973 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522554081 333289774 /nfs/dbraw/zinc/28/97/74/333289774.db2.gz GLTNRTHBGSJTEJ-GFCCVEGCSA-N 1 0 268.744 3.623 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000230407422 333317581 /nfs/dbraw/zinc/31/75/81/333317581.db2.gz PPAJKYDFROFXBF-FRRDWIJNSA-N 1 0 262.353 3.682 20 5 CHBDRO CCC(C)(C)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000231775455 333329502 /nfs/dbraw/zinc/32/95/02/333329502.db2.gz ADXZHGQBLOVNRA-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000523552901 333332808 /nfs/dbraw/zinc/33/28/08/333332808.db2.gz BVIWSGFJBOYOAU-CQSZACIVSA-N 1 0 262.353 3.749 20 5 CHBDRO CCc1ccc(CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000524066457 333352907 /nfs/dbraw/zinc/35/29/07/333352907.db2.gz QYYCVDHGJLGOGX-UHFFFAOYSA-N 1 0 298.386 3.798 20 5 CHBDRO CC1=C[C@@H](C)C[C@H](C[NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000235670649 333371548 /nfs/dbraw/zinc/37/15/48/333371548.db2.gz SWRYJQAQEYPDIY-OCCSQVGLSA-N 1 0 274.364 3.677 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000397685863 333427295 /nfs/dbraw/zinc/42/72/95/333427295.db2.gz WRXRCWHJZJLEMB-FQLMCAECSA-N 1 0 274.364 3.824 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000397941642 333431020 /nfs/dbraw/zinc/43/10/20/333431020.db2.gz VAJDLQSAJUHFEL-JKOKRWQUSA-N 1 0 280.393 3.530 20 5 CHBDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000576021258 335142374 /nfs/dbraw/zinc/14/23/74/335142374.db2.gz WSYYFIBKHHIYAU-VEXXYJEVSA-N 1 0 274.364 3.871 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000037260419 333525964 /nfs/dbraw/zinc/52/59/64/333525964.db2.gz DOLRANKKZGZLRZ-NEPJUHHUSA-N 1 0 250.342 3.680 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCCC2CC2)cccc1[N+](=O)[O-] ZINC000537971589 333552549 /nfs/dbraw/zinc/55/25/49/333552549.db2.gz XUSHDAKCPAFARI-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO C[C@H]1Cc2ccccc2[C@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000539050525 333651789 /nfs/dbraw/zinc/65/17/89/333651789.db2.gz HXNAILAJEZAUGZ-UGSOOPFHSA-N 1 0 296.370 3.660 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(C)CCC1 ZINC000539120134 333659323 /nfs/dbraw/zinc/65/93/23/333659323.db2.gz KQESBAWPAPXJPX-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO CCC1(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000539121561 333659450 /nfs/dbraw/zinc/65/94/50/333659450.db2.gz WBPBQKBDBQBBED-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO COc1ccc(C[NH2+][C@H](C)CCC(C)C)cc1[N+](=O)[O-] ZINC000069051803 333750709 /nfs/dbraw/zinc/75/07/09/333750709.db2.gz VWILNGRYRBCXMZ-GFCCVEGCSA-N 1 0 280.368 3.518 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000129469692 333767510 /nfs/dbraw/zinc/76/75/10/333767510.db2.gz KRRXVKMXHRNBSN-AAEUAGOBSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000541643976 333785595 /nfs/dbraw/zinc/78/55/95/333785595.db2.gz AXSHVNAQQLQZBD-UHFFFAOYSA-N 1 0 290.388 3.724 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC2CCSCC2)cc1[N+](=O)[O-] ZINC000131162926 333906213 /nfs/dbraw/zinc/90/62/13/333906213.db2.gz PBPRXYHTIAHMLR-GFCCVEGCSA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000135167444 334118539 /nfs/dbraw/zinc/11/85/39/334118539.db2.gz HQADFRKYIOIZQK-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)s1 ZINC000078003603 334120144 /nfs/dbraw/zinc/12/01/44/334120144.db2.gz LLAJAULQBKDRLS-LLVKDONJSA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCC(C)(C)O1 ZINC000547980612 334133184 /nfs/dbraw/zinc/13/31/84/334133184.db2.gz AUFKRYWJJHATJZ-GXTWGEPZSA-N 1 0 292.379 3.511 20 5 CHBDRO CC(C)[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC1CC1 ZINC000548623251 334164132 /nfs/dbraw/zinc/16/41/32/334164132.db2.gz LDHHLJRCDRTKSB-UHFFFAOYSA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000081045974 334177363 /nfs/dbraw/zinc/17/73/63/334177363.db2.gz XUTODIQKGJXKIH-CHWSQXEVSA-N 1 0 264.369 3.846 20 5 CHBDRO Cc1ccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)s1 ZINC000549407662 334193019 /nfs/dbraw/zinc/19/30/19/334193019.db2.gz HTYWQBHQDZJRPM-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO CS[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000245472142 334195886 /nfs/dbraw/zinc/19/58/86/334195886.db2.gz YRMWAIWOEKDXGC-OSAQELSMSA-N 1 0 294.420 3.920 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCC[C@@H](C3CC3)C2)cc1 ZINC000081637100 334201431 /nfs/dbraw/zinc/20/14/31/334201431.db2.gz QZCVCWNNVLODHL-CVEARBPZSA-N 1 0 288.391 3.696 20 5 CHBDRO Cc1ccc(C[NH2+]C2CC(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000549859429 334206949 /nfs/dbraw/zinc/20/69/49/334206949.db2.gz QHQGNCCXAKQVCS-UHFFFAOYSA-N 1 0 276.380 3.818 20 5 CHBDRO CC1(C)C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000550442916 334222522 /nfs/dbraw/zinc/22/25/22/334222522.db2.gz BTUXODZBHCEPIJ-HZPDHXFCSA-N 1 0 288.391 3.648 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000251555221 334363945 /nfs/dbraw/zinc/36/39/45/334363945.db2.gz ACBYBWTZGRROQS-VIKVFOODSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000252170658 334375779 /nfs/dbraw/zinc/37/57/79/334375779.db2.gz NWHHXKPBASGHCD-JYAVWHMHSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCSC(C)C ZINC000554377536 334427250 /nfs/dbraw/zinc/42/72/50/334427250.db2.gz OSAQXNFWPAYVHV-LBPRGKRZSA-N 1 0 282.409 3.695 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCCC(F)(F)F ZINC000566475973 334651525 /nfs/dbraw/zinc/65/15/25/334651525.db2.gz RKHYHSHTLPUWSV-LLVKDONJSA-N 1 0 288.269 3.514 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccc(C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000268802051 334716579 /nfs/dbraw/zinc/71/65/79/334716579.db2.gz YZARDIFNRUQYHU-KRWDZBQOSA-N 1 0 299.374 3.929 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000385820714 336157569 /nfs/dbraw/zinc/15/75/69/336157569.db2.gz QUERQLQXVGSQLF-MLGOLLRUSA-N 1 0 282.343 3.933 20 5 CHBDRO CCC[C@@H]([NH2+]CC(C)(C)OCC)c1cccc([N+](=O)[O-])c1 ZINC000159271625 520770380 /nfs/dbraw/zinc/77/03/80/520770380.db2.gz JILGOSIWSNZZSD-OAHLLOKOSA-N 1 0 294.395 3.841 20 5 CHBDRO CC[C@H]([NH2+]Cc1cnc(C)s1)c1cccc([N+](=O)[O-])c1 ZINC000040997587 522663211 /nfs/dbraw/zinc/66/32/11/522663211.db2.gz XUJFVGKENVWHLF-AWEZNQCLSA-N 1 0 291.376 3.601 20 5 CHBDRO CC[C@H]([NH2+][C@@H](CC)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000161629940 522705982 /nfs/dbraw/zinc/70/59/82/522705982.db2.gz SHRQPRHNBRZOMX-GJZGRUSLSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1cc(C)cc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000050015655 524382495 /nfs/dbraw/zinc/38/24/95/524382495.db2.gz ZLFMQMUPDIAARZ-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000157952172 525387467 /nfs/dbraw/zinc/38/74/67/525387467.db2.gz IRVQWNZZCGLHFL-FZMZJTMJSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccsc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000094259803 525861075 /nfs/dbraw/zinc/86/10/75/525861075.db2.gz OODLMHMASBNTNE-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2CCSCC2)cccc1[N+](=O)[O-] ZINC000268925613 525894091 /nfs/dbraw/zinc/89/40/91/525894091.db2.gz XXGOBHIOECGDMU-GFCCVEGCSA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289687888 526078856 /nfs/dbraw/zinc/07/88/56/526078856.db2.gz GUMNJFRGMQRDEA-MNOVXSKESA-N 1 0 284.306 3.633 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccncc1 ZINC000347376667 527500011 /nfs/dbraw/zinc/50/00/11/527500011.db2.gz OKFPIONJGQNEHD-UVTDQMKNSA-N 1 0 297.358 3.525 20 5 CHBDRO CCCCC[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000036721074 1117745406 /nfs/dbraw/zinc/74/54/06/1117745406.db2.gz STAXNHLCHLKXKS-AWEZNQCLSA-N 1 0 250.342 3.826 20 5 CHBDRO CC1(C)CC([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000395168163 1118684403 /nfs/dbraw/zinc/68/44/03/1118684403.db2.gz FDFQNJBBKUNJGH-UHFFFAOYSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H]1CC([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000084461662 1118944993 /nfs/dbraw/zinc/94/49/93/1118944993.db2.gz AILBVVIWPIADDP-RYUDHWBXSA-N 1 0 262.353 3.509 20 5 CHBDRO CCC(C)(CC)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000227217672 1120688034 /nfs/dbraw/zinc/68/80/34/1120688034.db2.gz JCYQPKUBLSWUPI-UHFFFAOYSA-N 1 0 270.760 3.917 20 5 CHBDRO CCC[C@H](OCCC[N+](C)(C)C)c1ccccc1 ZINC001224620687 1135462371 /nfs/dbraw/zinc/46/23/71/1135462371.db2.gz AQPDNANJOMYCSX-INIZCTEOSA-N 1 0 250.406 3.641 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1C[C@@H]1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000348315656 1125538367 /nfs/dbraw/zinc/53/83/67/1125538367.db2.gz UQKIQQFMJQFBOM-AVGNSLFASA-N 1 0 284.306 3.679 20 5 CHBDRO C[C@]1(c2ccccc2)CCC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886318077 1125668137 /nfs/dbraw/zinc/66/81/37/1125668137.db2.gz IXJYHLAWUQDRQY-QGZVFWFLSA-N 1 0 297.358 3.501 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CC2)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000886825588 1125721655 /nfs/dbraw/zinc/72/16/55/1125721655.db2.gz XWBAHSFEFJKQCH-LLVKDONJSA-N 1 0 260.337 3.578 20 5 CHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(N)c1 ZINC000261649899 1125735272 /nfs/dbraw/zinc/73/52/72/1125735272.db2.gz HMNALDKEKSYYTH-UHFFFAOYSA-N 1 0 299.374 3.588 20 5 CHBDRO CC1=C(c2ccco2)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000338338163 1126735042 /nfs/dbraw/zinc/73/50/42/1126735042.db2.gz AVXLJQLSLXZMOX-UHFFFAOYSA-N 1 0 298.342 3.867 20 5 CHBDRO CC[N@H+](CC1CCC1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000483131825 1126769549 /nfs/dbraw/zinc/76/95/49/1126769549.db2.gz RZXQNUSINSFEIT-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO CCCC[N@H+](CC)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000485143557 1126889981 /nfs/dbraw/zinc/88/99/81/1126889981.db2.gz JKDDKSCGSQYZIE-GFCCVEGCSA-N 1 0 250.342 3.778 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000037176961 1126923567 /nfs/dbraw/zinc/92/35/67/1126923567.db2.gz SGPQDAVPYKVPGN-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc(N(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000266872754 1126989008 /nfs/dbraw/zinc/98/90/08/1126989008.db2.gz NLYRZICWBWTLBV-CYBMUJFWSA-N 1 0 299.374 3.512 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)c1cccnc1 ZINC000270623883 1127058733 /nfs/dbraw/zinc/05/87/33/1127058733.db2.gz DVDUEKRRFSXHGT-CYBMUJFWSA-N 1 0 285.347 3.573 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000042861620 1127080784 /nfs/dbraw/zinc/08/07/84/1127080784.db2.gz JEMHWUYXRLTGOL-UKRRQHHQSA-N 1 0 276.380 3.553 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC000348539828 1127121568 /nfs/dbraw/zinc/12/15/68/1127121568.db2.gz BMDKVOMQNNJMOF-MRXNPFEDSA-N 1 0 268.316 3.542 20 5 CHBDRO CCC(CC)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000151293255 1127130041 /nfs/dbraw/zinc/13/00/41/1127130041.db2.gz JLVHEYXMFUKAQY-LLVKDONJSA-N 1 0 250.342 3.742 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000054993497 1127146905 /nfs/dbraw/zinc/14/69/05/1127146905.db2.gz SBRFAEADJJJXDL-INIZCTEOSA-N 1 0 282.343 3.932 20 5 CHBDRO CC(C)=CCC[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000570941829 1127149846 /nfs/dbraw/zinc/14/98/46/1127149846.db2.gz PWNSSCQXPURLJP-CQSZACIVSA-N 1 0 260.337 3.528 20 5 CHBDRO Cc1ccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000571807023 1127178612 /nfs/dbraw/zinc/17/86/12/1127178612.db2.gz VPGAROZHPYLZQZ-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000588978209 1127209460 /nfs/dbraw/zinc/20/94/60/1127209460.db2.gz PWHWELTWPIZTBN-GFCCVEGCSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000589209373 1127216310 /nfs/dbraw/zinc/21/63/10/1127216310.db2.gz IZSDTPAKBZIXLF-HNNXBMFYSA-N 1 0 274.364 3.525 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000572780343 1127226329 /nfs/dbraw/zinc/22/63/29/1127226329.db2.gz HUENQAGAWRSYEL-GXFFZTMASA-N 1 0 296.317 3.607 20 5 CHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353896223 1127276712 /nfs/dbraw/zinc/27/67/12/1127276712.db2.gz HBRMQERBLZRUJP-LBPRGKRZSA-N 1 0 268.382 3.667 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC2(CCC2)C1 ZINC000355207102 1127325105 /nfs/dbraw/zinc/32/51/05/1127325105.db2.gz XKLDGAAQFHYDBY-UHFFFAOYSA-N 1 0 274.364 3.669 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)CC(F)F ZINC000592373101 1127343913 /nfs/dbraw/zinc/34/39/13/1127343913.db2.gz UBWAUBABKISEDW-HUMZTAOYSA-N 1 0 298.333 3.879 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CC(F)F ZINC000592392130 1127344439 /nfs/dbraw/zinc/34/44/39/1127344439.db2.gz BIOXHUYRPITUJM-UWVGGRQHSA-N 1 0 272.295 3.537 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)F ZINC000592392350 1127344520 /nfs/dbraw/zinc/34/45/20/1127344520.db2.gz MQDJFYDQYSLIGL-NXEZZACHSA-N 1 0 272.295 3.537 20 5 CHBDRO CC(C)C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000592387488 1127345846 /nfs/dbraw/zinc/34/58/46/1127345846.db2.gz LOWZMPCRICUAON-KRWDZBQOSA-N 1 0 299.374 3.867 20 5 CHBDRO CC(C)O[C@@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000593056119 1127369970 /nfs/dbraw/zinc/36/99/70/1127369970.db2.gz YHKSOAUMOWQJOS-UONOGXRCSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@@H]([NH2+][C@H]1C[C@@H](OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000592398754 1127372629 /nfs/dbraw/zinc/37/26/29/1127372629.db2.gz SQVMXNDGRYLBFK-KYOSRNDESA-N 1 0 292.379 3.592 20 5 CHBDRO C[C@@H]([NH2+]CC1CCC(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000592399010 1127372838 /nfs/dbraw/zinc/37/28/38/1127372838.db2.gz LLRCKGCUPAKAIY-LKSINWNRSA-N 1 0 280.343 3.774 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CCCCO1 ZINC000594521284 1127421535 /nfs/dbraw/zinc/42/15/35/1127421535.db2.gz TVYHBQOUYUOKSA-VBNZEHGJSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000358373380 1127418185 /nfs/dbraw/zinc/41/81/85/1127418185.db2.gz DGCNGKKPKULYIL-YVEFUNNKSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)SC1)c1cccc([N+](=O)[O-])c1 ZINC000594503200 1127418903 /nfs/dbraw/zinc/41/89/03/1127418903.db2.gz GRTDYOPTBACICH-NQBHXWOUSA-N 1 0 280.393 3.530 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000594732234 1127429920 /nfs/dbraw/zinc/42/99/20/1127429920.db2.gz VOAVOQVSUWOVPH-AEIGPULVSA-N 1 0 274.364 3.682 20 5 CHBDRO CC([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])(C1CC1)C1CC1 ZINC000594992097 1127444391 /nfs/dbraw/zinc/44/43/91/1127444391.db2.gz AUZYSPHPQPAVFD-XQRVVYSFSA-N 1 0 286.375 3.776 20 5 CHBDRO CC(C)[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000594994974 1127444487 /nfs/dbraw/zinc/44/44/87/1127444487.db2.gz YLYXBMPMQCZTEJ-BIENSFFJSA-N 1 0 274.364 3.632 20 5 CHBDRO CCOC1CCC([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595004570 1127444954 /nfs/dbraw/zinc/44/49/54/1127444954.db2.gz BRAYALOHRLYYOU-XEBKBJJBSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCSCC2)cc1[N+](=O)[O-] ZINC000595027536 1127448752 /nfs/dbraw/zinc/44/87/52/1127448752.db2.gz PNISPOWXJUGBBX-GXTWGEPZSA-N 1 0 294.420 3.840 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CC12CCCC2 ZINC000595044178 1127450724 /nfs/dbraw/zinc/45/07/24/1127450724.db2.gz LTODJTALJWHWNK-IAQYHMDHSA-N 1 0 290.363 3.587 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)C(C)(C)C ZINC000595048640 1127451077 /nfs/dbraw/zinc/45/10/77/1127451077.db2.gz XJWYDTGFQZDQPE-WDEREUQCSA-N 1 0 280.368 3.689 20 5 CHBDRO CCSC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000595100215 1127452485 /nfs/dbraw/zinc/45/24/85/1127452485.db2.gz PKUBERYGTUZQNA-GFCCVEGCSA-N 1 0 294.420 3.840 20 5 CHBDRO CC(C)(F)CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000595084042 1127453481 /nfs/dbraw/zinc/45/34/81/1127453481.db2.gz IKNNDCAVVHCRBE-AWEZNQCLSA-N 1 0 280.343 3.700 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000595079219 1127453567 /nfs/dbraw/zinc/45/35/67/1127453567.db2.gz ISFOJQMTXBDOAW-GWCFXTLKSA-N 1 0 284.306 3.599 20 5 CHBDRO C[C@@]1(CC[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1(F)F ZINC000595081651 1127453569 /nfs/dbraw/zinc/45/35/69/1127453569.db2.gz TXSSTPFPXLNOHR-TZMCWYRMSA-N 1 0 296.317 3.607 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000595078833 1127453684 /nfs/dbraw/zinc/45/36/84/1127453684.db2.gz BGIHOLBBEHFYNR-RISCZKNCSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(C)F ZINC000595088340 1127454309 /nfs/dbraw/zinc/45/43/09/1127454309.db2.gz PLMZZMLGXWLOHT-GFCCVEGCSA-N 1 0 282.359 3.644 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000595093888 1127454634 /nfs/dbraw/zinc/45/46/34/1127454634.db2.gz PTFQHGBLAGMESF-SKDRFNHKSA-N 1 0 284.306 3.537 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)cccc1[N+](=O)[O-] ZINC000595095011 1127455518 /nfs/dbraw/zinc/45/55/18/1127455518.db2.gz SVBTUVWBWKMKNN-GWCFXTLKSA-N 1 0 298.333 3.845 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)cc1[N+](=O)[O-] ZINC000595419271 1127462331 /nfs/dbraw/zinc/46/23/31/1127462331.db2.gz JNCMSZDTJFNWMA-VIRABCJISA-N 1 0 274.364 3.600 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595562815 1127465639 /nfs/dbraw/zinc/46/56/39/1127465639.db2.gz RCDXIWCSHGBELC-ZLDLUXBVSA-N 1 0 260.337 3.530 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2ccco2)CC1 ZINC000595613653 1127470434 /nfs/dbraw/zinc/47/04/34/1127470434.db2.gz CUYZGVDVKWMRRZ-UHFFFAOYSA-N 1 0 286.331 3.567 20 5 CHBDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000595641304 1127471095 /nfs/dbraw/zinc/47/10/95/1127471095.db2.gz IKJKONGZJKDSCL-LLVKDONJSA-N 1 0 280.368 3.518 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)C2CCC(F)CC2)cccc1[N+](=O)[O-] ZINC000595819397 1127475999 /nfs/dbraw/zinc/47/59/99/1127475999.db2.gz PBEFAZINCJJGCM-OPFPJEHXSA-N 1 0 294.370 3.910 20 5 CHBDRO COCC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000060806048 1127587620 /nfs/dbraw/zinc/58/76/20/1127587620.db2.gz FUUPUJNCIQJAKK-UHFFFAOYSA-N 1 0 265.356 3.729 20 5 CHBDRO CC1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCCC1 ZINC000602503527 1127588168 /nfs/dbraw/zinc/58/81/68/1127588168.db2.gz PWDGPEDUDHOIBE-UHFFFAOYSA-N 1 0 289.335 3.548 20 5 CHBDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000362187306 1127617831 /nfs/dbraw/zinc/61/78/31/1127617831.db2.gz DBZJOXICYSYMHD-PWSUYJOCSA-N 1 0 296.342 3.505 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC[C@@H]1CC1(F)F)CCC2 ZINC000598680349 1127631864 /nfs/dbraw/zinc/63/18/64/1127631864.db2.gz XQAGTHYPLMWPCZ-BXUZGUMPSA-N 1 0 296.317 3.607 20 5 CHBDRO Cc1ccc(F)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000295592112 1127647597 /nfs/dbraw/zinc/64/75/97/1127647597.db2.gz CDEALVQPPGNKCU-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CCC([NH2+]Cc1cccc([N+](=O)[O-])c1)(C1CC1)C1CC1 ZINC000598986853 1127647980 /nfs/dbraw/zinc/64/79/80/1127647980.db2.gz FHYOXMPHTKOKGD-UHFFFAOYSA-N 1 0 274.364 3.653 20 5 CHBDRO CC1(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C[C@H]2C[C@H]2C1 ZINC000599004788 1127650105 /nfs/dbraw/zinc/65/01/05/1127650105.db2.gz GEINPVYXCJNPDO-HUMHNDBMSA-N 1 0 286.375 3.634 20 5 CHBDRO CCC[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)OCC ZINC000599057958 1127653766 /nfs/dbraw/zinc/65/37/66/1127653766.db2.gz DGHSZYKQCUJJSX-ZIAGYGMSSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCCC12CC2)c1ccc([N+](=O)[O-])cc1 ZINC000599089803 1127656527 /nfs/dbraw/zinc/65/65/27/1127656527.db2.gz ASZRUPLAYPYRRH-GXTWGEPZSA-N 1 0 274.364 3.826 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC2(CCC2)C1 ZINC000593695226 1127662267 /nfs/dbraw/zinc/66/22/67/1127662267.db2.gz YWAOMWMSCOYHIT-CYBMUJFWSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]12 ZINC000603662030 1127664892 /nfs/dbraw/zinc/66/48/92/1127664892.db2.gz BDADJFSWWDQPBG-XYPHTWIQSA-N 1 0 288.391 3.995 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](CC2CC(F)(F)C2)C2CC2)cc1 ZINC000296370071 1127670022 /nfs/dbraw/zinc/67/00/22/1127670022.db2.gz SQRZDSFZKXJFQP-UHFFFAOYSA-N 1 0 296.317 3.605 20 5 CHBDRO Cc1cccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000603859877 1127677535 /nfs/dbraw/zinc/67/75/35/1127677535.db2.gz GTJGIAFROMKBGI-UHFFFAOYSA-N 1 0 270.332 3.535 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC2(CC2)CC1 ZINC000599672170 1127685901 /nfs/dbraw/zinc/68/59/01/1127685901.db2.gz BUFYLUINZBTKNP-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000604013355 1127689677 /nfs/dbraw/zinc/68/96/77/1127689677.db2.gz DAQSCNJYDDESTC-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000035257018 1127907746 /nfs/dbraw/zinc/90/77/46/1127907746.db2.gz UZULXCZYUDWGHN-DZGCQCFKSA-N 1 0 262.353 3.653 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543857692 1127950303 /nfs/dbraw/zinc/95/03/03/1127950303.db2.gz HXIJQJCWCAQNGI-NSHDSACASA-N 1 0 268.744 3.623 20 5 CHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1ccoc1 ZINC000540184559 1127968207 /nfs/dbraw/zinc/96/82/07/1127968207.db2.gz RMGZCXIPUHBNAQ-CYBMUJFWSA-N 1 0 288.347 3.861 20 5 CHBDRO C[C@@H](c1ccco1)N(C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595296840 1127979326 /nfs/dbraw/zinc/97/93/26/1127979326.db2.gz MAIYXKJXOSHENV-JTQLQIEISA-N 1 0 278.283 3.520 20 5 CHBDRO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000595425139 1127994685 /nfs/dbraw/zinc/99/46/85/1127994685.db2.gz JYSAOMNXDQXOOK-LBPRGKRZSA-N 1 0 278.327 3.522 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC(C)(C)C1 ZINC000468392201 1128005492 /nfs/dbraw/zinc/00/54/92/1128005492.db2.gz JVDDAVFURBTCHA-CQSZACIVSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000545457228 1128016190 /nfs/dbraw/zinc/01/61/90/1128016190.db2.gz ASBWXMJKDXZDBK-GXSJLCMTSA-N 1 0 290.285 3.976 20 5 CHBDRO CCc1cccc(CN(C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000468855900 1128025123 /nfs/dbraw/zinc/02/51/23/1128025123.db2.gz GFHKEZBEGSTLBD-UHFFFAOYSA-N 1 0 284.359 3.789 20 5 CHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000541553684 1128027058 /nfs/dbraw/zinc/02/70/58/1128027058.db2.gz SRLLOJUMYOZPDA-USYSOWRXSA-N 1 0 286.375 3.896 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000541772602 1128039062 /nfs/dbraw/zinc/03/90/62/1128039062.db2.gz BNUUGQBKQSXYNM-QGZVFWFLSA-N 1 0 297.358 3.635 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]C(C1CC1)C1CC1 ZINC000541846359 1128040777 /nfs/dbraw/zinc/04/07/77/1128040777.db2.gz UZAOLKWITIVQEI-UHFFFAOYSA-N 1 0 294.782 3.569 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@]1(C)CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000094797513 1128056326 /nfs/dbraw/zinc/05/63/26/1128056326.db2.gz YECDNJZWJQUDMG-CVEARBPZSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000470170768 1128063628 /nfs/dbraw/zinc/06/36/28/1128063628.db2.gz ADDAQDMDIZXACR-UKTHLTGXSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000470207394 1128065868 /nfs/dbraw/zinc/06/58/68/1128065868.db2.gz VPJYJULEFUBZRM-BPTWVKRQSA-N 1 0 286.375 3.873 20 5 CHBDRO CCOc1cc(C[N@@H+]2CC[C@H](C)[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492816885 1128113600 /nfs/dbraw/zinc/11/36/00/1128113600.db2.gz JKZRDAPAURMGMC-JSGCOSHPSA-N 1 0 292.379 3.614 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@H](C)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492788327 1128113036 /nfs/dbraw/zinc/11/30/36/1128113036.db2.gz IFNVYXNOICICCG-OLZOCXBDSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC(C2CC2)C2CC2)cc1Cl ZINC000761526434 1128132835 /nfs/dbraw/zinc/13/28/35/1128132835.db2.gz LZERKVWVFGZFOQ-UHFFFAOYSA-N 1 0 294.782 3.774 20 5 CHBDRO CC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761528331 1128133709 /nfs/dbraw/zinc/13/37/09/1128133709.db2.gz QQAFXVASARCYKD-DGCLKSJQSA-N 1 0 282.771 3.917 20 5 CHBDRO CC(C)[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000324187807 1128136527 /nfs/dbraw/zinc/13/65/27/1128136527.db2.gz YODVRDLPJPRBQR-NHYWBVRUSA-N 1 0 262.353 3.680 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1C(C)(C)C ZINC000609195397 1128170719 /nfs/dbraw/zinc/17/07/19/1128170719.db2.gz DTSZDPVPVXXFFH-HNNXBMFYSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCS[C@@H](C)C1 ZINC000927028515 1128208787 /nfs/dbraw/zinc/20/87/87/1128208787.db2.gz ARSJMKNNWUIVQE-AVGNSLFASA-N 1 0 294.420 3.838 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@]2(C)CCCCO2)cccc1[N+](=O)[O-] ZINC000927025382 1128209156 /nfs/dbraw/zinc/20/91/56/1128209156.db2.gz YKAUQMYKUOMONI-CJNGLKHVSA-N 1 0 292.379 3.513 20 5 CHBDRO CCC[C@@H]([NH2+]CCCCCCO)c1cccc([N+](=O)[O-])c1 ZINC000224786529 1128286500 /nfs/dbraw/zinc/28/65/00/1128286500.db2.gz CRUBEIUDLCAXDV-MRXNPFEDSA-N 1 0 294.395 3.578 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccccc1[N+](=O)[O-] ZINC000930235347 1128309956 /nfs/dbraw/zinc/30/99/56/1128309956.db2.gz NASUPAMHVMXMIL-VCDKRKBESA-N 1 0 296.317 3.537 20 5 CHBDRO Cc1c(C[N@@H+]([C@@H](C)C(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000915684847 1128334156 /nfs/dbraw/zinc/33/41/56/1128334156.db2.gz HIHYDSGGBIKEGS-ZDUSSCGKSA-N 1 0 276.380 3.912 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCc2ccccc2)c1 ZINC000035368112 1128328193 /nfs/dbraw/zinc/32/81/93/1128328193.db2.gz RZQGNGZZGBNABH-UHFFFAOYSA-N 1 0 290.750 3.581 20 5 CHBDRO Cc1c(C[NH2+]C(C)(C)c2cccs2)cccc1[N+](=O)[O-] ZINC000542575106 1128328992 /nfs/dbraw/zinc/32/89/92/1128328992.db2.gz WBGJUTNGIVDFDF-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO CCCCC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000153734491 1128338906 /nfs/dbraw/zinc/33/89/06/1128338906.db2.gz CANMCKGFEJAUKW-INIZCTEOSA-N 1 0 294.395 3.529 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000562066865 1128375593 /nfs/dbraw/zinc/37/55/93/1128375593.db2.gz XZUNCBGQDXPBBG-IAQYHMDHSA-N 1 0 292.379 3.833 20 5 CHBDRO Cc1c(C[NH2+][C@H](c2ccncc2)C2CC2)cccc1[N+](=O)[O-] ZINC000934685688 1128466486 /nfs/dbraw/zinc/46/64/86/1128466486.db2.gz HZZOPKZWNSLILI-KRWDZBQOSA-N 1 0 297.358 3.539 20 5 CHBDRO Cc1c(C[NH2+][C@@H](c2ccncc2)C2CC2)cccc1[N+](=O)[O-] ZINC000934685691 1128466739 /nfs/dbraw/zinc/46/67/39/1128466739.db2.gz HZZOPKZWNSLILI-QGZVFWFLSA-N 1 0 297.358 3.539 20 5 CHBDRO CC1(C)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000565984239 1128536488 /nfs/dbraw/zinc/53/64/88/1128536488.db2.gz SPRWGVDLRFMWLV-GMNBZTITSA-N 1 0 286.375 3.728 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000569782433 1128609113 /nfs/dbraw/zinc/60/91/13/1128609113.db2.gz SDUWZLMAYNZEKP-UHFFFAOYSA-N 1 0 280.368 3.614 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000601304351 1128708972 /nfs/dbraw/zinc/70/89/72/1128708972.db2.gz NSZINHNFPGZXDJ-GFCCVEGCSA-N 1 0 274.320 3.655 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609705338 1128722828 /nfs/dbraw/zinc/72/28/28/1128722828.db2.gz VMOVKRNBFQNPBA-LLVKDONJSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@H]1CCCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609625626 1128720004 /nfs/dbraw/zinc/72/00/04/1128720004.db2.gz DTWMCPDSYRKRAB-AWEZNQCLSA-N 1 0 292.379 3.628 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000037668415 1128726009 /nfs/dbraw/zinc/72/60/09/1128726009.db2.gz GRQMSLTYBHXUNT-LBPRGKRZSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609846134 1128728236 /nfs/dbraw/zinc/72/82/36/1128728236.db2.gz DTSJJXCUAUPRRI-IVMMDQJWSA-N 1 0 274.364 3.748 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c(C)c1 ZINC000578883037 1128732147 /nfs/dbraw/zinc/73/21/47/1128732147.db2.gz WFEHKMKKBNCAHP-QGZVFWFLSA-N 1 0 296.370 3.989 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610080164 1128737653 /nfs/dbraw/zinc/73/76/53/1128737653.db2.gz KKNUKHAMTTWGGS-CQSZACIVSA-N 1 0 262.353 3.749 20 5 CHBDRO CC[C@@H]1CC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000430203218 1117859809 /nfs/dbraw/zinc/85/98/09/1117859809.db2.gz IVZPDLMUOLOYIN-CYBMUJFWSA-N 1 0 286.331 3.839 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC(C)(C)CC1 ZINC000610216265 1117884168 /nfs/dbraw/zinc/88/41/68/1117884168.db2.gz BEQPOJJTNOWVPQ-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO CCC[C@H]([NH2+]CCC[C@H](O)CC)c1cccc([N+](=O)[O-])c1 ZINC000358175640 1118015434 /nfs/dbraw/zinc/01/54/34/1118015434.db2.gz ZBDPIXYBMGIOTC-CVEARBPZSA-N 1 0 294.395 3.577 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000037487230 1118022153 /nfs/dbraw/zinc/02/21/53/1118022153.db2.gz RMNQPXIBHPTOLU-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000112466751 1118059668 /nfs/dbraw/zinc/05/96/68/1118059668.db2.gz SZVTVURUTMNMTR-INIZCTEOSA-N 1 0 284.359 3.706 20 5 CHBDRO O=[N+]([O-])c1ccccc1CNc1cc[nH+]c2cc(F)ccc12 ZINC000301303904 1118193705 /nfs/dbraw/zinc/19/37/05/1118193705.db2.gz ZBPGTZPETGHKLG-UHFFFAOYSA-N 1 0 297.289 3.894 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H]1C1CC1 ZINC000615835588 1128764584 /nfs/dbraw/zinc/76/45/84/1128764584.db2.gz TYWXAQDVWOAMFW-QFSNBGPKSA-N 1 0 286.375 3.873 20 5 CHBDRO C[C@@H]1CCCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083173417 1118250898 /nfs/dbraw/zinc/25/08/98/1118250898.db2.gz KKCHSQXJDBXJLU-LLVKDONJSA-N 1 0 289.335 3.501 20 5 CHBDRO CCC[C@H]([NH2+]CC[C@@H](C)F)c1cccc([N+](=O)[O-])c1 ZINC000340465757 1118269724 /nfs/dbraw/zinc/26/97/24/1118269724.db2.gz XLVCVHXXUIIMTE-RISCZKNCSA-N 1 0 268.332 3.774 20 5 CHBDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610001968 1118279355 /nfs/dbraw/zinc/27/93/55/1118279355.db2.gz PVAFRERVEVUQMX-CZUORRHYSA-N 1 0 276.380 3.995 20 5 CHBDRO CN(CCC(F)(F)F)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000088420016 1118398782 /nfs/dbraw/zinc/39/87/82/1118398782.db2.gz XALBSQNBUHPWEN-UHFFFAOYSA-N 1 0 296.676 3.632 20 5 CHBDRO C[C@@H]1CC([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000084975953 1118502042 /nfs/dbraw/zinc/50/20/42/1118502042.db2.gz KZPULQGOPXQIOO-STQMWFEESA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCSC2)cc1[N+](=O)[O-] ZINC000287138561 1118704563 /nfs/dbraw/zinc/70/45/63/1118704563.db2.gz SAMOIUMQRFPOCL-OLZOCXBDSA-N 1 0 294.420 3.697 20 5 CHBDRO CC1CCC(C)([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000610793403 1118871316 /nfs/dbraw/zinc/87/13/16/1118871316.db2.gz FQTHKHYUURICSV-UHFFFAOYSA-N 1 0 276.380 3.696 20 5 CHBDRO CCC[C@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000610796079 1118872337 /nfs/dbraw/zinc/87/23/37/1118872337.db2.gz DYNVJEWWPMYOMR-RYUDHWBXSA-N 1 0 250.342 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1Cc2ccccc21 ZINC000610810586 1118894519 /nfs/dbraw/zinc/89/45/19/1118894519.db2.gz CVCVBEYXAIBSBS-ZFWWWQNUSA-N 1 0 296.370 3.894 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479577610 1119124734 /nfs/dbraw/zinc/12/47/34/1119124734.db2.gz JFUHQOMBNNBILO-GFCCVEGCSA-N 1 0 262.353 3.604 20 5 CHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000479582705 1119124906 /nfs/dbraw/zinc/12/49/06/1119124906.db2.gz YTTJSLMTYQTWGA-OAHLLOKOSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1C ZINC000603601794 1119139111 /nfs/dbraw/zinc/13/91/11/1119139111.db2.gz IBXOGCGCXJNCPX-UHFFFAOYSA-N 1 0 284.359 3.925 20 5 CHBDRO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000153744962 1119283271 /nfs/dbraw/zinc/28/32/71/1119283271.db2.gz IMVMBGFXGRPBBT-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000094325371 1128839012 /nfs/dbraw/zinc/83/90/12/1128839012.db2.gz TYQGVHDMWKUITR-OAHLLOKOSA-N 1 0 292.379 3.532 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCCC1(F)F ZINC000583510700 1119370291 /nfs/dbraw/zinc/37/02/91/1119370291.db2.gz ZXNYAOHOTNTMRT-MFKMUULPSA-N 1 0 296.317 3.607 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000219244826 1119402974 /nfs/dbraw/zinc/40/29/74/1119402974.db2.gz KIVNATDPLGMZHB-ZKYQVNSYSA-N 1 0 280.393 3.530 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC23CCCCC3)cc1 ZINC000536179941 1119447575 /nfs/dbraw/zinc/44/75/75/1119447575.db2.gz LQUTXEOJMDMUCN-UHFFFAOYSA-N 1 0 274.364 3.894 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000169130493 1119496371 /nfs/dbraw/zinc/49/63/71/1119496371.db2.gz BZKLSHULUZOHGB-INIZCTEOSA-N 1 0 288.322 3.975 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCCC[C@@H]1C ZINC000219699245 1119511334 /nfs/dbraw/zinc/51/13/34/1119511334.db2.gz SZAPHYCDVLUGDT-WFASDCNBSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccccc1CN(Cc1ccsc1)C1CC1 ZINC000065684129 1119579322 /nfs/dbraw/zinc/57/93/22/1119579322.db2.gz DEIHOBGWYRDACI-UHFFFAOYSA-N 1 0 288.372 3.821 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C1(c2ccccc2)CC1 ZINC000573266167 1119583253 /nfs/dbraw/zinc/58/32/53/1119583253.db2.gz VIPLTOIIPBZYDC-MRXNPFEDSA-N 1 0 294.354 3.861 20 5 CHBDRO CC[C@@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)CC(F)(F)F ZINC000402715377 1119640618 /nfs/dbraw/zinc/64/06/18/1119640618.db2.gz VWOVPSATNYYBNN-MRVPVSSYSA-N 1 0 296.314 3.725 20 5 CHBDRO CC1CC[NH+](CCSc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000614675840 1119757689 /nfs/dbraw/zinc/75/76/89/1119757689.db2.gz PFUQHUMPNVRWKZ-UHFFFAOYSA-N 1 0 298.383 3.558 20 5 CHBDRO CCC(C)(C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000069432966 1128872382 /nfs/dbraw/zinc/87/23/82/1128872382.db2.gz WVXJTUWPBRXLKY-UHFFFAOYSA-N 1 0 270.760 3.869 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000414208948 1119939230 /nfs/dbraw/zinc/93/92/30/1119939230.db2.gz MANZMERTQLFBRT-MSQAHXEGSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)cc1[N+](=O)[O-] ZINC000414213375 1119941676 /nfs/dbraw/zinc/94/16/76/1119941676.db2.gz QZAOTOJYNAISNL-REBRKWNGSA-N 1 0 274.364 3.742 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)cc1[N+](=O)[O-] ZINC000414213373 1119941748 /nfs/dbraw/zinc/94/17/48/1119941748.db2.gz QZAOTOJYNAISNL-PMOUVXMZSA-N 1 0 274.364 3.742 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000180261540 1119965310 /nfs/dbraw/zinc/96/53/10/1119965310.db2.gz GWGCLDAFIPMSEB-DZGCQCFKSA-N 1 0 292.379 3.513 20 5 CHBDRO C[NH+](C)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000301519122 1120092254 /nfs/dbraw/zinc/09/22/54/1120092254.db2.gz HEDNKWHLYPBCCO-WDEREUQCSA-N 1 0 297.786 3.533 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccoc1 ZINC000542775779 1120144474 /nfs/dbraw/zinc/14/44/74/1120144474.db2.gz AQYAECOIJJOZPC-SNVBAGLBSA-N 1 0 294.738 3.735 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C1CC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000926890477 1120198126 /nfs/dbraw/zinc/19/81/26/1120198126.db2.gz DEGNSOJPOWXWRR-NXEZZACHSA-N 1 0 284.306 3.679 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000062726463 1120205514 /nfs/dbraw/zinc/20/55/14/1120205514.db2.gz DSAKIHNXPSMKRW-CYBMUJFWSA-N 1 0 290.388 3.940 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000062726458 1120206089 /nfs/dbraw/zinc/20/60/89/1120206089.db2.gz ACXHJVBLHKQHHU-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000062726571 1120206318 /nfs/dbraw/zinc/20/63/18/1120206318.db2.gz CJWIHUPINXUILK-MRXNPFEDSA-N 1 0 284.359 3.878 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000020087392 1120278651 /nfs/dbraw/zinc/27/86/51/1120278651.db2.gz WFSRQUQZFJOIJF-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(C)c(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000313944117 1120417868 /nfs/dbraw/zinc/41/78/68/1120417868.db2.gz OWSLLDRPINNPMC-KRWDZBQOSA-N 1 0 299.374 3.848 20 5 CHBDRO C[C@@H](F)CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417346901 1120430771 /nfs/dbraw/zinc/43/07/71/1120430771.db2.gz GALWASQGRUCXBE-IAQYHMDHSA-N 1 0 280.343 3.700 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000020090638 1120493223 /nfs/dbraw/zinc/49/32/23/1120493223.db2.gz XHQDEZGPIJIZOS-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000618567148 1128920121 /nfs/dbraw/zinc/92/01/21/1128920121.db2.gz ZBERBSMEWSANEA-ZBEGNZNMSA-N 1 0 274.364 3.608 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC(F)(F)C1)CCC2 ZINC000618574953 1128921375 /nfs/dbraw/zinc/92/13/75/1128921375.db2.gz QMPYRXDZRTUKNE-BXUZGUMPSA-N 1 0 296.317 3.750 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc2cc[nH]c21)c1cccc([N+](=O)[O-])c1 ZINC000317937554 1120520429 /nfs/dbraw/zinc/52/04/29/1120520429.db2.gz SMLAANUILLDCLS-GFCCVEGCSA-N 1 0 295.342 3.927 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000070113438 1120528393 /nfs/dbraw/zinc/52/83/93/1120528393.db2.gz CRBNQPYOPZOHTD-OUCADQQQSA-N 1 0 292.379 3.518 20 5 CHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000092703982 1120545684 /nfs/dbraw/zinc/54/56/84/1120545684.db2.gz OIFHKGFXDZASNC-GQCTYLIASA-N 1 0 286.375 3.728 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H](OC)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000154967572 1120565825 /nfs/dbraw/zinc/56/58/25/1120565825.db2.gz KSCWBPAKGLAJJP-CABCVRRESA-N 1 0 294.395 3.697 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000019981542 1120577719 /nfs/dbraw/zinc/57/77/19/1120577719.db2.gz LYYPYCLMZKZCLM-SLEUVZQESA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H](C[C@](C)(O)CC)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000925690766 1120599119 /nfs/dbraw/zinc/59/91/19/1120599119.db2.gz HBPLJNYLLCKQLZ-XJKCOSOUSA-N 1 0 294.395 3.575 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c(C)c1 ZINC000500417706 1120617855 /nfs/dbraw/zinc/61/78/55/1120617855.db2.gz AOENRYUULWNZMX-OAHLLOKOSA-N 1 0 291.395 3.580 20 5 CHBDRO Cc1cc(N2CC[C@@H](C)[C@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302102832 1120648874 /nfs/dbraw/zinc/64/88/74/1120648874.db2.gz VUQXOVDQFMGUGZ-ZYHUDNBSSA-N 1 0 285.347 3.686 20 5 CHBDRO CC[C@H]([NH2+]CC1CCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000131181918 1120650893 /nfs/dbraw/zinc/65/08/93/1120650893.db2.gz FGGQCWMNWUJIKO-HNNXBMFYSA-N 1 0 294.420 3.779 20 5 CHBDRO Cc1cccc(NC[C@H](c2ccccc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000302461344 1120652568 /nfs/dbraw/zinc/65/25/68/1120652568.db2.gz ACWQTZQKJNIVCH-MRXNPFEDSA-N 1 0 299.374 3.618 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CCCO1 ZINC000090857342 1128933165 /nfs/dbraw/zinc/93/31/65/1128933165.db2.gz JRXXUNLBKFLGOD-NOLJZWGESA-N 1 0 292.379 3.511 20 5 CHBDRO COc1ccc(C[N@H+]([C@@H](C)C(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000078535771 1128944556 /nfs/dbraw/zinc/94/45/56/1128944556.db2.gz MVVYBQDSYSCADD-LBPRGKRZSA-N 1 0 292.379 3.612 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000511954968 1120865164 /nfs/dbraw/zinc/86/51/64/1120865164.db2.gz DBDKHASBCWYXGF-LBPRGKRZSA-N 1 0 262.353 3.560 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000300405342 1120969542 /nfs/dbraw/zinc/96/95/42/1120969542.db2.gz KIVNATDPLGMZHB-SCDSUCTJSA-N 1 0 280.393 3.530 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCS[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000313502737 1121003261 /nfs/dbraw/zinc/00/32/61/1121003261.db2.gz JGCITYDAXMIDAQ-UGFHNGPFSA-N 1 0 294.420 3.920 20 5 CHBDRO CC1(C)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542003026 1121015931 /nfs/dbraw/zinc/01/59/31/1121015931.db2.gz HICMICSMKMYGQV-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1)CCC2 ZINC000168924842 1121136463 /nfs/dbraw/zinc/13/64/63/1121136463.db2.gz ZTSWPHPCHVWUFW-QGZVFWFLSA-N 1 0 282.343 3.762 20 5 CHBDRO [NH2+]=CNc1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC001167868246 1121178413 /nfs/dbraw/zinc/17/84/13/1121178413.db2.gz IBJNMZPLGHKHJL-UHFFFAOYSA-N 1 0 273.317 3.765 20 5 CHBDRO CC(C)C[C@@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001167897128 1121256361 /nfs/dbraw/zinc/25/63/61/1121256361.db2.gz DRCDFFUTNMRCKV-HNNXBMFYSA-N 1 0 276.380 3.995 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000706956659 1121445939 /nfs/dbraw/zinc/44/59/39/1121445939.db2.gz MIMCLHNNHGXGKK-RYUDHWBXSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)C1(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000706956641 1121446422 /nfs/dbraw/zinc/44/64/22/1121446422.db2.gz LZPQLZGAEXGROA-SMDDNHRTSA-N 1 0 262.353 3.824 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000708505703 1121468820 /nfs/dbraw/zinc/46/88/20/1121468820.db2.gz ZVLURCZGZOHWCV-LBPRGKRZSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@@H](CC1CCC1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000710230276 1121474296 /nfs/dbraw/zinc/47/42/96/1121474296.db2.gz YAYDGMFCGKYAQD-RYUDHWBXSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000512653366 1121510638 /nfs/dbraw/zinc/51/06/38/1121510638.db2.gz WNNFKPHLMQHFSS-VCIFKONDSA-N 1 0 286.375 3.873 20 5 CHBDRO CCC(C)(C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000429433977 1121580588 /nfs/dbraw/zinc/58/05/88/1121580588.db2.gz ZMOLFKFSLFBMBL-OAHLLOKOSA-N 1 0 290.407 3.942 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCCC1CC1 ZINC000611336005 1121637870 /nfs/dbraw/zinc/63/78/70/1121637870.db2.gz JTIHUVRSMFQBFJ-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO COc1cc(C[NH+]2C3CCCC2CCC3)ccc1[N+](=O)[O-] ZINC000611516455 1121653454 /nfs/dbraw/zinc/65/34/54/1121653454.db2.gz JHHGYFZPNRUENM-UHFFFAOYSA-N 1 0 290.363 3.510 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000611516945 1121653480 /nfs/dbraw/zinc/65/34/80/1121653480.db2.gz QAEBHUAKZBSNKK-GHMZBOCLSA-N 1 0 284.306 3.551 20 5 CHBDRO Cc1ccccc1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001177108467 1121713752 /nfs/dbraw/zinc/71/37/52/1121713752.db2.gz AENNIGBIXXYGKF-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO CC1=CCC[C@@H](C)[C@H]1C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC001178393737 1121781524 /nfs/dbraw/zinc/78/15/24/1121781524.db2.gz WFKKXZZELJNDSF-PBHICJAKSA-N 1 0 288.391 3.719 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC23CCC3)cc1[N+](=O)[O-] ZINC000619723956 1129008956 /nfs/dbraw/zinc/00/89/56/1129008956.db2.gz GXXFUCSTSVFQNQ-IUODEOHRSA-N 1 0 274.364 3.887 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCC12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000619723846 1129009158 /nfs/dbraw/zinc/00/91/58/1129009158.db2.gz OWYCLERAEYBJIA-HUUCEWRRSA-N 1 0 274.364 3.968 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC001179001715 1121838475 /nfs/dbraw/zinc/83/84/75/1121838475.db2.gz APAQEZBTRRUQNX-GJZGRUSLSA-N 1 0 288.391 3.737 20 5 CHBDRO CC[C@H]1CCC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000068593325 1121841463 /nfs/dbraw/zinc/84/14/63/1121841463.db2.gz SRYQQAGPSAWVSI-JSGCOSHPSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1cc(C(C)C)ccc1O[C@H](C)C[N+](C)(C)C ZINC001230211619 1121845814 /nfs/dbraw/zinc/84/58/14/1121845814.db2.gz OFWLOCBHCFFSTC-CQSZACIVSA-N 1 0 250.406 3.592 20 5 CHBDRO C[C@H](C[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000619843866 1129015150 /nfs/dbraw/zinc/01/51/50/1129015150.db2.gz YIRDIEXYRFSBIW-GFCCVEGCSA-N 1 0 264.369 3.709 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1C[C@@H]2CCC[C@@H]12 ZINC001179768174 1121905788 /nfs/dbraw/zinc/90/57/88/1121905788.db2.gz LPIZNFUFHRIFBC-RLTCXQKASA-N 1 0 286.375 3.776 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCC[C@H]1C ZINC000501927169 1122023824 /nfs/dbraw/zinc/02/38/24/1122023824.db2.gz JQOIBTKJTVYSBP-DOMZBBRYSA-N 1 0 292.379 3.660 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000502056167 1122032505 /nfs/dbraw/zinc/03/25/05/1122032505.db2.gz HNADYMCMUAZMOH-ZBFHGGJFSA-N 1 0 276.380 3.696 20 5 CHBDRO C[C@H]1CC(C)(C)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001182396494 1122150784 /nfs/dbraw/zinc/15/07/84/1122150784.db2.gz IDACLUPCMJUWPA-JTQLQIEISA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000035047658 1122156938 /nfs/dbraw/zinc/15/69/38/1122156938.db2.gz KWQCCLSIYRHAAD-MRXNPFEDSA-N 1 0 282.343 3.680 20 5 CHBDRO CSCCCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000133650895 1122176682 /nfs/dbraw/zinc/17/66/82/1122176682.db2.gz KSLYNQBXYSKODB-LBPRGKRZSA-N 1 0 282.409 3.697 20 5 CHBDRO C[C@H]([NH2+][C@H]1C[C@@H]2CC[C@@H](C2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001183788257 1122239207 /nfs/dbraw/zinc/23/92/07/1122239207.db2.gz KLEFASVWVBTMHQ-RMRHIDDWSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001183822802 1122241951 /nfs/dbraw/zinc/24/19/51/1122241951.db2.gz MYSRQTWSADBTNZ-IXOXFDKPSA-N 1 0 294.782 3.630 20 5 CHBDRO CC(C)[C@H]1[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000430101276 1122404231 /nfs/dbraw/zinc/40/42/31/1122404231.db2.gz NHMRFANLSXVVCP-OAHLLOKOSA-N 1 0 274.364 3.605 20 5 CHBDRO CC(C)[NH+]1CCC(CCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC001187189828 1122423101 /nfs/dbraw/zinc/42/31/01/1122423101.db2.gz JFDFJTRXZFCGFT-UHFFFAOYSA-N 1 0 291.395 3.517 20 5 CHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000505617439 1122438332 /nfs/dbraw/zinc/43/83/32/1122438332.db2.gz YWQYBDOJSVCPDH-NEPJUHHUSA-N 1 0 280.343 3.744 20 5 CHBDRO CCC(CC)(CC)[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC001191616999 1122606840 /nfs/dbraw/zinc/60/68/40/1122606840.db2.gz FZRYTCLDBQWGHN-UHFFFAOYSA-N 1 0 294.395 3.922 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2C[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC001192626061 1122654746 /nfs/dbraw/zinc/65/47/46/1122654746.db2.gz JRDZMDVNAXFECH-WQVCFCJDSA-N 1 0 288.391 3.990 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)CC1(c2ccccc2)CC1 ZINC000438284631 1122689853 /nfs/dbraw/zinc/68/98/53/1122689853.db2.gz QDVLNNVYKNDEMB-UHFFFAOYSA-N 1 0 296.370 3.758 20 5 CHBDRO Cc1ccc(CC[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000438514717 1122705368 /nfs/dbraw/zinc/70/53/68/1122705368.db2.gz FXPHFTWWVOXKII-UHFFFAOYSA-N 1 0 296.370 3.504 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC[C@@H]2C[C@H]2C2CC2)c(Cl)c1 ZINC000712720392 1122717115 /nfs/dbraw/zinc/71/71/15/1122717115.db2.gz RSOLITIDWPHXGG-RISCZKNCSA-N 1 0 294.782 3.774 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@H](C)[C@@H]1C ZINC001195277907 1122860774 /nfs/dbraw/zinc/86/07/74/1122860774.db2.gz HDJRJOXALBBZSU-MROQNXINSA-N 1 0 262.353 3.632 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC001198908752 1123016732 /nfs/dbraw/zinc/01/67/32/1123016732.db2.gz YVMGUDHLTXVBTH-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO C[NH+](C)C1(CNc2cc(Cl)ccc2[N+](=O)[O-])CCCC1 ZINC000161028456 1123023763 /nfs/dbraw/zinc/02/37/63/1123023763.db2.gz CVPMGHKUZFFBGW-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@H]1CCCCC1(F)F ZINC000294119149 1123065196 /nfs/dbraw/zinc/06/51/96/1123065196.db2.gz DLPCDJIWYXTPJN-GFCCVEGCSA-N 1 0 284.306 3.510 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H]1CCC[C@@H]1C ZINC001202134219 1123177323 /nfs/dbraw/zinc/17/73/23/1123177323.db2.gz CQMNACXMKQUVDS-FZMZJTMJSA-N 1 0 276.380 3.737 20 5 CHBDRO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000267022089 1123268032 /nfs/dbraw/zinc/26/80/32/1123268032.db2.gz KMLMFIQCPULXBE-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO CCCCC[C@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])C(C)(C)C ZINC000851908716 1123389100 /nfs/dbraw/zinc/38/91/00/1123389100.db2.gz QKJCEBNFJFZORK-ZDUSSCGKSA-N 1 0 297.399 3.976 20 5 CHBDRO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000852649777 1123411113 /nfs/dbraw/zinc/41/11/13/1123411113.db2.gz BWMSASBCRFGNAE-ZBOXLXRLSA-N 1 0 298.333 3.740 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)C1CCC(F)CC1 ZINC000852651443 1123412200 /nfs/dbraw/zinc/41/22/00/1123412200.db2.gz NIDMHKKDEPXTHZ-PKSQDBQZSA-N 1 0 298.333 3.740 20 5 CHBDRO Cc1cc(NC2CC[NH+](C(C)(C)C)CC2)c([N+](=O)[O-])s1 ZINC000853204101 1123428433 /nfs/dbraw/zinc/42/84/33/1123428433.db2.gz SZRZMSUVKAFCNZ-UHFFFAOYSA-N 1 0 297.424 3.640 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1ccns1 ZINC000858575786 1123663610 /nfs/dbraw/zinc/66/36/10/1123663610.db2.gz DTMMWJBKCUCJTN-MNOVXSKESA-N 1 0 291.376 3.772 20 5 CHBDRO CC(C)(C)c1ccncc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000414497771 1123787859 /nfs/dbraw/zinc/78/78/59/1123787859.db2.gz LMONJDFILWWOIP-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO COCCCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000171500022 1123855902 /nfs/dbraw/zinc/85/59/02/1123855902.db2.gz TYZMONWILFWTMF-UHFFFAOYSA-N 1 0 294.395 3.622 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000485541318 1123874048 /nfs/dbraw/zinc/87/40/48/1123874048.db2.gz HYIIMIXZEAYUHO-CYBMUJFWSA-N 1 0 292.379 3.616 20 5 CHBDRO Cc1c(CNc2ccc(C[NH+](C)C)cc2)cccc1[N+](=O)[O-] ZINC000864034645 1123913035 /nfs/dbraw/zinc/91/30/35/1123913035.db2.gz SESDGBYGTCAABR-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO C[C@@H]1CC[C@H](C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000475547650 1124007419 /nfs/dbraw/zinc/00/74/19/1124007419.db2.gz KODDWAYZJRHWRC-BVUKWYMNSA-N 1 0 274.364 3.634 20 5 CHBDRO COc1ccc(C[NH2+]C2(C)CCC(C)CC2)cc1[N+](=O)[O-] ZINC000237318280 1124030653 /nfs/dbraw/zinc/03/06/53/1124030653.db2.gz ROUPKWQSOHYOFY-UHFFFAOYSA-N 1 0 292.379 3.662 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC(C2CC2)C2CC2)c(Cl)c1 ZINC000088458781 1124042558 /nfs/dbraw/zinc/04/25/58/1124042558.db2.gz MQGHSAJGWSUPSE-UHFFFAOYSA-N 1 0 294.782 3.774 20 5 CHBDRO C[C@@H](CCc1cccnc1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000866316119 1124051648 /nfs/dbraw/zinc/05/16/48/1124051648.db2.gz WTXWCATTYGVNIF-KBPBESRZSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCC1(F)CCC1 ZINC000866356728 1124057474 /nfs/dbraw/zinc/05/74/74/1124057474.db2.gz OQIAZLKLLSQVSC-NSHDSACASA-N 1 0 298.333 3.537 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000088512090 1124064228 /nfs/dbraw/zinc/06/42/28/1124064228.db2.gz QXGXMPHOCSVBGH-TZMCWYRMSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)n1 ZINC000866541088 1124079980 /nfs/dbraw/zinc/07/99/80/1124079980.db2.gz VZJRHKBSJVCELC-CYBMUJFWSA-N 1 0 299.374 3.766 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000037668335 1129165530 /nfs/dbraw/zinc/16/55/30/1129165530.db2.gz VTPCBILCUFZVRN-CYBMUJFWSA-N 1 0 276.361 3.897 20 5 CHBDRO CCCC[C@@H](CC)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446839620 1124125558 /nfs/dbraw/zinc/12/55/58/1124125558.db2.gz UJJXBBVRESCVIZ-LLVKDONJSA-N 1 0 290.367 3.530 20 5 CHBDRO Cc1cc(C)[nH+]c(NCc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000122354324 1124491873 /nfs/dbraw/zinc/49/18/73/1124491873.db2.gz KGTMVYIOQLWRGV-UHFFFAOYSA-N 1 0 291.738 3.872 20 5 CHBDRO CSCCCCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000186777341 1124581791 /nfs/dbraw/zinc/58/17/91/1124581791.db2.gz ZXROEJHVYSBBKI-LBPRGKRZSA-N 1 0 282.409 3.779 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2ccccc21 ZINC000449068094 1124644003 /nfs/dbraw/zinc/64/40/03/1124644003.db2.gz QUWNURGXCCISER-GUYCJALGSA-N 1 0 296.370 3.803 20 5 CHBDRO C[C@@H]([NH2+]CC1(C2CC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872053938 1124667740 /nfs/dbraw/zinc/66/77/40/1124667740.db2.gz YPDKZHUHPCATRW-SNVBAGLBSA-N 1 0 278.327 3.575 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC1=CCCC1 ZINC000449207419 1124669568 /nfs/dbraw/zinc/66/95/68/1124669568.db2.gz BZGPUTHBBDYSED-ZDUSSCGKSA-N 1 0 274.364 3.616 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCCCS1)c1c(F)cccc1[N+](=O)[O-] ZINC000872060267 1124670208 /nfs/dbraw/zinc/67/02/08/1124670208.db2.gz OLJZAYBIJBKOHI-QWRGUYRKSA-N 1 0 298.383 3.670 20 5 CHBDRO CC(C)SCC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872070678 1124674503 /nfs/dbraw/zinc/67/45/03/1124674503.db2.gz GRVDUNPSSFMZQC-SNVBAGLBSA-N 1 0 286.372 3.526 20 5 CHBDRO CCC(C)(C)C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449285160 1124682690 /nfs/dbraw/zinc/68/26/90/1124682690.db2.gz QFHKRJYVOCSKGQ-GFCCVEGCSA-N 1 0 264.369 3.552 20 5 CHBDRO COCC(C)(C)CC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000872105357 1124683653 /nfs/dbraw/zinc/68/36/53/1124683653.db2.gz HMEUFRVAIURTAM-ZDUSSCGKSA-N 1 0 294.395 3.617 20 5 CHBDRO C[C@@H](CCC(F)(F)F)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449347756 1124695650 /nfs/dbraw/zinc/69/56/50/1124695650.db2.gz ISXIVUIAKXRSIW-UWVGGRQHSA-N 1 0 290.285 3.976 20 5 CHBDRO CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449350913 1124698604 /nfs/dbraw/zinc/69/86/04/1124698604.db2.gz YCGKMAPRKOYJQR-CQDKDKBSSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CC2(F)F)CC1 ZINC000593078039 1124824065 /nfs/dbraw/zinc/82/40/65/1124824065.db2.gz WBYBSJXTPCQQAA-LLVKDONJSA-N 1 0 296.317 3.777 20 5 CHBDRO CCC(C)(C)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000530278979 1125138274 /nfs/dbraw/zinc/13/82/74/1125138274.db2.gz VCGYQVQPSCYYHL-NTMALXAHSA-N 1 0 262.353 3.728 20 5 CHBDRO CCC[C@H]([NH2+][C@H](C)CCCCO)c1cccc([N+](=O)[O-])c1 ZINC000295841983 1125164221 /nfs/dbraw/zinc/16/42/21/1125164221.db2.gz ANSOGGPODKUWTH-CJNGLKHVSA-N 1 0 294.395 3.577 20 5 CHBDRO CC(F)(F)CCC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000295987364 1125192025 /nfs/dbraw/zinc/19/20/25/1125192025.db2.gz JZEDUUGOKXZBQI-UHFFFAOYSA-N 1 0 292.713 3.773 20 5 CHBDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000531441450 1125218984 /nfs/dbraw/zinc/21/89/84/1125218984.db2.gz GBYIDNQVIQDRSZ-YOEHRIQHSA-N 1 0 296.370 3.973 20 5 CHBDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000531441470 1125219880 /nfs/dbraw/zinc/21/98/80/1125219880.db2.gz NOXYHJJFFXODIL-RDTXWAMCSA-N 1 0 296.370 3.973 20 5 CHBDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000531441447 1125220005 /nfs/dbraw/zinc/22/00/05/1125220005.db2.gz GBYIDNQVIQDRSZ-PBHICJAKSA-N 1 0 296.370 3.973 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC2(C)CC(F)(F)C2)cc1[N+](=O)[O-] ZINC000883255080 1125385798 /nfs/dbraw/zinc/38/57/98/1125385798.db2.gz KNUGHQLRKHZHEB-LLVKDONJSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC2(C)CC(F)(F)C2)cc1[N+](=O)[O-] ZINC000883255081 1125386025 /nfs/dbraw/zinc/38/60/25/1125386025.db2.gz KNUGHQLRKHZHEB-NSHDSACASA-N 1 0 298.333 3.989 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CC[C@H]1CCCC1(F)F ZINC000883266904 1125389518 /nfs/dbraw/zinc/38/95/18/1125389518.db2.gz NPZPYFODEKILCV-GFCCVEGCSA-N 1 0 284.306 3.510 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]CC[C@@H]2CCCC2(F)F)cs1 ZINC000883266852 1125389553 /nfs/dbraw/zinc/38/95/53/1125389553.db2.gz MARAWJHJZWEDGT-JTQLQIEISA-N 1 0 290.335 3.571 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000132294885 1125416993 /nfs/dbraw/zinc/41/69/93/1125416993.db2.gz PHDIHARCTRFUBU-SKDRFNHKSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H](C[NH2+]C1CC2(CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000897465211 1125424900 /nfs/dbraw/zinc/42/49/00/1125424900.db2.gz TVLIOSOSKNNCGE-LBPRGKRZSA-N 1 0 274.364 3.621 20 5 CHBDRO Cc1ccccc1C[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000037777324 1129269003 /nfs/dbraw/zinc/26/90/03/1129269003.db2.gz SJJNTERHSPSCFW-AWEZNQCLSA-N 1 0 284.359 3.624 20 5 CHBDRO C[C@H](C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000734509745 1129310500 /nfs/dbraw/zinc/31/05/00/1129310500.db2.gz LIPFUWKJNFZEDG-FNOHHLHBSA-N 1 0 276.380 3.880 20 5 CHBDRO Cc1ccsc1[C@@H](C)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000090910144 1129336110 /nfs/dbraw/zinc/33/61/10/1129336110.db2.gz LUVCOLXLWCFRQT-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000742372947 1129475633 /nfs/dbraw/zinc/47/56/33/1129475633.db2.gz YVYHDSIHUKUDBB-OAHLLOKOSA-N 1 0 285.347 3.539 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000742377584 1129475954 /nfs/dbraw/zinc/47/59/54/1129475954.db2.gz WBZYHIOVONKDBO-HZPDHXFCSA-N 1 0 288.391 3.962 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCCCCCC1 ZINC000744385178 1129576054 /nfs/dbraw/zinc/57/60/54/1129576054.db2.gz SEHLXKWFDYJVFU-ZDUSSCGKSA-N 1 0 262.353 3.922 20 5 CHBDRO CC(C)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1Cl ZINC001168984287 1129686918 /nfs/dbraw/zinc/68/69/18/1129686918.db2.gz LRKHAOFMMNDMTH-NWDGAFQWSA-N 1 0 296.798 3.610 20 5 CHBDRO CC(C)[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001168985292 1129686920 /nfs/dbraw/zinc/68/69/20/1129686920.db2.gz SRQLPSZNDQFZQZ-MAZHCROVSA-N 1 0 294.370 3.558 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001168980721 1129686967 /nfs/dbraw/zinc/68/69/67/1129686967.db2.gz GACPRARHDJTQGM-KCXAZCMYSA-N 1 0 294.370 3.702 20 5 CHBDRO CC(C)=CCC/C(C)=C/C[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168979518 1129686990 /nfs/dbraw/zinc/68/69/90/1129686990.db2.gz YXWKEQNLMYOYAM-GQXMGIGRSA-N 1 0 280.412 3.714 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(C)c1 ZINC001169000776 1129688140 /nfs/dbraw/zinc/68/81/40/1129688140.db2.gz BTBLPXINCKTMFS-BHYGNILZSA-N 1 0 290.407 3.871 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](CC2CC2)c2ccccc2)C1 ZINC001169000939 1129688712 /nfs/dbraw/zinc/68/87/12/1129688712.db2.gz ZSCRJIXFAGWCFW-HYVNUMGLSA-N 1 0 288.391 3.563 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169006536 1129689248 /nfs/dbraw/zinc/68/92/48/1129689248.db2.gz YRYILSXOBWFOSK-XQLPTFJDSA-N 1 0 282.428 3.626 20 5 CHBDRO C[C@H](c1ccc(Cl)cc1)[N@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035127 1129690889 /nfs/dbraw/zinc/69/08/89/1129690889.db2.gz AJWRXJWHXMXWQL-JMSVASOKSA-N 1 0 296.798 3.778 20 5 CHBDRO Cc1ccccc1[C@H]1CCC[N@@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169055868 1129693283 /nfs/dbraw/zinc/69/32/83/1129693283.db2.gz QXBXTIXSMMUYRF-HLLBOEOZSA-N 1 0 288.391 3.577 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC001169271689 1129713726 /nfs/dbraw/zinc/71/37/26/1129713726.db2.gz OIADYTQTFQSVRA-CJNGLKHVSA-N 1 0 292.379 3.532 20 5 CHBDRO C[C@H]([NH2+]CC1(C)CC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000720911135 1129720578 /nfs/dbraw/zinc/72/05/78/1129720578.db2.gz GAWIBIHPJPBCTM-JTQLQIEISA-N 1 0 284.306 3.681 20 5 CHBDRO CCCCC(=O)[C@H](C)Nc1ccccc1C[N+](C)(C)CC ZINC001169547943 1129735454 /nfs/dbraw/zinc/73/54/54/1129735454.db2.gz RUSCOIMTEWBSPY-HNNXBMFYSA-N 1 0 291.459 3.843 20 5 CHBDRO Cc1ccc(C[N@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000768137328 1129834985 /nfs/dbraw/zinc/83/49/85/1129834985.db2.gz MAFCKASKHHMHPV-BETUJISGSA-N 1 0 262.353 3.666 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@H]2C2CCC2)c1 ZINC000800973740 1129901090 /nfs/dbraw/zinc/90/10/90/1129901090.db2.gz SSNIJOGUQFHXSG-DZGCQCFKSA-N 1 0 294.782 3.917 20 5 CHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801517198 1129923447 /nfs/dbraw/zinc/92/34/47/1129923447.db2.gz BHFVYVKSCQFPDI-NWDGAFQWSA-N 1 0 280.343 3.744 20 5 CHBDRO COc1cc([C@@H](C)[NH2+]Cc2cccs2)cc([N+](=O)[O-])c1 ZINC000903058564 1130107078 /nfs/dbraw/zinc/10/70/78/1130107078.db2.gz SARQTGPHPBTRQY-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC1CCC1 ZINC000786818477 1130119167 /nfs/dbraw/zinc/11/91/67/1130119167.db2.gz YXHSIJKKPCKXJW-RAXLEYEMSA-N 1 0 274.364 3.778 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746654672 1130135312 /nfs/dbraw/zinc/13/53/12/1130135312.db2.gz JYYZSNPPWJZJAW-SNVBAGLBSA-N 1 0 270.760 3.725 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccns1 ZINC000903245349 1130135426 /nfs/dbraw/zinc/13/54/26/1130135426.db2.gz LFSSKINFQDVIEK-GHMZBOCLSA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@H](CCc1cccnc1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000903288301 1130146376 /nfs/dbraw/zinc/14/63/76/1130146376.db2.gz WVJDGCACWDNSAX-ZIAGYGMSSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788480513 1130190446 /nfs/dbraw/zinc/19/04/46/1130190446.db2.gz KXKCNHWOGPDNFW-UXIGCNINSA-N 1 0 292.354 3.887 20 5 CHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)CC(C)C)c([N+](=O)[O-])c1 ZINC001170310426 1130484715 /nfs/dbraw/zinc/48/47/15/1130484715.db2.gz VUBBBJNTEYGWSA-CHWSQXEVSA-N 1 0 294.395 3.559 20 5 CHBDRO C(=C1CC[NH2+]CC1)c1ncnc2cc3ccccc3cc12 ZINC001240874423 1130498479 /nfs/dbraw/zinc/49/84/79/1130498479.db2.gz RAZXFWQTLZPGIJ-UHFFFAOYSA-N 1 0 275.355 3.550 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCC(F)(F)F)cc1Cl ZINC000783636132 1130843061 /nfs/dbraw/zinc/84/30/61/1130843061.db2.gz BJUKTHHETOQQBC-UHFFFAOYSA-N 1 0 296.676 3.680 20 5 CHBDRO CC[C@H](C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815595220 1131006062 /nfs/dbraw/zinc/00/60/62/1131006062.db2.gz KXKJPNQNJARBCU-TUAOUCFPSA-N 1 0 279.384 3.652 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2C[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000816646775 1131119542 /nfs/dbraw/zinc/11/95/42/1131119542.db2.gz IYCGQDQGAPHAPP-NEPJUHHUSA-N 1 0 262.353 3.558 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001115984282 1131124283 /nfs/dbraw/zinc/12/42/83/1131124283.db2.gz NGIGNZUCSHERGD-STQMWFEESA-N 1 0 292.354 3.746 20 5 CHBDRO C[N@@H+]1CCC[C@@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001227764103 1131739680 /nfs/dbraw/zinc/73/96/80/1131739680.db2.gz KMXWEIWDHVGXDM-MRXNPFEDSA-N 1 0 292.382 3.861 20 5 CHBDRO C[C@H](C[NH+](C)C)Oc1cccc2ccc3cccnc3c21 ZINC001227764158 1131740297 /nfs/dbraw/zinc/74/02/97/1131740297.db2.gz LPSLAWPFBSLUHL-CYBMUJFWSA-N 1 0 280.371 3.717 20 5 CHBDRO C/C=C/c1ccc(OCC)c(O[C@@H](C)C[N+](C)(C)C)c1 ZINC001228375188 1131869530 /nfs/dbraw/zinc/86/95/30/1131869530.db2.gz YWOVZEICLDOQHG-KGXGESDWSA-N 1 0 278.416 3.592 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC1CCC1 ZINC000773036477 1131925625 /nfs/dbraw/zinc/92/56/25/1131925625.db2.gz OEEGSLYGQKSQHS-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO Cc1ccc(C[N@H+]2CC[C@@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC001171380953 1131943521 /nfs/dbraw/zinc/94/35/21/1131943521.db2.gz HBVSESXXGCVIIK-DGCLKSJQSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000036993662 1131986333 /nfs/dbraw/zinc/98/63/33/1131986333.db2.gz JKPUBLQUWCANGR-MLGOLLRUSA-N 1 0 288.347 3.860 20 5 CHBDRO CCCCCCc1c(O)cccc1O[C@@H](C)C[N+](C)(C)C ZINC001230180779 1132157872 /nfs/dbraw/zinc/15/78/72/1132157872.db2.gz VTOKJJJGAVXTLZ-HNNXBMFYSA-O 1 0 294.459 3.989 20 5 CHBDRO CCCCCCc1c(O)cccc1O[C@H](C)C[N+](C)(C)C ZINC001230180780 1132157955 /nfs/dbraw/zinc/15/79/55/1132157955.db2.gz VTOKJJJGAVXTLZ-OAHLLOKOSA-O 1 0 294.459 3.989 20 5 CHBDRO CC[N@@H+]1CC[C@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001230203741 1132160259 /nfs/dbraw/zinc/16/02/59/1132160259.db2.gz WWYSSETVBQUVHY-HNNXBMFYSA-N 1 0 292.382 3.861 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)c1 ZINC000839186960 1132188121 /nfs/dbraw/zinc/18/81/21/1132188121.db2.gz WLOLQWQPUGMNMF-LQJRIPTKSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001141722786 1132239800 /nfs/dbraw/zinc/23/98/00/1132239800.db2.gz JDAZJQMXIJBSJY-RHSMWYFYSA-N 1 0 291.394 3.948 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C1CCCCC1)CC2 ZINC001172899410 1132347752 /nfs/dbraw/zinc/34/77/52/1132347752.db2.gz XFOXWNUZBBUNPK-MRXNPFEDSA-N 1 0 288.391 3.765 20 5 CHBDRO CCC[C@H](C)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172903827 1132347791 /nfs/dbraw/zinc/34/77/91/1132347791.db2.gz JPGZYCCXOCTCNH-WFASDCNBSA-N 1 0 276.380 3.620 20 5 CHBDRO CC1(C)CC([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172912758 1132371079 /nfs/dbraw/zinc/37/10/79/1132371079.db2.gz PHSARHAMHSUMBL-CQSZACIVSA-N 1 0 288.391 3.620 20 5 CHBDRO C[C@@H]1CCCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909939 1132371341 /nfs/dbraw/zinc/37/13/41/1132371341.db2.gz VWLBNXCXZGKCPF-CJNGLKHVSA-N 1 0 288.391 3.717 20 5 CHBDRO C[C@@H]1CCC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909382 1132372330 /nfs/dbraw/zinc/37/23/30/1132372330.db2.gz RJXKRMMNARCDSE-CZUORRHYSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC(C)(C)C1 ZINC001173221748 1132411126 /nfs/dbraw/zinc/41/11/26/1132411126.db2.gz POZHRKSTDKHDLT-TZMCWYRMSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)C1CCCC1 ZINC001173215877 1132411132 /nfs/dbraw/zinc/41/11/32/1132411132.db2.gz ATQIUBYSANVXBI-STQMWFEESA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)CC1 ZINC001173221564 1132411238 /nfs/dbraw/zinc/41/12/38/1132411238.db2.gz KHHGTMAHLPDEOL-ZIAGYGMSSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC[C@H]1C ZINC001173220862 1132411277 /nfs/dbraw/zinc/41/12/77/1132411277.db2.gz HINYDLZUIBCMOD-DVOMOZLQSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)C(C)(C)C ZINC001173215741 1132411409 /nfs/dbraw/zinc/41/14/09/1132411409.db2.gz ZBVRFRMDAFHESF-RYUDHWBXSA-N 1 0 264.369 3.550 20 5 CHBDRO CC(C)[N@H+](CC1CC1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173228474 1132412828 /nfs/dbraw/zinc/41/28/28/1132412828.db2.gz XIQKDAIRTKLURD-ZDUSSCGKSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[C@@H](C)CC1 ZINC001173232763 1132413695 /nfs/dbraw/zinc/41/36/95/1132413695.db2.gz FYXUJCJVPFZYHP-YDHLFZDLSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC001173231568 1132413889 /nfs/dbraw/zinc/41/38/89/1132413889.db2.gz ATQIUBYSANVXBI-QWHCGFSZSA-N 1 0 276.380 3.694 20 5 CHBDRO Cc1ccsc1C[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173211200 1132416822 /nfs/dbraw/zinc/41/68/22/1132416822.db2.gz RBDFTROMWZPLAO-LBPRGKRZSA-N 1 0 290.388 3.686 20 5 CHBDRO Nc1cc(Nc2c(Cl)ccc([N+](=O)[O-])c2Cl)cc[nH+]1 ZINC001159114363 1132808171 /nfs/dbraw/zinc/80/81/71/1132808171.db2.gz WHNNZWADSCHZMX-UHFFFAOYSA-N 1 0 299.117 3.622 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1ccc(C2([NH3+])CCC2)cc1 ZINC001159729213 1132900440 /nfs/dbraw/zinc/90/04/40/1132900440.db2.gz CAPMHPWWTBHPPL-UHFFFAOYSA-N 1 0 297.358 3.985 20 5 CHBDRO CC[NH2+]Cc1cccc(Nc2cccc([N+](=O)[O-])c2F)c1 ZINC001159955949 1132928339 /nfs/dbraw/zinc/92/83/39/1132928339.db2.gz ARPLRNFZTBXOAG-UHFFFAOYSA-N 1 0 289.310 3.587 20 5 CHBDRO [NH3+][C@H]1CCCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC001204878161 1133495048 /nfs/dbraw/zinc/49/50/48/1133495048.db2.gz ZHSCIESTKGCUTA-KRWDZBQOSA-N 1 0 290.410 3.916 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@@H](C3CC3)[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001205875829 1133625716 /nfs/dbraw/zinc/62/57/16/1133625716.db2.gz PNHOAPBNFIKFGD-DOTOQJQBSA-N 1 0 286.375 3.524 20 5 CHBDRO Cc1cc(Nc2cccc([N+](=O)[O-])c2F)c2ccccc2[nH+]1 ZINC001210378536 1134203849 /nfs/dbraw/zinc/20/38/49/1134203849.db2.gz JAUNOENMSGJGQZ-UHFFFAOYSA-N 1 0 297.289 3.756 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2CO[C@H]1CC[NH2+]C1 ZINC001217824290 1135005127 /nfs/dbraw/zinc/00/51/27/1135005127.db2.gz PJZBOXOSDSOQAL-INIZCTEOSA-N 1 0 277.367 3.872 20 5 CHBDRO C[C@@H]1[NH2+]C[C@@H]1OCc1c2ccccc2cc2ccccc21 ZINC001217905620 1135021273 /nfs/dbraw/zinc/02/12/73/1135021273.db2.gz AIDNLYLAJPTRBU-DJJJIMSYSA-N 1 0 277.367 3.870 20 5 CHBDRO C[C@@H]1C[C@H](Oc2c3ccccc3c(O)c3ccccc32)C[NH2+]1 ZINC001218046864 1135049415 /nfs/dbraw/zinc/04/94/15/1135049415.db2.gz XTEDFWMFBMBSAS-OLZOCXBDSA-N 1 0 293.366 3.828 20 5 CHBDRO C[C@@H]1C[C@@H](Oc2nc3ccccc3c3ccccc32)CC[NH2+]1 ZINC001218056852 1135051174 /nfs/dbraw/zinc/05/11/74/1135051174.db2.gz PQSYBPAKQVGDQX-KGLIPLIRSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@@H]1CC[C@@H](Oc2cccc3ccc4cccnc4c32)C[NH2+]1 ZINC001218399380 1135099756 /nfs/dbraw/zinc/09/97/56/1135099756.db2.gz PQYCIXSSVHKXIV-CZUORRHYSA-N 1 0 292.382 3.907 20 5 CHBDRO c1ccc2c(c1)nc(O[C@H]1[C@@H]3CC[C@H]1[NH2+]C3)c1ccccc21 ZINC001218440892 1135106199 /nfs/dbraw/zinc/10/61/99/1135106199.db2.gz BDZJNPPEATZNHL-PJSAGSTRSA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@H](C[N@H+](C)Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000309861900 1135118797 /nfs/dbraw/zinc/11/87/97/1135118797.db2.gz DMCCYKBOIWOJOW-CQSZACIVSA-N 1 0 299.374 3.527 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OC(c1ccccc1)c1ccccc1 ZINC001223323033 1135328472 /nfs/dbraw/zinc/32/84/72/1135328472.db2.gz ZGVWLLQCFSWYKM-MRXNPFEDSA-N 1 0 284.423 3.887 20 5 CHBDRO CC[C@@H](C)c1ccc(O[C@H](C)C[N+](C)(C)C)cc1 ZINC001227329895 1135822545 /nfs/dbraw/zinc/82/25/45/1135822545.db2.gz MZWYJDUXKPPALQ-ZIAGYGMSSA-N 1 0 250.406 3.674 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(-c2ccccc2)cc1 ZINC001227409681 1135829778 /nfs/dbraw/zinc/82/97/78/1135829778.db2.gz MRGPWOMGZPDINO-OAHLLOKOSA-N 1 0 270.396 3.827 20 5 CHBDRO CSc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])s1 ZINC000352830363 532958246 /nfs/dbraw/zinc/95/82/46/532958246.db2.gz AFCXBUPJBWQQNP-UHFFFAOYSA-N 1 0 294.401 3.668 20 5 CHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C[NH+](C)C ZINC000301332052 533557359 /nfs/dbraw/zinc/55/73/59/533557359.db2.gz DZSLKXMKHZNRQI-SNVBAGLBSA-N 1 0 299.802 3.636 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000020087096 170988344 /nfs/dbraw/zinc/98/83/44/170988344.db2.gz CRSCAGLHLRPKGG-NEPJUHHUSA-N 1 0 250.342 3.742 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000020526190 171239249 /nfs/dbraw/zinc/23/92/49/171239249.db2.gz FGYWSWCBXUQDGC-MLGOLLRUSA-N 1 0 282.343 3.933 20 5 CHBDRO CCC[NH+]1CCC(Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000035014103 171931196 /nfs/dbraw/zinc/93/11/96/171931196.db2.gz GGJDAJQOYAIYBB-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO CC(C)CCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000038093571 174107714 /nfs/dbraw/zinc/10/77/14/174107714.db2.gz TYGNQQSMPVJXPZ-LBPRGKRZSA-N 1 0 250.342 3.682 20 5 CHBDRO COC1CCC([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000346446336 225801211 /nfs/dbraw/zinc/80/12/11/225801211.db2.gz LSUIOIJWBQOMSG-GRTSSRMGSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](C)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000480666432 228048499 /nfs/dbraw/zinc/04/84/99/228048499.db2.gz ZYWSSKLVLLOUIJ-WCBMZHEXSA-N 1 0 290.285 3.752 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2CC23CC3)o1 ZINC000418104719 228052306 /nfs/dbraw/zinc/05/23/06/228052306.db2.gz XKTDIKCYOFZMMT-LBPRGKRZSA-N 1 0 298.342 3.745 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CC(C)(C)C)cc1[N+](=O)[O-] ZINC000179408641 260047376 /nfs/dbraw/zinc/04/73/76/260047376.db2.gz IOFPRUZEQGPKAG-LLVKDONJSA-N 1 0 280.368 3.690 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000037176960 260072638 /nfs/dbraw/zinc/07/26/38/260072638.db2.gz LRSPYMRJGPDNOF-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO Cc1cc(NCCCCF)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000312636346 260185885 /nfs/dbraw/zinc/18/58/85/260185885.db2.gz WQHCENVLAHYZTJ-UHFFFAOYSA-N 1 0 277.299 3.613 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC000090217585 260240015 /nfs/dbraw/zinc/24/00/15/260240015.db2.gz HYWNFSHSRLNHTQ-NEPJUHHUSA-N 1 0 262.353 3.742 20 5 CHBDRO CSC(C)(C)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000132401094 260497624 /nfs/dbraw/zinc/49/76/24/260497624.db2.gz RLJSHFQHVDONIQ-LLVKDONJSA-N 1 0 282.409 3.695 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)o1 ZINC000044729823 260647980 /nfs/dbraw/zinc/64/79/80/260647980.db2.gz VUKYBTQJLPHEEY-LBPRGKRZSA-N 1 0 288.347 3.964 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000152367467 261063508 /nfs/dbraw/zinc/06/35/08/261063508.db2.gz ISVZQQVBVYSFPF-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@@H](CCc1ccccc1)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000020138546 262231273 /nfs/dbraw/zinc/23/12/73/262231273.db2.gz ADAWFOIBVUPAQE-AWEZNQCLSA-N 1 0 284.359 3.706 20 5 CHBDRO CSCCCCC[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000185161483 262303113 /nfs/dbraw/zinc/30/31/13/262303113.db2.gz KCHFAAHRQMAURT-UHFFFAOYSA-N 1 0 282.409 3.526 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCCC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000390899376 262359853 /nfs/dbraw/zinc/35/98/53/262359853.db2.gz GHNUEXXTXNLDNV-PWSUYJOCSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1F ZINC000414296599 262838371 /nfs/dbraw/zinc/83/83/71/262838371.db2.gz YDIKUISNJKJZAT-NWANDNLSSA-N 1 0 294.370 3.786 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000155811223 263016425 /nfs/dbraw/zinc/01/64/25/263016425.db2.gz WONKOLAWUZWOQD-MNOVXSKESA-N 1 0 289.310 3.541 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000280756436 263064137 /nfs/dbraw/zinc/06/41/37/263064137.db2.gz CEUCLJYDCWKKHB-QWRGUYRKSA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)cccc1[N+](=O)[O-] ZINC000187846466 263270658 /nfs/dbraw/zinc/27/06/58/263270658.db2.gz ZCXXXPPAINWCPN-CHWSQXEVSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC12CCCC2)c1ccccc1[N+](=O)[O-] ZINC000474042306 263653380 /nfs/dbraw/zinc/65/33/80/263653380.db2.gz DKINFOVNNLEIEP-WFASDCNBSA-N 1 0 274.364 3.968 20 5 CHBDRO CSC[C@H](C)[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417307193 263794317 /nfs/dbraw/zinc/79/43/17/263794317.db2.gz GTPPRIRFMNHMNC-XHDPSFHLSA-N 1 0 294.420 3.703 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cccnc1)CCCC2 ZINC000417305672 263794398 /nfs/dbraw/zinc/79/43/98/263794398.db2.gz WZNZMVVCOIEUPW-QGZVFWFLSA-N 1 0 297.358 3.547 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000330695810 264005473 /nfs/dbraw/zinc/00/54/73/264005473.db2.gz DFGUSUJVFWNWPY-BXUZGUMPSA-N 1 0 292.379 3.592 20 5 CHBDRO CC[C@H](C)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000054467631 264338790 /nfs/dbraw/zinc/33/87/90/264338790.db2.gz CRSRAHNNLCUZPG-JQWIXIFHSA-N 1 0 250.342 3.600 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000094321449 265237349 /nfs/dbraw/zinc/23/73/49/265237349.db2.gz BSNHDCKWOLLJQD-BXUZGUMPSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccsc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000094879755 265268584 /nfs/dbraw/zinc/26/85/84/265268584.db2.gz ZNJYKUQXEARHJB-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO CC[C@@H]([NH2+]CCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000303461319 267671474 /nfs/dbraw/zinc/67/14/74/267671474.db2.gz FYBPYDYSSHHKNM-OAHLLOKOSA-N 1 0 299.374 3.748 20 5 CHBDRO CCC[C@H](C[NH2+][C@@H](CCC)c1cccc([N+](=O)[O-])c1)OC ZINC000378842755 327760454 /nfs/dbraw/zinc/76/04/54/327760454.db2.gz PYTOXEUKHMBPDY-CVEARBPZSA-N 1 0 294.395 3.841 20 5 CHBDRO C[C@@H]([NH2+]C1CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000020020585 327881773 /nfs/dbraw/zinc/88/17/73/327881773.db2.gz UOBIHGIFFCMJFQ-GFCCVEGCSA-N 1 0 262.353 3.968 20 5 CHBDRO CC(C)CC[C@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000040675905 328015532 /nfs/dbraw/zinc/01/55/32/328015532.db2.gz WBUVXMPONLHIAR-ZDUSSCGKSA-N 1 0 264.369 3.552 20 5 CHBDRO CC(C)CC[C@@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000040675904 328015539 /nfs/dbraw/zinc/01/55/39/328015539.db2.gz WBUVXMPONLHIAR-CYBMUJFWSA-N 1 0 264.369 3.552 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccncc1 ZINC000563419478 328063771 /nfs/dbraw/zinc/06/37/71/328063771.db2.gz WRAZVCBAYIDEKZ-CVEARBPZSA-N 1 0 297.358 3.718 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000048408878 328308568 /nfs/dbraw/zinc/30/85/68/328308568.db2.gz PBRJCKVAQLOWEI-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO CCCC(C)(C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000111387225 328353770 /nfs/dbraw/zinc/35/37/70/328353770.db2.gz BISKDMYGGVQHLG-UHFFFAOYSA-N 1 0 250.342 3.572 20 5 CHBDRO C[C@H](Cc1ccsc1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000049156018 328350871 /nfs/dbraw/zinc/35/08/71/328350871.db2.gz BKAHGWRHTHAKNB-VXGBXAGGSA-N 1 0 290.388 3.938 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000070305858 328592371 /nfs/dbraw/zinc/59/23/71/328592371.db2.gz PHVALFVUPBCNMO-NWDGAFQWSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000070306978 328593724 /nfs/dbraw/zinc/59/37/24/328593724.db2.gz BJOBVDRNWHUCLQ-SNVBAGLBSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1cccc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)c1 ZINC000537950359 326850525 /nfs/dbraw/zinc/85/05/25/326850525.db2.gz UEEWXTKAILVOGJ-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@@H](CCC1CC1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000398232960 326875906 /nfs/dbraw/zinc/87/59/06/326875906.db2.gz UIYDYZJXNVOUHE-RYUDHWBXSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCCC1(F)F ZINC000560351036 327302163 /nfs/dbraw/zinc/30/21/63/327302163.db2.gz DATXZYZZWVYZJO-VXGBXAGGSA-N 1 0 298.333 3.989 20 5 CHBDRO C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000561411330 327393219 /nfs/dbraw/zinc/39/32/19/327393219.db2.gz GMCMBCZWTSJDFW-TXNVCOODSA-N 1 0 296.317 3.585 20 5 CHBDRO C[C@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000561411329 327393227 /nfs/dbraw/zinc/39/32/27/327393227.db2.gz GMCMBCZWTSJDFW-RNZFLTOJSA-N 1 0 296.317 3.585 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCSC(C)C)cccc1[N+](=O)[O-] ZINC000562066654 327446105 /nfs/dbraw/zinc/44/61/05/327446105.db2.gz WVYBULGDYYYNHA-LBPRGKRZSA-N 1 0 282.409 3.695 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCCC[C@H]2C2CC2)cc1 ZINC000507463136 332807195 /nfs/dbraw/zinc/80/71/95/332807195.db2.gz RDFSBPABNJYCBM-IRXDYDNUSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000300306488 332812391 /nfs/dbraw/zinc/81/23/91/332812391.db2.gz GSPMXODWJGTFBA-MBNYWOFBSA-N 1 0 262.353 3.682 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C2CC2)C2CCC2)cccc1[N+](=O)[O-] ZINC000325026208 328816909 /nfs/dbraw/zinc/81/69/09/328816909.db2.gz KJZBEKXMYFVYSI-MRXNPFEDSA-N 1 0 274.364 3.572 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C(C2CCC2)C2CCC2)cs1 ZINC000325049085 328818147 /nfs/dbraw/zinc/81/81/47/328818147.db2.gz OTVOHYGSMNJDQJ-UHFFFAOYSA-N 1 0 280.393 3.715 20 5 CHBDRO CC[C@H]([NH2+][C@@H](CC)[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000181743218 329236196 /nfs/dbraw/zinc/23/61/96/329236196.db2.gz JSHPTOIXFZQDJX-JYJNAYRXSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCSCC(C)C)cc1[N+](=O)[O-] ZINC000397344108 329350840 /nfs/dbraw/zinc/35/08/40/329350840.db2.gz XDJRRHQMDCHLCT-CYBMUJFWSA-N 1 0 296.436 3.943 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1C[C@H]1C ZINC000321713803 329393251 /nfs/dbraw/zinc/39/32/51/329393251.db2.gz VQQIVOGQCCWIIR-FIXIBIHLSA-N 1 0 262.353 3.680 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000086642423 332877072 /nfs/dbraw/zinc/87/70/72/332877072.db2.gz ACIGBTROTWDJJA-UHFFFAOYSA-N 1 0 256.371 3.715 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000421376215 329816645 /nfs/dbraw/zinc/81/66/45/329816645.db2.gz IZYIQFMDCGVEBB-OLZOCXBDSA-N 1 0 264.369 3.552 20 5 CHBDRO Cc1cc(N)cc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000423478743 330206012 /nfs/dbraw/zinc/20/60/12/330206012.db2.gz LGAHYSFJPRLWAM-ZDUSSCGKSA-N 1 0 299.374 3.645 20 5 CHBDRO CC(C)c1ccc(C[NH+]2[C@@H](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000527238786 330240698 /nfs/dbraw/zinc/24/06/98/330240698.db2.gz VQDGSMRFOFYDEX-RYUDHWBXSA-N 1 0 262.353 3.701 20 5 CHBDRO Cc1c(C[NH2+]Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000035648836 330248453 /nfs/dbraw/zinc/24/84/53/330248453.db2.gz XMYBBFNHJMYWCO-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO CC1(C)C[C@@H]1C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000536865791 330253725 /nfs/dbraw/zinc/25/37/25/330253725.db2.gz WUPLNNZSQQFHGF-HUUCEWRRSA-N 1 0 288.391 3.552 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000536870729 330263954 /nfs/dbraw/zinc/26/39/54/330263954.db2.gz PLKWMXKLVDJUKJ-WCFLWFBJSA-N 1 0 264.369 3.988 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000424145916 330292100 /nfs/dbraw/zinc/29/21/00/330292100.db2.gz VUTDYJAESLCDRX-PJODQICGSA-N 1 0 274.364 3.682 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000036878823 330310290 /nfs/dbraw/zinc/31/02/90/330310290.db2.gz SGUNCOARFZFMRU-MRXNPFEDSA-N 1 0 282.343 3.680 20 5 CHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000123138838 330446231 /nfs/dbraw/zinc/44/62/31/330446231.db2.gz VLVAQAJOBINXLN-INWMFGNUSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccccc1[N+](=O)[O-] ZINC000429795845 330555030 /nfs/dbraw/zinc/55/50/30/330555030.db2.gz ZTOXBWUCNRWPRL-GHMZBOCLSA-N 1 0 284.306 3.681 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)cc1 ZINC000435787925 330663031 /nfs/dbraw/zinc/66/30/31/330663031.db2.gz BFEQDUPCCNUQRP-WKILWMFISA-N 1 0 282.343 3.631 20 5 CHBDRO Cc1cccc(CC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449113427 330899820 /nfs/dbraw/zinc/89/98/20/330899820.db2.gz VXYVQAIDOULNTK-HNNXBMFYSA-N 1 0 298.386 3.667 20 5 CHBDRO CC/C=C/C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000449464647 330927804 /nfs/dbraw/zinc/92/78/04/330927804.db2.gz YNKWEPVTBRMWTK-ODPUXILVSA-N 1 0 260.337 3.554 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000449739436 330947542 /nfs/dbraw/zinc/94/75/42/330947542.db2.gz AHRAHFQXNQKFQD-XENLGGRHSA-N 1 0 286.375 3.634 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H]1CCC12CCCC2 ZINC000451459132 331030295 /nfs/dbraw/zinc/03/02/95/331030295.db2.gz PVDATOGXEJDLAB-AWEZNQCLSA-N 1 0 278.327 3.546 20 5 CHBDRO CC[C@@H](F)C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543737 331033614 /nfs/dbraw/zinc/03/36/14/331033614.db2.gz CJRZNEFMMCGMPM-ZIAGYGMSSA-N 1 0 280.343 3.522 20 5 CHBDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000163405177 331034679 /nfs/dbraw/zinc/03/46/79/331034679.db2.gz XEYKPBRRUYZCBM-SNVBAGLBSA-N 1 0 290.285 3.806 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000195586187 331178237 /nfs/dbraw/zinc/17/82/37/331178237.db2.gz VWWSOQQKFIMKBV-BZPMIXESSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+]C1CC2(CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000459455989 331282153 /nfs/dbraw/zinc/28/21/53/331282153.db2.gz DLTVRLCNYYSZOQ-LLVKDONJSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459753342 331298507 /nfs/dbraw/zinc/29/85/07/331298507.db2.gz IXUAMFVRXHDKKV-UKMLZYKCSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@]1([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC=CCC1 ZINC000459753292 331298513 /nfs/dbraw/zinc/29/85/13/331298513.db2.gz LXSLCQGRPOPVFL-MNDMWVCDSA-N 1 0 272.348 3.696 20 5 CHBDRO C=Cc1ccc(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000462914704 331334983 /nfs/dbraw/zinc/33/49/83/331334983.db2.gz UVOMRRLGVGFNMP-UHFFFAOYSA-N 1 0 282.343 3.570 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCC1=CCCCCC1 ZINC000463700286 331350722 /nfs/dbraw/zinc/35/07/22/331350722.db2.gz VBNRIIVYVYRYKG-UHFFFAOYSA-N 1 0 274.364 3.965 20 5 CHBDRO CC/C=C/CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000466218652 331391016 /nfs/dbraw/zinc/39/10/16/331391016.db2.gz OGHCKEBNBCYYGX-ONEGZZNKSA-N 1 0 274.364 3.916 20 5 CHBDRO CC/C=C\CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000466218651 331391028 /nfs/dbraw/zinc/39/10/28/331391028.db2.gz OGHCKEBNBCYYGX-ARJAWSKDSA-N 1 0 274.364 3.916 20 5 CHBDRO CC1(C)CCC[C@@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510764978 332916229 /nfs/dbraw/zinc/91/62/29/332916229.db2.gz NQXMWQIERJFKNS-ZDUSSCGKSA-N 1 0 284.306 3.541 20 5 CHBDRO CC(C)=CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000480289620 331766427 /nfs/dbraw/zinc/76/64/27/331766427.db2.gz UTWWKMDXWVFUSZ-UHFFFAOYSA-N 1 0 286.331 3.911 20 5 CHBDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CS1 ZINC000488447818 332009849 /nfs/dbraw/zinc/00/98/49/332009849.db2.gz XUFMIGYYXFTNOQ-ZOWXZIJZSA-N 1 0 294.420 3.776 20 5 CHBDRO CC[C@@H]1CC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490010396 332076602 /nfs/dbraw/zinc/07/66/02/332076602.db2.gz BCSNTBOEMISIJV-QWHCGFSZSA-N 1 0 262.353 3.696 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490087504 332080813 /nfs/dbraw/zinc/08/08/13/332080813.db2.gz JETSUOFGPUVACL-CYBMUJFWSA-N 1 0 292.379 3.616 20 5 CHBDRO CC(C)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491328988 332191671 /nfs/dbraw/zinc/19/16/71/332191671.db2.gz KJFZSJXOLFIOSO-QGZVFWFLSA-N 1 0 284.359 3.930 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC2CC(F)(F)C2)cc1[N+](=O)[O-] ZINC000491599163 332242314 /nfs/dbraw/zinc/24/23/14/332242314.db2.gz ONOGUHRMCWFVHH-UHFFFAOYSA-N 1 0 298.333 3.853 20 5 CHBDRO CCOc1cc(C[NH+]2[C@@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492789006 332413636 /nfs/dbraw/zinc/41/36/36/332413636.db2.gz KCUBHLLCROAKCE-STQMWFEESA-N 1 0 292.379 3.756 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC1(F)CCC1 ZINC000575495520 335106214 /nfs/dbraw/zinc/10/62/14/335106214.db2.gz PAICVXQKBFLPRS-RAXLEYEMSA-N 1 0 292.354 3.870 20 5 CHBDRO CC(C)C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C(C)C ZINC000311862328 333073753 /nfs/dbraw/zinc/07/37/53/333073753.db2.gz KJNNEPRERLSCCZ-UHFFFAOYSA-N 1 0 268.332 3.600 20 5 CHBDRO Cc1c(C[N@H+]2CCCC[C@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000516994720 333089196 /nfs/dbraw/zinc/08/91/96/333089196.db2.gz TYJJRILJHLEZLK-HNNXBMFYSA-N 1 0 276.380 3.914 20 5 CHBDRO CCC[C@@H]([NH2+]CC(C)(C)COC)c1cccc([N+](=O)[O-])c1 ZINC000336848684 335121049 /nfs/dbraw/zinc/12/10/49/335121049.db2.gz MDHFIHXCPNYIRT-OAHLLOKOSA-N 1 0 294.395 3.698 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3[C@@H]4CCC[C@@H]43)o2)c1 ZINC000521069319 333110929 /nfs/dbraw/zinc/11/09/29/333110929.db2.gz GMOVKOPXBYEZMJ-SCAQPMJSSA-N 1 0 298.342 3.743 20 5 CHBDRO CC[N@H+](CC1CC1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182782650 333117611 /nfs/dbraw/zinc/11/76/11/333117611.db2.gz KJLCBLRIHUMLCY-LBPRGKRZSA-N 1 0 262.353 3.696 20 5 CHBDRO CCC[C@@H]([NH2+]CC1(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000222170904 333176255 /nfs/dbraw/zinc/17/62/55/333176255.db2.gz DKSOAJSZVZJDNY-CQSZACIVSA-N 1 0 262.353 3.826 20 5 CHBDRO COc1ccc(C[NH2+]CCCC2CCCC2)cc1[N+](=O)[O-] ZINC000223448366 333208058 /nfs/dbraw/zinc/20/80/58/333208058.db2.gz NUFKELBNIQFDJZ-UHFFFAOYSA-N 1 0 292.379 3.663 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000522299725 333280743 /nfs/dbraw/zinc/28/07/43/333280743.db2.gz SOIBNXQNXMPKGV-OAHLLOKOSA-N 1 0 276.380 3.853 20 5 CHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000522418961 333286723 /nfs/dbraw/zinc/28/67/23/333286723.db2.gz VZDSXMYEIIKKTH-PBHICJAKSA-N 1 0 296.370 3.973 20 5 CHBDRO CC(C)[C@H](C)[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523841153 333347695 /nfs/dbraw/zinc/34/76/95/333347695.db2.gz OPEJOOKXMAGDLK-JTQLQIEISA-N 1 0 270.760 3.725 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000235590026 333371142 /nfs/dbraw/zinc/37/11/42/333371142.db2.gz AETRCJZLBPWIMM-WFASDCNBSA-N 1 0 276.380 3.552 20 5 CHBDRO CC1CCC(C)([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000236662652 333374455 /nfs/dbraw/zinc/37/44/55/333374455.db2.gz WQSVANOXQXACPL-UHFFFAOYSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000525989571 333417379 /nfs/dbraw/zinc/41/73/79/333417379.db2.gz MNNKODDOIWKBMI-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCC(C)(C)C)cc1[N+](=O)[O-] ZINC000129612377 333781966 /nfs/dbraw/zinc/78/19/66/333781966.db2.gz BMZNZQLAUAHPKW-LBPRGKRZSA-N 1 0 264.369 3.990 20 5 CHBDRO C[C@@H]([NH2+]CCCCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000130403395 333841253 /nfs/dbraw/zinc/84/12/53/333841253.db2.gz PJTIOEUCPXNVQR-SNVBAGLBSA-N 1 0 290.285 3.978 20 5 CHBDRO CCC(CC)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000130708993 333868073 /nfs/dbraw/zinc/86/80/73/333868073.db2.gz WVMARLOIUUSMSZ-GFCCVEGCSA-N 1 0 264.369 3.990 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]([C@@H](C)C1CC1)C1CC1 ZINC000546705346 334047126 /nfs/dbraw/zinc/04/71/26/334047126.db2.gz QRMAFDOMHDMKRC-LBPRGKRZSA-N 1 0 274.364 3.666 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1Cc2ccccc2C1 ZINC000547278794 334075564 /nfs/dbraw/zinc/07/55/64/334075564.db2.gz CUTROOOWGABSCB-CYBMUJFWSA-N 1 0 296.370 3.721 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H](c1ccccc1)C1CC1 ZINC000548066852 334137988 /nfs/dbraw/zinc/13/79/88/334137988.db2.gz KWKWOLBEQPVDRJ-GOSISDBHSA-N 1 0 296.370 3.878 20 5 CHBDRO Cc1ccc(C[N@H+]2CCCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000548587379 334163033 /nfs/dbraw/zinc/16/30/33/334163033.db2.gz IWAGTLCTKPTFRV-CYBMUJFWSA-N 1 0 262.353 3.668 20 5 CHBDRO CC1(C)CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000079979031 334164866 /nfs/dbraw/zinc/16/48/66/334164866.db2.gz SNPNUMYJAQXKCL-ZDUSSCGKSA-N 1 0 262.353 3.653 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H](C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000081046045 334177311 /nfs/dbraw/zinc/17/73/11/334177311.db2.gz ZLPUPJNCKNGHHS-SWLSCSKDSA-N 1 0 264.369 3.928 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CSC2(C)C)cc1[N+](=O)[O-] ZINC000548989019 334182040 /nfs/dbraw/zinc/18/20/40/334182040.db2.gz FHTZDRWQECDIIF-CQSZACIVSA-N 1 0 294.420 3.702 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000245596519 334205757 /nfs/dbraw/zinc/20/57/57/334205757.db2.gz NEMQKOXEYWOOIC-ZMJPVWNMSA-N 1 0 292.379 3.510 20 5 CHBDRO C[C@H](F)CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000551258123 334243238 /nfs/dbraw/zinc/24/32/38/334243238.db2.gz DJAHWFPINQOEBL-IINYFYTJSA-N 1 0 280.343 3.655 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](COC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000086695560 334315222 /nfs/dbraw/zinc/31/52/22/334315222.db2.gz OMCBUVRUDJFGHL-HOTGVXAUSA-N 1 0 294.395 3.697 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CC=CCC1)C1CC1 ZINC000090035856 334355970 /nfs/dbraw/zinc/35/59/70/334355970.db2.gz LQJCRDXBLZMDRJ-HOTGVXAUSA-N 1 0 286.375 3.614 20 5 CHBDRO C[NH+](C)CCSc1c(Cl)cc(Cl)cc1[N+](=O)[O-] ZINC000553111400 334361972 /nfs/dbraw/zinc/36/19/72/334361972.db2.gz JCPFCNSYMWIHTE-UHFFFAOYSA-N 1 0 295.191 3.555 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000554363863 334424805 /nfs/dbraw/zinc/42/48/05/334424805.db2.gz OFLSFNTXIDQSJS-KBPBESRZSA-N 1 0 276.380 3.552 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCCC(F)(F)F ZINC000566475974 334651397 /nfs/dbraw/zinc/65/13/97/334651397.db2.gz RKHYHSHTLPUWSV-NSHDSACASA-N 1 0 288.269 3.514 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000567269585 334699776 /nfs/dbraw/zinc/69/97/76/334699776.db2.gz NNEPDTRZSMIGDL-YUTCNCBUSA-N 1 0 280.343 3.835 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C(C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000157545360 334774691 /nfs/dbraw/zinc/77/46/91/334774691.db2.gz SMJWQOVPYSOAJT-LLVKDONJSA-N 1 0 274.364 3.742 20 5 CHBDRO C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)(C)C ZINC000580673507 335320494 /nfs/dbraw/zinc/32/04/94/335320494.db2.gz WXCSDABNEVCBMU-NSHDSACASA-N 1 0 289.379 3.643 20 5 CHBDRO C[C@H](CNc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000347322338 335376038 /nfs/dbraw/zinc/37/60/38/335376038.db2.gz VETXKVNNKAKASI-CQSZACIVSA-N 1 0 299.374 3.527 20 5 CHBDRO CC1(C)CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000380932526 336039960 /nfs/dbraw/zinc/03/99/60/336039960.db2.gz OQUJYGIRMMZEHJ-LBPRGKRZSA-N 1 0 280.343 3.792 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC000381551534 336068168 /nfs/dbraw/zinc/06/81/68/336068168.db2.gz GBAZZQBFOCYDMQ-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO CC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1CCCC1 ZINC000382771630 336096774 /nfs/dbraw/zinc/09/67/74/336096774.db2.gz LWSSAIYOFOAOGL-LBPRGKRZSA-N 1 0 268.382 3.715 20 5 CHBDRO C[C@@H](CC(C)(C)C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000384490770 336124880 /nfs/dbraw/zinc/12/48/80/336124880.db2.gz KUOFPVAACFVEAE-VIFPVBQESA-N 1 0 256.371 3.571 20 5 CHBDRO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000353664063 534074309 /nfs/dbraw/zinc/07/43/09/534074309.db2.gz FQXJDRUBFASGTF-CYBMUJFWSA-N 1 0 282.343 3.542 20 5 CHBDRO CO[C@]1(C)CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000280495957 521752085 /nfs/dbraw/zinc/75/20/85/521752085.db2.gz MOKFQNORUOMEGB-XJKSGUPXSA-N 1 0 292.379 3.547 20 5 CHBDRO CC[C@H]([NH2+]CCc1cccc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000280016715 522600719 /nfs/dbraw/zinc/60/07/19/522600719.db2.gz HCEIHTUYPLHABH-KRWDZBQOSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC000037668430 524582200 /nfs/dbraw/zinc/58/22/00/524582200.db2.gz ZNJBNZKQLHSWCM-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293245154 525360966 /nfs/dbraw/zinc/36/09/66/525360966.db2.gz BHHRPGRDTDHECD-CHWSQXEVSA-N 1 0 299.374 3.897 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000062726614 525462344 /nfs/dbraw/zinc/46/23/44/525462344.db2.gz ACNIMBXTNBJTMS-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(O)c1 ZINC000037150780 525612342 /nfs/dbraw/zinc/61/23/42/525612342.db2.gz CWRNCZCYWZLQNP-NWDGAFQWSA-N 1 0 286.331 3.712 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@@H](C)C2CCC2)cccc1[N+](=O)[O-] ZINC000357026896 525702659 /nfs/dbraw/zinc/70/26/59/525702659.db2.gz RGKJTOXVLOVTAO-LBPRGKRZSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CCCS2)cc1[N+](=O)[O-] ZINC000122050319 525730795 /nfs/dbraw/zinc/73/07/95/525730795.db2.gz IVLVYQIXNICSDB-DOMZBBRYSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000271941511 525921431 /nfs/dbraw/zinc/92/14/31/525921431.db2.gz UGRSRUKOZFMXOK-HEHGZKQESA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])s1 ZINC000049158849 525929904 /nfs/dbraw/zinc/92/99/04/525929904.db2.gz JSQPXKAICHKXHD-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCCC(F)(F)F)c1 ZINC000097988917 527356188 /nfs/dbraw/zinc/35/61/88/527356188.db2.gz CFTRSCZQJRUZEY-UHFFFAOYSA-N 1 0 296.676 3.680 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCCc3sccc32)c1 ZINC000061329422 527387158 /nfs/dbraw/zinc/38/71/58/527387158.db2.gz HYKCHJCLEFNGQY-CQSZACIVSA-N 1 0 288.372 3.824 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CC[C@@H](F)C2)c2cc([N+](=O)[O-])ccc21 ZINC000331636478 527747357 /nfs/dbraw/zinc/74/73/57/527747357.db2.gz SJCHWJGXQIMIDY-HFAKWTLXSA-N 1 0 292.354 3.797 20 5 CHBDRO CCCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000301332049 528464010 /nfs/dbraw/zinc/46/40/10/528464010.db2.gz BQDKJDPFROFGNT-UHFFFAOYSA-N 1 0 291.395 3.580 20 5 CHBDRO C[C@@H](CCc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000013726097 567942080 /nfs/dbraw/zinc/94/20/80/567942080.db2.gz NFIKIFDXHCHXMU-AWEZNQCLSA-N 1 0 284.359 3.706 20 5 CHBDRO CCSCCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000502574336 1122114212 /nfs/dbraw/zinc/11/42/12/1122114212.db2.gz ICXNGZQPYNACTA-LBPRGKRZSA-N 1 0 282.409 3.697 20 5 CHBDRO CCCCCC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC001194683344 1122791166 /nfs/dbraw/zinc/79/11/66/1122791166.db2.gz NRKVKRWYTDFZTF-UHFFFAOYSA-N 1 0 264.369 4.000 20 5 CHBDRO CC(F)(F)CCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000295929884 1125181384 /nfs/dbraw/zinc/18/13/84/1125181384.db2.gz FQEDBTBDXVPHNP-UHFFFAOYSA-N 1 0 292.713 3.773 20 5 CHBDRO CCC(C)(C)C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000428544339 1125314293 /nfs/dbraw/zinc/31/42/93/1125314293.db2.gz XUBGZIZYTNVPRW-CLFYSBASSA-N 1 0 262.353 3.634 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])c(C)s1 ZINC000886107484 1125650288 /nfs/dbraw/zinc/65/02/88/1125650288.db2.gz SIRBBJGPLHBQEA-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000886540831 1125687221 /nfs/dbraw/zinc/68/72/21/1125687221.db2.gz LNABQOLEXMUDMI-XJKSGUPXSA-N 1 0 297.358 3.573 20 5 CHBDRO CO[C@H]1CCC[C@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000886650166 1125702701 /nfs/dbraw/zinc/70/27/01/1125702701.db2.gz QRWVRCZBWNDYOC-RDBSUJKOSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000090035849 1125737906 /nfs/dbraw/zinc/73/79/06/1125737906.db2.gz SMJVUIZKBWUZND-STQMWFEESA-N 1 0 260.337 3.663 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OC(Cl)(Cl)c1ccc(F)cc1 ZINC001223924538 1125779638 /nfs/dbraw/zinc/77/96/38/1125779638.db2.gz VTHAJUVLJHFHPT-JTQLQIEISA-N 1 0 295.205 3.525 20 5 CHBDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000121989831 1125782317 /nfs/dbraw/zinc/78/23/17/1125782317.db2.gz XYANAXZWLQOXEY-AAEUAGOBSA-N 1 0 294.395 3.757 20 5 CHBDRO CCCC[C@H](CCC)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819133747 1131232898 /nfs/dbraw/zinc/23/28/98/1131232898.db2.gz CDRPJPJFQFOFOP-GOEBONIOSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1ccc(C[N@H+]2CCCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000482304836 1126750302 /nfs/dbraw/zinc/75/03/02/1126750302.db2.gz BCBPXTZLYSDICF-GFCCVEGCSA-N 1 0 262.353 3.525 20 5 CHBDRO CC1=C(C)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000482458724 1126757571 /nfs/dbraw/zinc/75/75/71/1126757571.db2.gz MMCFREWQODZHPC-FNORWQNLSA-N 1 0 272.348 3.650 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(F)F)CC1 ZINC000483549440 1126793103 /nfs/dbraw/zinc/79/31/03/1126793103.db2.gz YEMPXHHWDUNNGB-JTQLQIEISA-N 1 0 284.306 3.633 20 5 CHBDRO O=[N+]([O-])c1ccccc1COc1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC000905618363 1126909568 /nfs/dbraw/zinc/90/95/68/1126909568.db2.gz XKFBNOZQQOXDEL-INIZCTEOSA-N 1 0 298.342 3.598 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C2CCCC2)cc(C(F)(F)F)c1 ZINC000487152723 1127019820 /nfs/dbraw/zinc/01/98/20/1127019820.db2.gz JEISDKHIMDTYMU-UHFFFAOYSA-N 1 0 288.269 3.646 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000487235834 1127026806 /nfs/dbraw/zinc/02/68/06/1127026806.db2.gz UYCMCJMQXOEEIX-CYBMUJFWSA-N 1 0 282.343 3.714 20 5 CHBDRO CC[C@H](C)C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000487291786 1127030232 /nfs/dbraw/zinc/03/02/32/1127030232.db2.gz RZMRUPQBBCPLQX-RYUDHWBXSA-N 1 0 250.342 3.634 20 5 CHBDRO Cc1cncc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000274360534 1127114598 /nfs/dbraw/zinc/11/45/98/1127114598.db2.gz IFPPIXHECATJFA-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284153633 1127176469 /nfs/dbraw/zinc/17/64/69/1127176469.db2.gz PMEIUYNGMLDSHX-BDJLRTHQSA-N 1 0 297.358 3.515 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000588977944 1127209154 /nfs/dbraw/zinc/20/91/54/1127209154.db2.gz DZMAALWBHWEIQM-GXTWGEPZSA-N 1 0 274.364 3.778 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000589209387 1127216239 /nfs/dbraw/zinc/21/62/39/1127216239.db2.gz KXHRHBVMMGDYNU-GIZXNFQBSA-N 1 0 286.375 3.730 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH+]1CCOCC1 ZINC000224536912 1127267613 /nfs/dbraw/zinc/26/76/13/1127267613.db2.gz UPZOENOTRXYHCJ-UHFFFAOYSA-N 1 0 277.367 3.825 20 5 CHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C3CCCC3)C2)cc1 ZINC000590757613 1127270445 /nfs/dbraw/zinc/27/04/45/1127270445.db2.gz ILJTXMPVDCKLJO-AWEZNQCLSA-N 1 0 274.364 3.717 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2c3ccccc3O[C@H]2C)cc1[N+](=O)[O-] ZINC000288574745 1127348400 /nfs/dbraw/zinc/34/84/00/1127348400.db2.gz NIIPCCVUXFFHEH-YVEFUNNKSA-N 1 0 298.342 3.515 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](C)CC(F)F)cccc1[N+](=O)[O-] ZINC000592392417 1127344288 /nfs/dbraw/zinc/34/42/88/1127344288.db2.gz SPBOBISJYHCXHR-MWLCHTKSSA-N 1 0 286.322 3.845 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H](C)CC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000592392233 1127344454 /nfs/dbraw/zinc/34/44/54/1127344454.db2.gz JCDCTBDUEVWOGP-ZWNOBZJWSA-N 1 0 286.322 3.927 20 5 CHBDRO C[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)CC(F)F ZINC000592392222 1127344556 /nfs/dbraw/zinc/34/45/56/1127344556.db2.gz IUNBSYISDLBDAL-HZMBPMFUSA-N 1 0 298.333 3.853 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)CC(F)F ZINC000592392404 1127344737 /nfs/dbraw/zinc/34/47/37/1127344737.db2.gz QWHREDLBXSYXDY-MWLCHTKSSA-N 1 0 286.322 3.845 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCS[C@@H]2C)cc1[N+](=O)[O-] ZINC000592379125 1127345850 /nfs/dbraw/zinc/34/58/50/1127345850.db2.gz HIEQVVRNDIEGSE-RISCZKNCSA-N 1 0 294.420 3.702 20 5 CHBDRO CCc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000225787717 1127351472 /nfs/dbraw/zinc/35/14/72/1127351472.db2.gz UIPGKZQMEQJWNS-UHFFFAOYSA-N 1 0 290.388 3.817 20 5 CHBDRO C[C@@H]([NH2+]CC1CCC(F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000592401572 1127376213 /nfs/dbraw/zinc/37/62/13/1127376213.db2.gz YSNUQBSFSXMLLH-LKSINWNRSA-N 1 0 280.343 3.774 20 5 CHBDRO C[C@H]([NH2+]CC1CCC(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000592399009 1127372836 /nfs/dbraw/zinc/37/28/36/1127372836.db2.gz LLRCKGCUPAKAIY-DCBWTQNWSA-N 1 0 280.343 3.774 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000592396584 1127374312 /nfs/dbraw/zinc/37/43/12/1127374312.db2.gz BPTJRADHWHXWQW-SYAUCNOPSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000358366235 1127417658 /nfs/dbraw/zinc/41/76/58/1127417658.db2.gz KDWNTMFNGPOUTF-PXAZEXFGSA-N 1 0 297.358 3.792 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H]1Cc2ccccc21 ZINC000594493906 1127418442 /nfs/dbraw/zinc/41/84/42/1127418442.db2.gz AMLDXSLTFDKGBA-DYVFJYSZSA-N 1 0 294.354 3.512 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000594511319 1127420493 /nfs/dbraw/zinc/42/04/93/1127420493.db2.gz FTAKRJOYBMSPTR-IJLUTSLNSA-N 1 0 280.393 3.530 20 5 CHBDRO CCc1ccc(C)[nH+]c1NCc1ccc([N+](=O)[O-])cc1F ZINC000594743534 1127431124 /nfs/dbraw/zinc/43/11/24/1127431124.db2.gz QRUVTYBTBIPRAP-UHFFFAOYSA-N 1 0 289.310 3.612 20 5 CHBDRO CCC(C)(C)[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000594970547 1127437582 /nfs/dbraw/zinc/43/75/82/1127437582.db2.gz XKEJYLPELBIVHH-VIFPVBQESA-N 1 0 256.371 3.571 20 5 CHBDRO CC[C@](C)([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000594979312 1127438315 /nfs/dbraw/zinc/43/83/15/1127438315.db2.gz JDEGPIBMTOHDQX-BVBGJJFLSA-N 1 0 274.364 3.776 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC2(C(F)F)CC2)cc1[N+](=O)[O-] ZINC000359001987 1127443468 /nfs/dbraw/zinc/44/34/68/1127443468.db2.gz NNYHZQKMDVGEKL-SNVBAGLBSA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000595050181 1127451056 /nfs/dbraw/zinc/45/10/56/1127451056.db2.gz QSDOMJJEYNUKBQ-KGLIPLIRSA-N 1 0 299.374 3.753 20 5 CHBDRO CCSC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000595101505 1127452409 /nfs/dbraw/zinc/45/24/09/1127452409.db2.gz VSYUKIJKHPATCJ-LLVKDONJSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCC(C)(C)F)cc1[N+](=O)[O-] ZINC000595083957 1127453564 /nfs/dbraw/zinc/45/35/64/1127453564.db2.gz GTRYRYUPQVIXNN-NSHDSACASA-N 1 0 268.332 3.692 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)cc1[N+](=O)[O-] ZINC000595095005 1127455536 /nfs/dbraw/zinc/45/55/36/1127455536.db2.gz SNBSGQRRBXBVAH-MFKMUULPSA-N 1 0 298.333 3.845 20 5 CHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000359293441 1127456836 /nfs/dbraw/zinc/45/68/36/1127456836.db2.gz FLEHWNOBCZSDNQ-CJNGLKHVSA-N 1 0 274.364 3.607 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])C(C)(C)C ZINC000595290176 1127457097 /nfs/dbraw/zinc/45/70/97/1127457097.db2.gz JAQNJGQHRHIHGB-SNVBAGLBSA-N 1 0 268.332 3.600 20 5 CHBDRO C[C@H]([N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])C(C)(C)C ZINC000595290175 1127457615 /nfs/dbraw/zinc/45/76/15/1127457615.db2.gz JAQNJGQHRHIHGB-JTQLQIEISA-N 1 0 268.332 3.600 20 5 CHBDRO CC[C@@H](C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])CC(F)F ZINC000595423311 1127462250 /nfs/dbraw/zinc/46/22/50/1127462250.db2.gz NFJHIDPSRXAJST-WDEREUQCSA-N 1 0 286.322 3.927 20 5 CHBDRO CCN(Cc1occc1C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595544143 1127466490 /nfs/dbraw/zinc/46/64/90/1127466490.db2.gz LYPFMHPOXNZSIE-UHFFFAOYSA-N 1 0 292.310 3.657 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)C1CCC(F)CC1 ZINC000595817664 1127475820 /nfs/dbraw/zinc/47/58/20/1127475820.db2.gz AUZFNDIKSYYTOE-LRVUVFPRSA-N 1 0 294.370 3.644 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000059971461 1127483269 /nfs/dbraw/zinc/48/32/69/1127483269.db2.gz WQLFYZODIHCJTQ-DYVFJYSZSA-N 1 0 296.370 3.803 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)cc1 ZINC000360702283 1127507009 /nfs/dbraw/zinc/50/70/09/1127507009.db2.gz IKFVTKAETGIOOC-UHFFFAOYSA-N 1 0 294.354 3.642 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1cccc(N)c1)c1cccc([N+](=O)[O-])c1 ZINC000596650989 1127514964 /nfs/dbraw/zinc/51/49/64/1127514964.db2.gz NFHSXYNGDNFKIC-QGZVFWFLSA-N 1 0 299.374 3.808 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000293807232 1127522558 /nfs/dbraw/zinc/52/25/58/1127522558.db2.gz RIUIKOXVSRUYSA-BLLLJJGKSA-N 1 0 299.374 3.979 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000597074978 1127527441 /nfs/dbraw/zinc/52/74/41/1127527441.db2.gz IAMXLXFCWSNAAF-KWCYVHTRSA-N 1 0 294.782 3.569 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@H+]([C@@H]1C[C@H]1c1ccccc1)CC2 ZINC000361314806 1127556089 /nfs/dbraw/zinc/55/60/89/1127556089.db2.gz SLCOROYBYXIPIY-ZWKOTPCHSA-N 1 0 294.354 3.509 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@H+]([C@H]1C[C@@H]1c1ccccc1)CC2 ZINC000361314803 1127556452 /nfs/dbraw/zinc/55/64/52/1127556452.db2.gz SLCOROYBYXIPIY-MSOLQXFVSA-N 1 0 294.354 3.509 20 5 CHBDRO CC[C@@H](C)C[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602559561 1127593176 /nfs/dbraw/zinc/59/31/76/1127593176.db2.gz FIUBBRQNSHKXJP-GHMZBOCLSA-N 1 0 291.351 3.650 20 5 CHBDRO C[C@@H]1CC[C@H]1[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602651886 1127600536 /nfs/dbraw/zinc/60/05/36/1127600536.db2.gz AEVDWYOWZAOVHF-LDYMZIIASA-N 1 0 288.269 3.502 20 5 CHBDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602708332 1127607903 /nfs/dbraw/zinc/60/79/03/1127607903.db2.gz DCWLZRUXAFBUPA-SNVBAGLBSA-N 1 0 291.351 3.650 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(CF)CC1 ZINC000295050748 1127616563 /nfs/dbraw/zinc/61/65/63/1127616563.db2.gz BJGIGBUCXSPFLL-LBPRGKRZSA-N 1 0 280.343 3.646 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@H]1CC1(F)F ZINC000598648750 1127630467 /nfs/dbraw/zinc/63/04/67/1127630467.db2.gz SAWQREYZOLKUGA-LWMSPQMPSA-N 1 0 296.317 3.633 20 5 CHBDRO CC[C@H]([NH2+]CC[C@H]1CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000598678922 1127631110 /nfs/dbraw/zinc/63/11/10/1127631110.db2.gz AVBIMNYIQPENKZ-AAEUAGOBSA-N 1 0 284.306 3.681 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(c3ccccc3)CC2)c1 ZINC000603442018 1127647523 /nfs/dbraw/zinc/64/75/23/1127647523.db2.gz QKUDHVOMWXEMOU-UHFFFAOYSA-N 1 0 296.370 3.974 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccn2)C2CCC2)cc1 ZINC000598992954 1127650556 /nfs/dbraw/zinc/65/05/56/1127650556.db2.gz FAEBGHSWVFKUTR-KRWDZBQOSA-N 1 0 297.358 3.621 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000599060166 1127653623 /nfs/dbraw/zinc/65/36/23/1127653623.db2.gz TXSLFLDKYUDKCD-GRYCIOLGSA-N 1 0 298.333 3.879 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C)C(F)(F)[C@H](C)C1 ZINC000599060167 1127653878 /nfs/dbraw/zinc/65/38/78/1127653878.db2.gz TXSLFLDKYUDKCD-IJLUTSLNSA-N 1 0 298.333 3.879 20 5 CHBDRO CCC[C@@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)OCC ZINC000599061678 1127654416 /nfs/dbraw/zinc/65/44/16/1127654416.db2.gz QZLXHBVTCMYNLG-HIFRSBDPSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000599084048 1127656006 /nfs/dbraw/zinc/65/60/06/1127656006.db2.gz QVQDCKSXMWIRPQ-OEYIWLLWSA-N 1 0 274.364 3.682 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000603582123 1127660347 /nfs/dbraw/zinc/66/03/47/1127660347.db2.gz UMHVGIFGUIUMGN-OCCSQVGLSA-N 1 0 292.379 3.614 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000603582121 1127660579 /nfs/dbraw/zinc/66/05/79/1127660579.db2.gz UMHVGIFGUIUMGN-GXTWGEPZSA-N 1 0 292.379 3.614 20 5 CHBDRO CCC(CC)C[N@H+](CC)Cc1cccc([N+](=O)[O-])c1 ZINC000603849650 1127675900 /nfs/dbraw/zinc/67/59/00/1127675900.db2.gz MYKSMQAUTOACJB-UHFFFAOYSA-N 1 0 264.369 3.853 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC(F)(F)CC1 ZINC000599552065 1127679981 /nfs/dbraw/zinc/67/99/81/1127679981.db2.gz UTXQJNCUNWKCDB-NSHDSACASA-N 1 0 284.306 3.777 20 5 CHBDRO C[C@H]1CC[C@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000230417777 1127752836 /nfs/dbraw/zinc/75/28/36/1127752836.db2.gz QXAQJMFPQQRXDS-QWRGUYRKSA-N 1 0 282.771 3.774 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000374007185 1127870679 /nfs/dbraw/zinc/87/06/79/1127870679.db2.gz CJWZFJSKXIVTJV-JSGCOSHPSA-N 1 0 286.331 3.738 20 5 CHBDRO Cc1ccc(C[N@@H+]2C[C@@H](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000539824825 1127940686 /nfs/dbraw/zinc/94/06/86/1127940686.db2.gz LGHUFINXMASNRK-AAEUAGOBSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)CC(C)C ZINC000540151622 1127964285 /nfs/dbraw/zinc/96/42/85/1127964285.db2.gz SPASVZFZKOFIMD-QWHCGFSZSA-N 1 0 264.369 3.988 20 5 CHBDRO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000544612065 1127979418 /nfs/dbraw/zinc/97/94/18/1127979418.db2.gz XCLWUGLXMADCNQ-FZMZJTMJSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000468044375 1127989671 /nfs/dbraw/zinc/98/96/71/1127989671.db2.gz HLKREVCOIUKOLK-WPRPVWTQSA-N 1 0 290.285 3.895 20 5 CHBDRO CC[C@@]1(C)CC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468138133 1127994794 /nfs/dbraw/zinc/99/47/94/1127994794.db2.gz KHUBSAJGCZYWAD-WFASDCNBSA-N 1 0 262.353 3.778 20 5 CHBDRO CS[C@H]1CCCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468258103 1128000626 /nfs/dbraw/zinc/00/06/26/1128000626.db2.gz AVGHYVXOISAXKT-STQMWFEESA-N 1 0 294.420 3.873 20 5 CHBDRO COc1ccc(C[N@H+](C)[C@H]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000468409056 1128007164 /nfs/dbraw/zinc/00/71/64/1128007164.db2.gz RGYCBMFHTNKNCU-ZDUSSCGKSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H]([NH2+]CCCc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000541205731 1128011037 /nfs/dbraw/zinc/01/10/37/1128011037.db2.gz OIOCKTCZWVSDQT-GFCCVEGCSA-N 1 0 290.388 3.940 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccccc1 ZINC000468635930 1128014308 /nfs/dbraw/zinc/01/43/08/1128014308.db2.gz VIENGEKFRGMDAI-NTCAYCPXSA-N 1 0 296.370 3.830 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000541553681 1128027532 /nfs/dbraw/zinc/02/75/32/1128027532.db2.gz SRLLOJUMYOZPDA-OCOPJHETSA-N 1 0 286.375 3.896 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](C)C1 ZINC000470175903 1128064891 /nfs/dbraw/zinc/06/48/91/1128064891.db2.gz TUGRBAIGFWBRIG-OZYJXZHSSA-N 1 0 274.364 3.730 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094801057 1128080005 /nfs/dbraw/zinc/08/00/05/1128080005.db2.gz OKMFXDSIHSWEJK-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C2CC2)C1 ZINC000492785037 1128113014 /nfs/dbraw/zinc/11/30/14/1128113014.db2.gz RWKPQAQALHQXDJ-JSGCOSHPSA-N 1 0 274.364 3.696 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC(C)(C)C ZINC000761505961 1128132376 /nfs/dbraw/zinc/13/23/76/1128132376.db2.gz JMLZVJHSLMFEFD-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCC2CC2)cc1Cl ZINC000761524297 1128132537 /nfs/dbraw/zinc/13/25/37/1128132537.db2.gz AWBXSQFYSLSPFC-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO CC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761528330 1128133884 /nfs/dbraw/zinc/13/38/84/1128133884.db2.gz QQAFXVASARCYKD-AAEUAGOBSA-N 1 0 282.771 3.917 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000324187806 1128136089 /nfs/dbraw/zinc/13/60/89/1128136089.db2.gz YODVRDLPJPRBQR-IAQYHMDHSA-N 1 0 262.353 3.680 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@H](C)C2 ZINC000493246583 1128137151 /nfs/dbraw/zinc/13/71/51/1128137151.db2.gz IMZXAGJEONQWJJ-ACJLOTCBSA-N 1 0 296.370 3.926 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2sccc2Cl)cc1 ZINC000193086525 1128210794 /nfs/dbraw/zinc/21/07/94/1128210794.db2.gz CSEVMLKBWQSDHO-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000495439674 1128284364 /nfs/dbraw/zinc/28/43/64/1128284364.db2.gz MTWJONHAQAEYDZ-SNVBAGLBSA-N 1 0 284.787 3.815 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1CF)c1ccccc1[N+](=O)[O-] ZINC000930235272 1128310485 /nfs/dbraw/zinc/31/04/85/1128310485.db2.gz LJHCNAVXUXGIKM-GFCCVEGCSA-N 1 0 288.322 3.915 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000487967782 1128312398 /nfs/dbraw/zinc/31/23/98/1128312398.db2.gz DETYEFKYJSLLEO-XQQFMLRXSA-N 1 0 262.353 3.634 20 5 CHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000915685331 1128334207 /nfs/dbraw/zinc/33/42/07/1128334207.db2.gz VEFPDVRKNMDXGB-SMDDNHRTSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000916152115 1128409702 /nfs/dbraw/zinc/40/97/02/1128409702.db2.gz NKILBOYLNKXRFI-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO CCC(C)(C)C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000763387730 1128430722 /nfs/dbraw/zinc/43/07/22/1128430722.db2.gz JXEFQEIGOBODJZ-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO CC1CCC([N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000917013566 1128467959 /nfs/dbraw/zinc/46/79/59/1128467959.db2.gz HAXQSBNSVWUKSY-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO COc1cc(C[NH2+][C@H](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000563776995 1128478202 /nfs/dbraw/zinc/47/82/02/1128478202.db2.gz FOJGPUKMWWLLTR-GFCCVEGCSA-N 1 0 292.379 3.662 20 5 CHBDRO CC1(C)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000565984234 1128536450 /nfs/dbraw/zinc/53/64/50/1128536450.db2.gz SPRWGVDLRFMWLV-BIENSFFJSA-N 1 0 286.375 3.728 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(CC)CC ZINC000609288150 1128578452 /nfs/dbraw/zinc/57/84/52/1128578452.db2.gz BSLDNSXBOHOIDY-UHFFFAOYSA-N 1 0 280.368 3.519 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Cl)s2)cc1 ZINC000037500177 1128584344 /nfs/dbraw/zinc/58/43/44/1128584344.db2.gz OUGHRJBBHQFQIJ-UHFFFAOYSA-N 1 0 282.752 3.600 20 5 CHBDRO COC1([C@@H](C)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCC1 ZINC000570300937 1128620568 /nfs/dbraw/zinc/62/05/68/1128620568.db2.gz MPOHEDZROSHLJG-QWHCGFSZSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1sccc1C[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000557032376 1128660960 /nfs/dbraw/zinc/66/09/60/1128660960.db2.gz MCXMQDPBSAYRCR-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO CC(C)[NH2+]Cc1cccc(-c2ccc([N+](=O)[O-])cc2)c1 ZINC000600787026 1128681073 /nfs/dbraw/zinc/68/10/73/1128681073.db2.gz XBSXAWZDZFKWQY-UHFFFAOYSA-N 1 0 270.332 3.760 20 5 CHBDRO Cc1ccc(-c2cccc([C@H]3CC[NH2+]C3)c2)cc1[N+](=O)[O-] ZINC000600790279 1128681903 /nfs/dbraw/zinc/68/19/03/1128681903.db2.gz IUSYPYANHMCMNK-INIZCTEOSA-N 1 0 282.343 3.647 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCc3sccc3C2)cc1 ZINC000609322827 1128698100 /nfs/dbraw/zinc/69/81/00/1128698100.db2.gz MTTICYJPMOUZLQ-UHFFFAOYSA-N 1 0 288.372 3.605 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000601305176 1128709145 /nfs/dbraw/zinc/70/91/45/1128709145.db2.gz VZVQDZJBNVCDNH-MRXNPFEDSA-N 1 0 286.331 3.663 20 5 CHBDRO CCCCC[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000036721075 1117746119 /nfs/dbraw/zinc/74/61/19/1117746119.db2.gz STAXNHLCHLKXKS-CQSZACIVSA-N 1 0 250.342 3.826 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)C[C@H]1C ZINC000610133399 1128739560 /nfs/dbraw/zinc/73/95/60/1128739560.db2.gz MJQCNADJFPAFHX-CHWSQXEVSA-N 1 0 292.379 3.612 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](CC1CCC1)C(C)C ZINC000430243207 1117911235 /nfs/dbraw/zinc/91/12/35/1117911235.db2.gz UOGMLXRTOCFIQN-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000444747534 1117918685 /nfs/dbraw/zinc/91/86/85/1117918685.db2.gz AIBXRNUGZAZSFJ-OAHLLOKOSA-N 1 0 276.380 3.505 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000336807772 1117938713 /nfs/dbraw/zinc/93/87/13/1117938713.db2.gz ABVUWFXYVBFTEE-UGFHNGPFSA-N 1 0 262.353 3.824 20 5 CHBDRO CC1=C[C@@H](C)C[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000430280759 1117989616 /nfs/dbraw/zinc/98/96/16/1117989616.db2.gz YCORPJFFMDXTRF-YPMHNXCESA-N 1 0 260.337 3.554 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)Cc1ccco1 ZINC000764774208 1118113236 /nfs/dbraw/zinc/11/32/36/1118113236.db2.gz NWNWVNCPTPSJSL-STQMWFEESA-N 1 0 288.347 3.778 20 5 CHBDRO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccs1 ZINC000801539728 1128758725 /nfs/dbraw/zinc/75/87/25/1128758725.db2.gz OCMMJBVSPOVKDF-UHFFFAOYSA-N 1 0 294.351 3.820 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000340525758 1118317087 /nfs/dbraw/zinc/31/70/87/1118317087.db2.gz XTXYKZYFLFXBQM-HZSPNIEDSA-N 1 0 266.316 3.526 20 5 CHBDRO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1CCCC1 ZINC000110512635 1118347344 /nfs/dbraw/zinc/34/73/44/1118347344.db2.gz DNVUUGVJVRGMSV-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000610420449 1118420263 /nfs/dbraw/zinc/42/02/63/1118420263.db2.gz KDVHHHJJEAJWPB-ZDUSSCGKSA-N 1 0 299.374 3.512 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000286950738 1118679223 /nfs/dbraw/zinc/67/92/23/1118679223.db2.gz HJOMUKOSYOLTTE-WFASDCNBSA-N 1 0 294.420 3.779 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000430884418 1118783144 /nfs/dbraw/zinc/78/31/44/1118783144.db2.gz WOVIVUADSIDVHU-MGMWDDNKSA-N 1 0 286.375 3.896 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000430884415 1118783504 /nfs/dbraw/zinc/78/35/04/1118783504.db2.gz WOVIVUADSIDVHU-ATDKOCKZSA-N 1 0 286.375 3.896 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000132468842 1118851181 /nfs/dbraw/zinc/85/11/81/1118851181.db2.gz HNCBMWXYZWEPOZ-TZMCWYRMSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1Cc2ccccc21 ZINC000610810583 1118894326 /nfs/dbraw/zinc/89/43/26/1118894326.db2.gz CVCVBEYXAIBSBS-DZGCQCFKSA-N 1 0 296.370 3.894 20 5 CHBDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000610811052 1118894706 /nfs/dbraw/zinc/89/47/06/1118894706.db2.gz BBQKWVSSDUJHKV-GOSISDBHSA-N 1 0 296.370 3.723 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000610830977 1118898452 /nfs/dbraw/zinc/89/84/52/1118898452.db2.gz SUTYGKDHYFTHKJ-KGLIPLIRSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1cccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511067255 1119002521 /nfs/dbraw/zinc/00/25/21/1119002521.db2.gz ULMIKXSQPWRHKT-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000540055016 1119024823 /nfs/dbraw/zinc/02/48/23/1119024823.db2.gz AUJZCXUHJYUXAD-RISCZKNCSA-N 1 0 262.353 3.666 20 5 CHBDRO Cc1c(C[N@@H+](CC(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000051735416 1119104729 /nfs/dbraw/zinc/10/47/29/1119104729.db2.gz DCMOBJHUKWPUAN-UHFFFAOYSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1c(C[N@@H+](Cc2ccccn2)C(C)C)cccc1[N+](=O)[O-] ZINC000052218531 1119326241 /nfs/dbraw/zinc/32/62/41/1119326241.db2.gz KWBSLGVVPLWXBM-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCCC1(C)C ZINC000094325754 1128840205 /nfs/dbraw/zinc/84/02/05/1128840205.db2.gz UQAVGJVKDMTDJK-HNNXBMFYSA-N 1 0 292.379 3.662 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCCc2occc21 ZINC000584063065 1119469633 /nfs/dbraw/zinc/46/96/33/1119469633.db2.gz GTKQWDIJGGCKEK-CABCVRRESA-N 1 0 298.342 3.842 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000219697480 1119510933 /nfs/dbraw/zinc/51/09/33/1119510933.db2.gz FINOUWLVCUQVAS-WFASDCNBSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H]([NH2+]CCC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000061839543 1119656937 /nfs/dbraw/zinc/65/69/37/1119656937.db2.gz YPTZZKFYSHHNST-LLVKDONJSA-N 1 0 250.342 3.682 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580240075 1119874526 /nfs/dbraw/zinc/87/45/26/1119874526.db2.gz BFMYYOQJNXVENO-NWDGAFQWSA-N 1 0 289.379 3.643 20 5 CHBDRO C[C@@H](CC1CCC1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000613515300 1119964094 /nfs/dbraw/zinc/96/40/94/1119964094.db2.gz TXNVCAXDDCSIQO-JTQLQIEISA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccccc2)CC1 ZINC000273393381 1120111192 /nfs/dbraw/zinc/11/11/92/1120111192.db2.gz KJJUZWRWZGJBAX-UHFFFAOYSA-N 1 0 282.343 3.682 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000273437282 1120116421 /nfs/dbraw/zinc/11/64/21/1120116421.db2.gz MFXKXVRFWXARKV-MRXNPFEDSA-N 1 0 285.347 3.568 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)c1ccccc1 ZINC000542702508 1120123328 /nfs/dbraw/zinc/12/33/28/1120123328.db2.gz XXUVSEVYDZWJEE-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO CN(CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542927456 1120254951 /nfs/dbraw/zinc/25/49/51/1120254951.db2.gz JBORMICDNUCMOY-UHFFFAOYSA-N 1 0 296.676 3.632 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC000113310575 1120318528 /nfs/dbraw/zinc/31/85/28/1120318528.db2.gz VSOYMHVBYDUSOP-QGZVFWFLSA-N 1 0 282.343 3.680 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCCSC2)cc1[N+](=O)[O-] ZINC000330686106 1120329516 /nfs/dbraw/zinc/32/95/16/1120329516.db2.gz SFWQDAJQMBAUJX-ZDUSSCGKSA-N 1 0 294.420 3.703 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H]1CC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000417340145 1120428366 /nfs/dbraw/zinc/42/83/66/1120428366.db2.gz ACKFVKLNWGLSBP-ZFWWWQNUSA-N 1 0 274.364 3.826 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]C[C@H]2CC23CC3)c2cc([N+](=O)[O-])ccc21 ZINC000417334024 1120430278 /nfs/dbraw/zinc/43/02/78/1120430278.db2.gz GQOCTVDSKWDRFP-IAQYHMDHSA-N 1 0 286.375 3.707 20 5 CHBDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC(C)C ZINC000417358522 1120435463 /nfs/dbraw/zinc/43/54/63/1120435463.db2.gz HZHZXVWWNNAWOE-ZFWWWQNUSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000053422362 1120495470 /nfs/dbraw/zinc/49/54/70/1120495470.db2.gz PFFMAAJDSWBYGE-LBPRGKRZSA-N 1 0 288.322 3.927 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000070306572 1120529989 /nfs/dbraw/zinc/52/99/89/1120529989.db2.gz SEPVEEJVHFFBKF-GFCCVEGCSA-N 1 0 262.353 3.572 20 5 CHBDRO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000466934917 1120567942 /nfs/dbraw/zinc/56/79/42/1120567942.db2.gz GRNQDRVIWPZKIE-GXFFZTMASA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000500369147 1120598416 /nfs/dbraw/zinc/59/84/16/1120598416.db2.gz GJVNZPVOLKNABR-ZDUSSCGKSA-N 1 0 298.333 3.818 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2CC(c3ccccc3)C2)cc1 ZINC000568535697 1120949163 /nfs/dbraw/zinc/94/91/63/1120949163.db2.gz IVVMWJHMVRWOTL-UHFFFAOYSA-N 1 0 296.370 3.878 20 5 CHBDRO Cc1cc(NCc2ccco2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000228440612 1121027525 /nfs/dbraw/zinc/02/75/25/1121027525.db2.gz VSLSVAWBXGGGNP-UHFFFAOYSA-N 1 0 283.287 3.657 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2CCCSCC2)cc1[N+](=O)[O-] ZINC000357225641 1121053190 /nfs/dbraw/zinc/05/31/90/1121053190.db2.gz AIWUAMZERSRIDA-UHFFFAOYSA-N 1 0 294.420 3.657 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]C1CCC(C(F)F)CC1 ZINC000282513847 1121057792 /nfs/dbraw/zinc/05/77/92/1121057792.db2.gz ZEDPMJOWSFRDPA-UHFFFAOYSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCC2(C)CC2)cccc1[N+](=O)[O-] ZINC000359008338 1121063756 /nfs/dbraw/zinc/06/37/56/1121063756.db2.gz WRQZVQUPULRRAL-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO Cc1ccc(C[N@H+]2CC3(CCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000432789116 1121350812 /nfs/dbraw/zinc/35/08/12/1121350812.db2.gz PMNWMWWOGKUKGW-CYBMUJFWSA-N 1 0 274.364 3.668 20 5 CHBDRO CC[C@@H]([NH2+]CC[C@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000704774871 1121368097 /nfs/dbraw/zinc/36/80/97/1121368097.db2.gz ZYUBZMPCAHWNTD-SWLSCSKDSA-N 1 0 294.420 3.779 20 5 CHBDRO OCC1(C[NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000238172740 1121399302 /nfs/dbraw/zinc/39/93/02/1121399302.db2.gz CGNRVXQOTYMRKN-UHFFFAOYSA-N 1 0 291.394 3.855 20 5 CHBDRO CC/C=C\CC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429259042 1121485794 /nfs/dbraw/zinc/48/57/94/1121485794.db2.gz SNTKGESVXOIUAY-WAYWQWQTSA-N 1 0 262.353 3.776 20 5 CHBDRO CC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H](C)C(C)C ZINC000509295198 1121518864 /nfs/dbraw/zinc/51/88/64/1121518864.db2.gz UHCPGYAEQMYZDR-JTQLQIEISA-N 1 0 286.322 3.739 20 5 CHBDRO CCSCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543631615 1121538309 /nfs/dbraw/zinc/53/83/09/1121538309.db2.gz MHOFOSWDQHUPHA-CYBMUJFWSA-N 1 0 296.436 3.867 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000433145185 1121594802 /nfs/dbraw/zinc/59/48/02/1121594802.db2.gz FVJWLCMYYWPASW-BONVTDFDSA-N 1 0 274.364 3.705 20 5 CHBDRO CCC[C@H](C)[NH2+][C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000611248319 1121632673 /nfs/dbraw/zinc/63/26/73/1121632673.db2.gz RSHNUAPFPTZGIL-RYUDHWBXSA-N 1 0 280.368 3.833 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000611248255 1121632714 /nfs/dbraw/zinc/63/27/14/1121632714.db2.gz ZTORTDQRXXYLCP-NEPJUHHUSA-N 1 0 292.379 3.690 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)CC2 ZINC000611439173 1121647736 /nfs/dbraw/zinc/64/77/36/1121647736.db2.gz IMVYFGBQLUSNOC-CQSZACIVSA-N 1 0 288.372 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCC(F)(F)C1 ZINC000611475828 1121651135 /nfs/dbraw/zinc/65/11/35/1121651135.db2.gz JLRNTNAIJUZBJV-GHMZBOCLSA-N 1 0 284.306 3.742 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC(F)(F)C1 ZINC000611475904 1121651531 /nfs/dbraw/zinc/65/15/31/1121651531.db2.gz PHPUFOITOBHNMH-WCQYABFASA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC(F)(F)C1 ZINC000611475903 1121651641 /nfs/dbraw/zinc/65/16/41/1121651641.db2.gz PHPUFOITOBHNMH-DGCLKSJQSA-N 1 0 298.333 3.693 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CCOC(C)(C)C ZINC000611516522 1121653993 /nfs/dbraw/zinc/65/39/93/1121653993.db2.gz OPJNZHWQIOILQP-CYBMUJFWSA-N 1 0 294.395 3.711 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000052333638 1121703524 /nfs/dbraw/zinc/70/35/24/1121703524.db2.gz VKXPMXASRLOLLB-ZDUSSCGKSA-N 1 0 276.380 3.962 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000037770576 1129008884 /nfs/dbraw/zinc/00/88/84/1129008884.db2.gz QQGSWWRZPMYRAA-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1c(C[NH2+]CC[C@@H]2CCCC2(F)F)cccc1[N+](=O)[O-] ZINC001179443305 1121877683 /nfs/dbraw/zinc/87/76/83/1121877683.db2.gz OCNGORMMMFOHDY-ZDUSSCGKSA-N 1 0 298.333 3.818 20 5 CHBDRO Cc1cc(C)cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000501775562 1122008359 /nfs/dbraw/zinc/00/83/59/1122008359.db2.gz MEVKIBRFZOYPGJ-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO CSCC[C@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774198462 1122139356 /nfs/dbraw/zinc/13/93/56/1122139356.db2.gz BDMRZZUVNDABCK-XHDPSFHLSA-N 1 0 294.420 3.703 20 5 CHBDRO CCC(CC)[C@@H](CNc1cc(C)ccc1[N+](=O)[O-])[NH+](C)C ZINC001184740499 1122295323 /nfs/dbraw/zinc/29/53/23/1122295323.db2.gz QREIRYYAZWKMLP-MRXNPFEDSA-N 1 0 293.411 3.682 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CCC(C)C)cc1[N+](=O)[O-] ZINC000504919571 1122310392 /nfs/dbraw/zinc/31/03/92/1122310392.db2.gz LHZMHIWKMUFLLT-LBPRGKRZSA-N 1 0 280.368 3.690 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(Nc2ccc(CC[NH+](C)C)cc2)c1 ZINC001185272165 1122330754 /nfs/dbraw/zinc/33/07/54/1122330754.db2.gz DZYSMLJFFWMDRK-UHFFFAOYSA-N 1 0 299.374 3.751 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CC(C)(C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000434754619 1122409648 /nfs/dbraw/zinc/40/96/48/1122409648.db2.gz GKLVNFIZQSNVFV-YPMHNXCESA-N 1 0 292.379 3.518 20 5 CHBDRO CCCCC[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000775178320 1122467422 /nfs/dbraw/zinc/46/74/22/1122467422.db2.gz GBUKJNIRJLCGDD-NSHDSACASA-N 1 0 290.367 3.530 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@@H](C)C1 ZINC000437044204 1122606577 /nfs/dbraw/zinc/60/65/77/1122606577.db2.gz LEZLCPZIOFNTQM-IPYPFGDCSA-N 1 0 276.380 3.694 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000437049692 1122607237 /nfs/dbraw/zinc/60/72/37/1122607237.db2.gz YPJBRPSSYJVHAQ-OBJOEFQTSA-N 1 0 292.379 3.833 20 5 CHBDRO C[C@H]([N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-])C1(C)CC1 ZINC000437532844 1122639092 /nfs/dbraw/zinc/63/90/92/1122639092.db2.gz DIKSUOWXGVEMSY-JTQLQIEISA-N 1 0 282.771 3.869 20 5 CHBDRO CC1(C)CCCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000438367824 1122694701 /nfs/dbraw/zinc/69/47/01/1122694701.db2.gz PJXMCZUNSDBASG-UHFFFAOYSA-N 1 0 268.382 3.668 20 5 CHBDRO Cc1ccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC001193742728 1122712317 /nfs/dbraw/zinc/71/23/17/1122712317.db2.gz FIECBWRHXJOMHY-UHFFFAOYSA-N 1 0 298.386 3.886 20 5 CHBDRO C[C@H]1CC[C@@H]([N@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429600741 1122726852 /nfs/dbraw/zinc/72/68/52/1122726852.db2.gz WTRKEGVAQLQQQM-WDEREUQCSA-N 1 0 282.771 3.869 20 5 CHBDRO CC(C)C[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000506495046 1122756942 /nfs/dbraw/zinc/75/69/42/1122756942.db2.gz IMTCLDCSJVHSNJ-UHFFFAOYSA-N 1 0 288.347 3.943 20 5 CHBDRO CCCC[C@@H](C)[N@H+](CCCC)Cc1cn(C)nc1[N+](=O)[O-] ZINC001194570515 1122784524 /nfs/dbraw/zinc/78/45/24/1122784524.db2.gz KIPDMHIMENVJFK-CYBMUJFWSA-N 1 0 296.415 3.509 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426524698 1122812314 /nfs/dbraw/zinc/81/23/14/1122812314.db2.gz PNQPWWYAGKGMAB-GWCFXTLKSA-N 1 0 280.755 3.623 20 5 CHBDRO C[C@H](c1ccccn1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183679133 1129081257 /nfs/dbraw/zinc/08/12/57/1129081257.db2.gz XOPNJWSGGUOVNY-RCQQVGEISA-N 1 0 297.358 3.696 20 5 CHBDRO C[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC001195359731 1122865965 /nfs/dbraw/zinc/86/59/65/1122865965.db2.gz XTUDSEBEXDPVES-ZDUSSCGKSA-N 1 0 292.379 3.532 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2CC2)s1 ZINC000102421164 1122919594 /nfs/dbraw/zinc/91/95/94/1122919594.db2.gz HQJDUEWENRLPGU-UHFFFAOYSA-N 1 0 288.372 3.823 20 5 CHBDRO Cc1ccoc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507151351 1122932796 /nfs/dbraw/zinc/93/27/96/1122932796.db2.gz DSMMCYFJXMDUQU-UHFFFAOYSA-N 1 0 288.347 3.907 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)[C@@]23C[C@@H]2CCCC3)cccc1[N+](=O)[O-] ZINC001196878186 1122936668 /nfs/dbraw/zinc/93/66/68/1122936668.db2.gz IKZNGEUXLCKGGO-UKPHBRMFSA-N 1 0 288.391 3.962 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000543628050 1122945375 /nfs/dbraw/zinc/94/53/75/1122945375.db2.gz KCJHPXYRLNEVJW-AWEZNQCLSA-N 1 0 262.353 3.668 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H]2CCCCC2(F)F)c1 ZINC000294164128 1123075460 /nfs/dbraw/zinc/07/54/60/1123075460.db2.gz IRQSWETVGXACQB-LBPRGKRZSA-N 1 0 284.306 3.510 20 5 CHBDRO CCCCC[C@@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])C(C)(C)C ZINC000851908715 1123388480 /nfs/dbraw/zinc/38/84/80/1123388480.db2.gz QKJCEBNFJFZORK-CYBMUJFWSA-N 1 0 297.399 3.976 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000474066802 1123408256 /nfs/dbraw/zinc/40/82/56/1123408256.db2.gz QRNSKDPJSCAYFA-LLVKDONJSA-N 1 0 298.333 3.898 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2csc([C@@H]3CCCC[NH2+]3)n2)cc1 ZINC000053251594 1123572802 /nfs/dbraw/zinc/57/28/02/1123572802.db2.gz VYNIYQSVISZCMD-LBPRGKRZSA-N 1 0 289.360 3.533 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1CC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000862381508 1123804085 /nfs/dbraw/zinc/80/40/85/1123804085.db2.gz DEGNSOJPOWXWRR-UWVGGRQHSA-N 1 0 284.306 3.679 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000025938369 1123843596 /nfs/dbraw/zinc/84/35/96/1123843596.db2.gz RUPVGUYRZFWLAR-KRWDZBQOSA-N 1 0 282.343 3.714 20 5 CHBDRO C[C@H](CCO)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000119629433 1123896069 /nfs/dbraw/zinc/89/60/69/1123896069.db2.gz FAHPHFOFWHISFL-CQSZACIVSA-N 1 0 279.383 3.854 20 5 CHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC1CCC1 ZINC000475547607 1124007259 /nfs/dbraw/zinc/00/72/59/1124007259.db2.gz JYDMIZHYEHUALR-POHAHGRESA-N 1 0 274.364 3.730 20 5 CHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCC1(F)CCC1 ZINC000866356725 1124057749 /nfs/dbraw/zinc/05/77/49/1124057749.db2.gz OQIAZLKLLSQVSC-LLVKDONJSA-N 1 0 298.333 3.537 20 5 CHBDRO CC[N@H+](Cc1ccc(C)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000519917696 1124069091 /nfs/dbraw/zinc/06/90/91/1124069091.db2.gz DUNYYPXDBWRCCQ-UHFFFAOYSA-N 1 0 284.359 3.925 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)CCC(F)(F)F)cc1[N+](=O)[O-] ZINC000866540363 1124080170 /nfs/dbraw/zinc/08/01/70/1124080170.db2.gz MSCGWKQIWREHFJ-JTQLQIEISA-N 1 0 290.285 3.724 20 5 CHBDRO Cc1c(COc2ccc([C@H](C)[NH3+])cc2)cccc1[N+](=O)[O-] ZINC000037697594 1129169410 /nfs/dbraw/zinc/16/94/10/1129169410.db2.gz MEVLARHDHXOSAN-LBPRGKRZSA-N 1 0 286.331 3.502 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1(C3CC3)CC1)CCC2 ZINC000447576331 1124496144 /nfs/dbraw/zinc/49/61/44/1124496144.db2.gz XXEKEGBHDWIZMA-MRXNPFEDSA-N 1 0 286.375 3.752 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCC1 ZINC000872047038 1124665273 /nfs/dbraw/zinc/66/52/73/1124665273.db2.gz OSLRPBCENIEDLH-VIFPVBQESA-N 1 0 266.366 3.520 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872051800 1124666591 /nfs/dbraw/zinc/66/65/91/1124666591.db2.gz NKOMDNBLZNYDSN-UWVGGRQHSA-N 1 0 266.316 3.573 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872053609 1124667539 /nfs/dbraw/zinc/66/75/39/1124667539.db2.gz LIZHSYNVLIPDHA-UWVGGRQHSA-N 1 0 286.372 3.526 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC2(CC2)CC1 ZINC000449283895 1124683024 /nfs/dbraw/zinc/68/30/24/1124683024.db2.gz NFNWVGIWCGZULV-CYBMUJFWSA-N 1 0 288.391 3.838 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000449372597 1124704342 /nfs/dbraw/zinc/70/43/42/1124704342.db2.gz JNQUHVZURBEJGT-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccsc1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873024009 1124734231 /nfs/dbraw/zinc/73/42/31/1124734231.db2.gz DTHBVNDNBFWFKQ-UHFFFAOYSA-N 1 0 290.388 3.871 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]2C2CC2)o1 ZINC000449429586 1124735731 /nfs/dbraw/zinc/73/57/31/1124735731.db2.gz XDFLQOGZTHZRAB-OAHLLOKOSA-N 1 0 298.342 3.839 20 5 CHBDRO Cc1cscc1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873114952 1124737624 /nfs/dbraw/zinc/73/76/24/1124737624.db2.gz BSWQHJWHSUGKLJ-UHFFFAOYSA-N 1 0 290.388 3.871 20 5 CHBDRO Cc1c(C[NH2+][C@H]2c3ccccc3O[C@H]2C)cccc1[N+](=O)[O-] ZINC000873127975 1124739368 /nfs/dbraw/zinc/73/93/68/1124739368.db2.gz YOZQXCRWDSGNDU-YVEFUNNKSA-N 1 0 298.342 3.515 20 5 CHBDRO CC[NH+](CC)CC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1Cl ZINC001121180641 1131291055 /nfs/dbraw/zinc/29/10/55/1131291055.db2.gz DRHGLXFFDRUZAD-LLVKDONJSA-N 1 0 299.802 3.781 20 5 CHBDRO CC1(C2([NH2+]C/C=C/c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000449672601 1124836165 /nfs/dbraw/zinc/83/61/65/1124836165.db2.gz MYRWFNLMFIKKRS-GQCTYLIASA-N 1 0 272.348 3.530 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CC1CC(F)(F)C1)C1CC1 ZINC000450599067 1125064022 /nfs/dbraw/zinc/06/40/22/1125064022.db2.gz KLZDKOYIEKAQNQ-UHFFFAOYSA-N 1 0 296.317 3.605 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCC1CC1 ZINC000530326544 1125143110 /nfs/dbraw/zinc/14/31/10/1125143110.db2.gz VARUNANCNOVYPK-JLHYYAGUSA-N 1 0 274.364 3.778 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](C[C@H]2CC=CCC2)C2CC2)cc1 ZINC000215663826 1125144299 /nfs/dbraw/zinc/14/42/99/1125144299.db2.gz DPMUOXYVSSEMEK-AWEZNQCLSA-N 1 0 286.375 3.916 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@H]2c2ccccn2)cccc1[N+](=O)[O-] ZINC000530963489 1125189638 /nfs/dbraw/zinc/18/96/38/1125189638.db2.gz VRJBKOWPQMLUNE-KRWDZBQOSA-N 1 0 297.358 3.635 20 5 CHBDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000531202530 1125200871 /nfs/dbraw/zinc/20/08/71/1125200871.db2.gz QSGLMCHWFXHFGL-KDOFPFPSSA-N 1 0 296.370 3.973 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000531378680 1125212533 /nfs/dbraw/zinc/21/25/33/1125212533.db2.gz JNOMWEJNEZFAPO-CXAGYDPISA-N 1 0 282.343 3.788 20 5 CHBDRO C[C@@H](C[NH2+][C@H]1CCCC12CC2)c1ccccc1[N+](=O)[O-] ZINC000897461111 1125423749 /nfs/dbraw/zinc/42/37/49/1125423749.db2.gz LKIQYQLBBLZMBN-WFASDCNBSA-N 1 0 274.364 3.621 20 5 CHBDRO C[C@H](C[NH2+][C@H]1CCCSCC1)c1ccccc1[N+](=O)[O-] ZINC000897461445 1125424057 /nfs/dbraw/zinc/42/40/57/1125424057.db2.gz PCIKGUMDMGEHAE-OLZOCXBDSA-N 1 0 294.420 3.574 20 5 CHBDRO C[C@H](C[NH2+]Cc1ccsc1)c1ccccc1[N+](=O)[O-] ZINC000897469568 1125433792 /nfs/dbraw/zinc/43/37/92/1125433792.db2.gz MPTDSDFLZRKEED-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037913721 1129290060 /nfs/dbraw/zinc/29/00/60/1129290060.db2.gz RQZDQYVKSIVADF-NSHDSACASA-N 1 0 268.744 3.623 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)C(C)(C)C ZINC000734510454 1129311304 /nfs/dbraw/zinc/31/13/04/1129311304.db2.gz QIGAHMJOFRQFHF-GFCCVEGCSA-N 1 0 294.395 3.765 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)C(C)C ZINC000065299240 1129434167 /nfs/dbraw/zinc/43/41/67/1129434167.db2.gz MIXOJLDOZTWKQX-CYBMUJFWSA-N 1 0 264.369 3.770 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccsc1 ZINC000094773687 1129451962 /nfs/dbraw/zinc/45/19/62/1129451962.db2.gz SWCOHYAPXCXEHE-VIFPVBQESA-N 1 0 280.324 3.646 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000742377581 1129476077 /nfs/dbraw/zinc/47/60/77/1129476077.db2.gz WBZYHIOVONKDBO-CVEARBPZSA-N 1 0 288.391 3.962 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168976687 1129686217 /nfs/dbraw/zinc/68/62/17/1129686217.db2.gz FBEDHCMVGMYSBR-KBMXLJTQSA-N 1 0 276.380 3.563 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)C2CCC2)C1 ZINC001168977362 1129686388 /nfs/dbraw/zinc/68/63/88/1129686388.db2.gz AYRARSQEDPVENB-COXVUDFISA-N 1 0 288.391 3.563 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H]([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168979500 1129686879 /nfs/dbraw/zinc/68/68/79/1129686879.db2.gz YRYILSXOBWFOSK-ZQDZILKHSA-N 1 0 282.428 3.626 20 5 CHBDRO CC(C)(C)c1ccc(C[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001168966496 1129687553 /nfs/dbraw/zinc/68/75/53/1129687553.db2.gz IQSOYAMVCPYXCS-GDBMZVCRSA-N 1 0 290.407 3.519 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168985908 1129687660 /nfs/dbraw/zinc/68/76/60/1129687660.db2.gz VQJALAFOUIXEFT-RCBQFDQVSA-N 1 0 294.370 3.702 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccs1 ZINC001168968188 1129687890 /nfs/dbraw/zinc/68/78/90/1129687890.db2.gz XHCZKHUQSFWXLX-XQQFMLRXSA-N 1 0 282.409 3.624 20 5 CHBDRO CC(C)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168968752 1129688675 /nfs/dbraw/zinc/68/86/75/1129688675.db2.gz AEYOMJJQYPXLLO-FZMZJTMJSA-N 1 0 296.798 3.610 20 5 CHBDRO CC(C)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168968754 1129688690 /nfs/dbraw/zinc/68/86/90/1129688690.db2.gz AEYOMJJQYPXLLO-SMDDNHRTSA-N 1 0 296.798 3.610 20 5 CHBDRO CCc1ccc([C@@H](CC)[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169005890 1129689119 /nfs/dbraw/zinc/68/91/19/1129689119.db2.gz VQAAZRRNSREIOO-BHYGNILZSA-N 1 0 290.407 3.735 20 5 CHBDRO CCCC[N@H+](Cc1ccccc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169030252 1129690421 /nfs/dbraw/zinc/69/04/21/1129690421.db2.gz XJUBTDQGFYXXBO-IAGOWNOFSA-N 1 0 290.407 3.734 20 5 CHBDRO C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C1CCC(C(C)(C)C)CC1 ZINC001169036352 1129690532 /nfs/dbraw/zinc/69/05/32/1129690532.db2.gz FRBHNRGECUFPBK-LMPOIIKSSA-N 1 0 296.455 3.969 20 5 CHBDRO CC(C)[N@H+]([C@@H](C)c1ccccc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169048722 1129691771 /nfs/dbraw/zinc/69/17/71/1129691771.db2.gz AXLMVPHBFVVJNI-ZMSDIMECSA-N 1 0 290.407 3.903 20 5 CHBDRO C[C@H](c1ccccc1Cl)[N@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169049590 1129692111 /nfs/dbraw/zinc/69/21/11/1129692111.db2.gz WQKLLLDQLUOGOR-AGIUHOORSA-N 1 0 296.798 3.778 20 5 CHBDRO CC[C@H]1CCC[C@@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC001169271688 1129713951 /nfs/dbraw/zinc/71/39/51/1129713951.db2.gz OIADYTQTFQSVRA-BBRMVZONSA-N 1 0 292.379 3.532 20 5 CHBDRO C[C@@H]([NH2+]CC1(C)CC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000720912221 1129720058 /nfs/dbraw/zinc/72/00/58/1129720058.db2.gz MABFEHQCIRBVJT-SNVBAGLBSA-N 1 0 284.306 3.681 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CC[C@@H]2C2CCC2)c1 ZINC000800973741 1129901203 /nfs/dbraw/zinc/90/12/03/1129901203.db2.gz SSNIJOGUQFHXSG-HIFRSBDPSA-N 1 0 294.782 3.917 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801516030 1129923762 /nfs/dbraw/zinc/92/37/62/1129923762.db2.gz QKMHHPJZLMYILY-AWEZNQCLSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801527277 1129924559 /nfs/dbraw/zinc/92/45/59/1129924559.db2.gz ISEQIYCLGWXQAX-HBYGRHMLSA-N 1 0 280.343 3.648 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903282339 1130145286 /nfs/dbraw/zinc/14/52/86/1130145286.db2.gz CQNDJWGAGDPHLU-WCQYABFASA-N 1 0 294.420 3.920 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788480512 1130190373 /nfs/dbraw/zinc/19/03/73/1130190373.db2.gz KXKCNHWOGPDNFW-OSAQELSMSA-N 1 0 292.354 3.887 20 5 CHBDRO CCCCC[N@H+](C)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329379 1130483282 /nfs/dbraw/zinc/48/32/82/1130483282.db2.gz PTONHCVJVONXCM-ZDUSSCGKSA-N 1 0 294.395 3.656 20 5 CHBDRO C[Si](C)(C)C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001170409715 1130491808 /nfs/dbraw/zinc/49/18/08/1130491808.db2.gz BCNYMJWYKNJJIS-CQSZACIVSA-N 1 0 292.455 3.652 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC000827319122 1130557419 /nfs/dbraw/zinc/55/74/19/1130557419.db2.gz ABBQQOQMMRGCHJ-LBPRGKRZSA-N 1 0 268.744 3.526 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2CN1CC[NH2+][C@H]2C[C@H]21 ZINC001235287477 1130731125 /nfs/dbraw/zinc/73/11/25/1130731125.db2.gz CSMVMOASDGRXND-VQTJNVASSA-N 1 0 288.394 3.539 20 5 CHBDRO CC1(C)CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783648583 1130844632 /nfs/dbraw/zinc/84/46/32/1130844632.db2.gz MYGMJCWYAXSUSB-LLVKDONJSA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815584271 1131003921 /nfs/dbraw/zinc/00/39/21/1131003921.db2.gz ZHQPIKZOAMREKH-VXGBXAGGSA-N 1 0 291.395 3.796 20 5 CHBDRO C[C@@H]1C[C@H](N)C[N@@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001237203978 1131070374 /nfs/dbraw/zinc/07/03/74/1131070374.db2.gz OWFDOYUTVSZRLV-PBHICJAKSA-N 1 0 290.410 3.915 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000816646320 1131117083 /nfs/dbraw/zinc/11/70/83/1131117083.db2.gz BTWORNNSSHVNIU-VXGBXAGGSA-N 1 0 286.331 3.695 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001115984280 1131124476 /nfs/dbraw/zinc/12/44/76/1131124476.db2.gz NGIGNZUCSHERGD-QWHCGFSZSA-N 1 0 292.354 3.746 20 5 CHBDRO [NH3+]CCCCCCCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000818618571 1131219024 /nfs/dbraw/zinc/21/90/24/1131219024.db2.gz RQLNPYPZNIQDBI-UHFFFAOYSA-N 1 0 286.759 3.536 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000037150778 1132003583 /nfs/dbraw/zinc/00/35/83/1132003583.db2.gz CWRNCZCYWZLQNP-NEPJUHHUSA-N 1 0 286.331 3.712 20 5 CHBDRO C[C@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)C[C@@H]1O ZINC001141722574 1132239517 /nfs/dbraw/zinc/23/95/17/1132239517.db2.gz DJYUKWPQOBGLPU-XOBRGWDASA-N 1 0 291.394 3.806 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)(C)C ZINC001172899995 1132347744 /nfs/dbraw/zinc/34/77/44/1132347744.db2.gz RBICNVMNICDFER-IUODEOHRSA-N 1 0 290.407 3.866 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1C=CCCC1)CC2 ZINC001172903128 1132348143 /nfs/dbraw/zinc/34/81/43/1132348143.db2.gz FFSVROCYICKUFB-CVEARBPZSA-N 1 0 286.375 3.541 20 5 CHBDRO CCC[N@H+](CC)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907446 1132350356 /nfs/dbraw/zinc/35/03/56/1132350356.db2.gz DUKLOTRNUIQZNI-OAHLLOKOSA-N 1 0 276.380 3.574 20 5 CHBDRO CC[C@@H]1CC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172913017 1132371846 /nfs/dbraw/zinc/37/18/46/1132371846.db2.gz OGTPLPJZIRFFDK-CJNGLKHVSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC001173226044 1132412559 /nfs/dbraw/zinc/41/25/59/1132412559.db2.gz KWCVOGBIKPLOLL-AWEZNQCLSA-N 1 0 296.370 3.584 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)[C@H]1C ZINC001173227892 1132412635 /nfs/dbraw/zinc/41/26/35/1132412635.db2.gz SHVXPKZHKMITSG-HZSPNIEDSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccsc1 ZINC001173233728 1132413572 /nfs/dbraw/zinc/41/35/72/1132413572.db2.gz MSTYIOOFCUXUNV-LBPRGKRZSA-N 1 0 290.388 3.719 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001173233718 1132413689 /nfs/dbraw/zinc/41/36/89/1132413689.db2.gz MLBDIBLCQIOCAQ-UNEWFSDZSA-N 1 0 288.391 3.790 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@@H]1CC1(C)C ZINC001173231264 1132413995 /nfs/dbraw/zinc/41/39/95/1132413995.db2.gz AGJJWIOABFKCSH-OCCSQVGLSA-N 1 0 276.380 3.504 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)nc1 ZINC001173235271 1132414134 /nfs/dbraw/zinc/41/41/34/1132414134.db2.gz RYSQDDUREJVSHP-ZIAGYGMSSA-N 1 0 299.374 3.580 20 5 CHBDRO CC(C)C1CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173233342 1132414323 /nfs/dbraw/zinc/41/43/23/1132414323.db2.gz LECFTKPINMPIKC-AWEZNQCLSA-N 1 0 290.407 3.894 20 5 CHBDRO CC[C@H]1CCC[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173235809 1132414977 /nfs/dbraw/zinc/41/49/77/1132414977.db2.gz ZNDHNLDBGBKYGL-KBPBESRZSA-N 1 0 276.380 3.648 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173235818 1132415228 /nfs/dbraw/zinc/41/52/28/1132415228.db2.gz ZNDHNLDBGBKYGL-ZIAGYGMSSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)c1ccccc1 ZINC001173214586 1132416251 /nfs/dbraw/zinc/41/62/51/1132416251.db2.gz PLUWCNOCEHVOMI-ZIAGYGMSSA-N 1 0 284.359 3.877 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC001173212645 1132416398 /nfs/dbraw/zinc/41/63/98/1132416398.db2.gz CARQBPPNMDYLCO-OAHLLOKOSA-N 1 0 298.386 3.932 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC001173210720 1132416549 /nfs/dbraw/zinc/41/65/49/1132416549.db2.gz MPBMJGPVIMTWBZ-VNHYZAJKSA-N 1 0 276.380 3.694 20 5 CHBDRO O=[N+]([O-])c1ccccc1Nc1ccccc1C1=CC[NH2+]CC1 ZINC001160022837 1132936777 /nfs/dbraw/zinc/93/67/77/1132936777.db2.gz CPNZAQRMCMXRTA-UHFFFAOYSA-N 1 0 295.342 3.715 20 5 CHBDRO CC(C)(C)[C@H](C[NH3+])Nc1ccc2ccc3cccnc3c2n1 ZINC001160912806 1132986068 /nfs/dbraw/zinc/98/60/68/1132986068.db2.gz UFWYZIFCMNYQBJ-AWEZNQCLSA-N 1 0 294.402 3.568 20 5 CHBDRO C[C@@H]1C[C@@H](CNc2nc3ccccc3c3ccccc32)C[NH2+]1 ZINC001162562413 1133091706 /nfs/dbraw/zinc/09/17/06/1133091706.db2.gz JDTWYPLBGBKGBF-ZIAGYGMSSA-N 1 0 291.398 3.798 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCc1ccc(C)nc1 ZINC001162871481 1133118074 /nfs/dbraw/zinc/11/80/74/1133118074.db2.gz KIDQVKHFRXFUIA-UHFFFAOYSA-N 1 0 284.427 3.598 20 5 CHBDRO CC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)CC(C)C ZINC001204881725 1133495481 /nfs/dbraw/zinc/49/54/81/1133495481.db2.gz SMYRMDRBODALJG-ZROIWOOFSA-N 1 0 276.380 3.976 20 5 CHBDRO C[C@@H](CC1CC1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001205006918 1133516392 /nfs/dbraw/zinc/51/63/92/1133516392.db2.gz AORDMFBXUYRUOH-JTQLQIEISA-N 1 0 282.771 3.569 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2C[C@@H]2C2CCCC2)c(F)c1 ZINC001207837869 1133850443 /nfs/dbraw/zinc/85/04/43/1133850443.db2.gz USUGBZCDBMSGBT-UKRRQHHQSA-N 1 0 292.354 3.650 20 5 CHBDRO Cc1c[nH+]ccc1Nc1c(Cl)ccc([N+](=O)[O-])c1Cl ZINC001215581011 1134647581 /nfs/dbraw/zinc/64/75/81/1134647581.db2.gz ITXQAKWVOMZLAS-UHFFFAOYSA-N 1 0 298.129 3.771 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)c(Cl)c1 ZINC000403686526 1134836160 /nfs/dbraw/zinc/83/61/60/1134836160.db2.gz RFBKFJDIKRBCFG-ZMLRMANQSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000308696487 1134978012 /nfs/dbraw/zinc/97/80/12/1134978012.db2.gz FNBDKCIQEADODL-SWLSCSKDSA-N 1 0 262.353 3.653 20 5 CHBDRO c1ccc2nc3c(cccc3OC3CC[NH2+]CC3)cc2c1 ZINC001217964223 1135032741 /nfs/dbraw/zinc/03/27/41/1135032741.db2.gz NTWDFASPYRYZPV-UHFFFAOYSA-N 1 0 278.355 3.519 20 5 CHBDRO Oc1c2ccccc2c(O[C@H]2C=CC[NH2+]C2)c2ccccc12 ZINC001218334981 1135089615 /nfs/dbraw/zinc/08/96/15/1135089615.db2.gz SGEYBRYANWBWGN-ZDUSSCGKSA-N 1 0 291.350 3.605 20 5 CHBDRO C[N@@H+]1CC[C@@H](OCc2c3ccccc3nc3ccccc32)C1 ZINC001223333019 1135329958 /nfs/dbraw/zinc/32/99/58/1135329958.db2.gz YBJABJSECNYJMW-CQSZACIVSA-N 1 0 292.382 3.609 20 5 CHBDRO C[N@@H+]1CC[C@H](OCc2c3ccccc3nc3ccccc32)C1 ZINC001223333017 1135330026 /nfs/dbraw/zinc/33/00/26/1135330026.db2.gz YBJABJSECNYJMW-AWEZNQCLSA-N 1 0 292.382 3.609 20 5 CHBDRO C[C@@H](OC1CCC([NH+](C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC001223432524 1135344565 /nfs/dbraw/zinc/34/45/65/1135344565.db2.gz VIZPBSJINYYFAP-XEBKBJJBSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCc1csc2ccccc12 ZINC001223978857 1135404596 /nfs/dbraw/zinc/40/45/96/1135404596.db2.gz JPYJNYGXQPDRKU-GFCCVEGCSA-N 1 0 264.414 3.513 20 5 CHBDRO C[C@H](OC1CCC([NH+](C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC001224021610 1135411346 /nfs/dbraw/zinc/41/13/46/1135411346.db2.gz ASXWKHOCVWMHCN-YGONEPDPSA-N 1 0 292.379 3.545 20 5 CHBDRO CC(C)[N@@H+]1CCC[C@@H](O[C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001224024712 1135411752 /nfs/dbraw/zinc/41/17/52/1135411752.db2.gz KTKVZOWWGQXVPR-CZUORRHYSA-N 1 0 292.379 3.545 20 5 CHBDRO C[N+](C)(C)CCO[C@@H]1CCCC[C@H]1C1CCCCC1 ZINC001224772723 1135480717 /nfs/dbraw/zinc/48/07/17/1135480717.db2.gz BYPDKJSLVSTKIM-DLBZAZTESA-N 1 0 268.465 3.848 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(Oc2ccccc2)cc1 ZINC001225251402 1135526014 /nfs/dbraw/zinc/52/60/14/1135526014.db2.gz TYTPNYFTQIABKT-HNNXBMFYSA-N 1 0 286.395 3.952 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc2[nH]c3ccccc3c21 ZINC001226256860 1135678017 /nfs/dbraw/zinc/67/80/17/1135678017.db2.gz ITLVVIKQLSXVQE-ZDUSSCGKSA-N 1 0 283.395 3.795 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc(-c2ccccc2)c1 ZINC001227540828 1135844568 /nfs/dbraw/zinc/84/45/68/1135844568.db2.gz MGRQAODZQUURIQ-HNNXBMFYSA-N 1 0 270.396 3.827 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)CC2CC2)cc1[N+](=O)[O-] ZINC000070101181 260152036 /nfs/dbraw/zinc/15/20/36/260152036.db2.gz UKNMPRLXFFRCMP-RYUDHWBXSA-N 1 0 262.353 3.742 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](CCCCCF)C2CC2)c1 ZINC000341879268 130105529 /nfs/dbraw/zinc/10/55/29/130105529.db2.gz WOVWSYIXJYNFEF-UHFFFAOYSA-N 1 0 280.343 3.699 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000020126328 171010545 /nfs/dbraw/zinc/01/05/45/171010545.db2.gz XIVWGRUMZHPNMY-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO CCCCC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000020560949 171252001 /nfs/dbraw/zinc/25/20/01/171252001.db2.gz HKBUJWYFHMXNQJ-GFCCVEGCSA-N 1 0 250.342 3.744 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C2CCCCCCC2)cs1 ZINC000037562450 173272792 /nfs/dbraw/zinc/27/27/92/173272792.db2.gz WQBVOGUDHPZWQK-UHFFFAOYSA-N 1 0 268.382 3.859 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037562902 173510573 /nfs/dbraw/zinc/51/05/73/173510573.db2.gz YIBMLPVIJNZNAU-NWDGAFQWSA-N 1 0 268.382 3.715 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000037177081 260072917 /nfs/dbraw/zinc/07/29/17/260072917.db2.gz XILDLRVBJSVJET-YVEFUNNKSA-N 1 0 282.343 3.933 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426766151 260213954 /nfs/dbraw/zinc/21/39/54/260213954.db2.gz XGDXLKBVGJBSCW-AEGPPILISA-N 1 0 274.364 3.778 20 5 CHBDRO CC(C)C1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000090230564 260339742 /nfs/dbraw/zinc/33/97/42/260339742.db2.gz PAPCDUHYUKYGEU-GFCCVEGCSA-N 1 0 262.353 3.682 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cccc(F)c1 ZINC000518215547 260358661 /nfs/dbraw/zinc/35/86/61/260358661.db2.gz UYGXSUOBYABZAJ-OAHLLOKOSA-N 1 0 286.306 3.511 20 5 CHBDRO CC[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000409456818 260411724 /nfs/dbraw/zinc/41/17/24/260411724.db2.gz KXKGYVVVFQULKZ-NSHDSACASA-N 1 0 274.320 3.743 20 5 CHBDRO Cc1c([C@H](C)[NH2+]Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000152955748 261071577 /nfs/dbraw/zinc/07/15/77/261071577.db2.gz JPVKUAUGTHCSRN-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1c([C@H](C)[NH2+]Cc2ccccc2F)cccc1[N+](=O)[O-] ZINC000153933335 261085660 /nfs/dbraw/zinc/08/56/60/261085660.db2.gz RIPZOXQOMBVPSU-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CSC(C)(C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000154261374 261089840 /nfs/dbraw/zinc/08/98/40/261089840.db2.gz NYBVLVQCYITCEA-NSHDSACASA-N 1 0 282.409 3.695 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)c2cccnc2)cccc1[N+](=O)[O-] ZINC000158518953 261166015 /nfs/dbraw/zinc/16/60/15/261166015.db2.gz YPXAFGPBMXKADJ-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000094322270 261184268 /nfs/dbraw/zinc/18/42/68/261184268.db2.gz HSQKIHKEPQIOHD-RISCZKNCSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)[C@@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000221382700 261824860 /nfs/dbraw/zinc/82/48/60/261824860.db2.gz NBCYCFLCZFZCBI-HUUCEWRRSA-N 1 0 276.380 3.899 20 5 CHBDRO CC[N@H+](Cc1cccs1)Cc1cccc([N+](=O)[O-])c1C ZINC000501492713 262185592 /nfs/dbraw/zinc/18/55/92/262185592.db2.gz WCHXUCLUDHWJSI-UHFFFAOYSA-N 1 0 290.388 3.987 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000020526306 262246083 /nfs/dbraw/zinc/24/60/83/262246083.db2.gz JDJRUSNCGDHEEM-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@@H]([NH2+]C[C@H](C)c1nccs1)c1cccc([N+](=O)[O-])c1 ZINC000186742144 262323058 /nfs/dbraw/zinc/32/30/58/262323058.db2.gz FIMHQRCZQRHDGP-WDEREUQCSA-N 1 0 291.376 3.506 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CS[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000488541574 262334209 /nfs/dbraw/zinc/33/42/09/262334209.db2.gz IHQTULRRNPVSSC-HIFRSBDPSA-N 1 0 294.420 3.523 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000094423903 262369575 /nfs/dbraw/zinc/36/95/75/262369575.db2.gz RYCJRMISXBOMPG-FZMZJTMJSA-N 1 0 292.379 3.592 20 5 CHBDRO CC[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1ncc[nH]1 ZINC000139779294 263031156 /nfs/dbraw/zinc/03/11/56/263031156.db2.gz OYPBEDUMQVVXDA-JTQLQIEISA-N 1 0 280.715 3.535 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1CNc1ccc([C@@H](C)[NH3+])cc1 ZINC000414816817 263054447 /nfs/dbraw/zinc/05/44/47/263054447.db2.gz YBDAUUHJDJIGER-GFCCVEGCSA-N 1 0 285.347 3.535 20 5 CHBDRO CC[NH2+]Cc1ccccc1NCc1ccc(C)c([N+](=O)[O-])c1 ZINC000414872480 263086598 /nfs/dbraw/zinc/08/65/98/263086598.db2.gz VMSVPVGXJSTUOY-UHFFFAOYSA-N 1 0 299.374 3.625 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000222134221 263241883 /nfs/dbraw/zinc/24/18/83/263241883.db2.gz ABDJWBOIZOIYLX-GXTWGEPZSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000330695811 264005728 /nfs/dbraw/zinc/00/57/28/264005728.db2.gz DFGUSUJVFWNWPY-FZMZJTMJSA-N 1 0 292.379 3.592 20 5 CHBDRO C[C@H]([NH2+][C@@H]1COCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000417407321 264224605 /nfs/dbraw/zinc/22/46/05/264224605.db2.gz SIIMDTXZRCDQDQ-YVEFUNNKSA-N 1 0 298.342 3.517 20 5 CHBDRO CCOC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000314741364 266002931 /nfs/dbraw/zinc/00/29/31/266002931.db2.gz LJTCTYOCOQICIU-CYBMUJFWSA-N 1 0 292.379 3.595 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(C3CC3)c2)cc1 ZINC000094519077 327954770 /nfs/dbraw/zinc/95/47/70/327954770.db2.gz QWVUUXVSQUCRGP-UHFFFAOYSA-N 1 0 282.343 3.762 20 5 CHBDRO CCCC(O)(CCC)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000152045903 328007488 /nfs/dbraw/zinc/00/74/88/328007488.db2.gz VXHPPDVPAUWANJ-CYBMUJFWSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1cccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000040675998 328015553 /nfs/dbraw/zinc/01/55/53/328015553.db2.gz MTSIKXOIOYHUIO-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@@H]1C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC(C)(C)C1 ZINC000040675899 328015582 /nfs/dbraw/zinc/01/55/82/328015582.db2.gz FAZOZBXEJQEJMT-HIFRSBDPSA-N 1 0 290.407 3.942 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(Cl)s2)cc1 ZINC000040675922 328015612 /nfs/dbraw/zinc/01/56/12/328015612.db2.gz PAJYIOLWZQQETG-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO CO[C@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C(C)(C)C ZINC000154944410 328059337 /nfs/dbraw/zinc/05/93/37/328059337.db2.gz REMLDHDTTHWHPM-IUODEOHRSA-N 1 0 294.395 3.615 20 5 CHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C(C)C ZINC000571466209 328123719 /nfs/dbraw/zinc/12/37/19/328123719.db2.gz PELDTINSKZOWSB-UHFFFAOYSA-N 1 0 290.285 3.844 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000531932461 328321084 /nfs/dbraw/zinc/32/10/84/328321084.db2.gz KBUHNRRWEFEZCM-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000049963240 328380072 /nfs/dbraw/zinc/38/00/72/328380072.db2.gz POBMMUXXQJVUDN-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO CC[C@@H](Cc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000112466746 328439648 /nfs/dbraw/zinc/43/96/48/328439648.db2.gz MSLSHSNQWKNHSH-INIZCTEOSA-N 1 0 284.359 3.706 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000563780897 328516331 /nfs/dbraw/zinc/51/63/31/328516331.db2.gz QUJFQSWOUAXTCN-UHFFFAOYSA-N 1 0 295.342 3.674 20 5 CHBDRO CC1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000538019462 326849680 /nfs/dbraw/zinc/84/96/80/326849680.db2.gz RZZAHLLMMKBCSG-HNNXBMFYSA-N 1 0 288.391 3.696 20 5 CHBDRO CC(C)[C@H]1CC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000556893218 326979782 /nfs/dbraw/zinc/97/97/82/326979782.db2.gz RCCKZVUZHVKONF-ZIAGYGMSSA-N 1 0 296.798 3.815 20 5 CHBDRO CC(C)[C@H]1CC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000556893215 326979816 /nfs/dbraw/zinc/97/98/16/326979816.db2.gz RCCKZVUZHVKONF-KGLIPLIRSA-N 1 0 296.798 3.815 20 5 CHBDRO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000255758460 327013069 /nfs/dbraw/zinc/01/30/69/327013069.db2.gz YQIOBWYYWZDVJY-BMWLXYDHSA-N 1 0 282.343 3.959 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CCC(C)(F)F)cc1[N+](=O)[O-] ZINC000449355486 327168389 /nfs/dbraw/zinc/16/83/89/327168389.db2.gz ZYCOPMNBLVGJQF-UHFFFAOYSA-N 1 0 286.322 3.853 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1N(C)C ZINC000089513232 327170946 /nfs/dbraw/zinc/17/09/46/327170946.db2.gz JWIIFCVBXWSUHI-ZDUSSCGKSA-N 1 0 299.374 3.512 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000559418267 327244471 /nfs/dbraw/zinc/24/44/71/327244471.db2.gz PQXHUHAVCRLIRI-JSGCOSHPSA-N 1 0 274.364 3.778 20 5 CHBDRO Cc1cccc(CC[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000051668572 328627006 /nfs/dbraw/zinc/62/70/06/328627006.db2.gz AMHVQSDOQVYXLS-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1cccc(CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000051669253 328627334 /nfs/dbraw/zinc/62/73/34/328627334.db2.gz GHNGCLDMACNFMT-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@H]2C[C@@H]2c2ccccc2)cc1 ZINC000532127589 328700814 /nfs/dbraw/zinc/70/08/14/328700814.db2.gz GBEKVNOSLGMOHX-SJLPKXTDSA-N 1 0 296.370 3.531 20 5 CHBDRO CC[C@@H]([NH2+]CC1(SC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000193816115 329063098 /nfs/dbraw/zinc/06/30/98/329063098.db2.gz JNKHTFHPJYIZCS-CYBMUJFWSA-N 1 0 280.393 3.531 20 5 CHBDRO CC1=CC[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000582537107 329108458 /nfs/dbraw/zinc/10/84/58/329108458.db2.gz NYDWIIPVAAIQSW-GXTWGEPZSA-N 1 0 260.337 3.744 20 5 CHBDRO CCO[C@H](CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000178661193 329201881 /nfs/dbraw/zinc/20/18/81/329201881.db2.gz VVFXMRQNTKLIRX-XJKSGUPXSA-N 1 0 294.395 3.697 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC1(C)C ZINC000583106310 329312473 /nfs/dbraw/zinc/31/24/73/329312473.db2.gz HWBPDZSHIUKCSP-SAAWKEMMSA-N 1 0 274.364 3.776 20 5 CHBDRO CCC(CC)(CC)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000086642723 332877396 /nfs/dbraw/zinc/87/73/96/332877396.db2.gz LPIAMGXETIMFSY-UHFFFAOYSA-N 1 0 280.368 3.532 20 5 CHBDRO CSC1(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCC1 ZINC000572462420 330111209 /nfs/dbraw/zinc/11/12/09/330111209.db2.gz HQGGRZBBKXRQBH-LBPRGKRZSA-N 1 0 294.420 3.840 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000396960218 330232128 /nfs/dbraw/zinc/23/21/28/330232128.db2.gz ZBFRCUJBSYEVJV-UWVGGRQHSA-N 1 0 290.285 3.834 20 5 CHBDRO CC[C@H]([NH2+]Cc1cnc(C)cc1C)c1cccc([N+](=O)[O-])c1 ZINC000397119495 330238644 /nfs/dbraw/zinc/23/86/44/330238644.db2.gz ZMSDQUJADMEKES-KRWDZBQOSA-N 1 0 299.374 3.848 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000035257020 330244851 /nfs/dbraw/zinc/24/48/51/330244851.db2.gz YPCIHQHRDHAXFJ-ZFWWWQNUSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000045628990 330347228 /nfs/dbraw/zinc/34/72/28/330347228.db2.gz NXJUDYMCCJNWQP-STQMWFEESA-N 1 0 260.337 3.602 20 5 CHBDRO CC[C@@H]1CCC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000071120268 330352073 /nfs/dbraw/zinc/35/20/73/330352073.db2.gz DMAMXXAIVRHYMV-UKRRQHHQSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@H]([NH2+]CC1(OC)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000315466517 330475969 /nfs/dbraw/zinc/47/59/69/330475969.db2.gz LGHWSNTWBSBTFN-HNNXBMFYSA-N 1 0 292.379 3.595 20 5 CHBDRO Cc1ccoc1C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000426354119 330505501 /nfs/dbraw/zinc/50/55/01/330505501.db2.gz YGHYEACOXSLIOF-CYBMUJFWSA-N 1 0 288.347 3.607 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C2CC(F)(F)C2)cc1[N+](=O)[O-] ZINC000428649116 330528875 /nfs/dbraw/zinc/52/88/75/330528875.db2.gz JTINYHANJIJJFT-UHFFFAOYSA-N 1 0 284.306 3.606 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000433145186 330618057 /nfs/dbraw/zinc/61/80/57/330618057.db2.gz FVJWLCMYYWPASW-MEBBXXQBSA-N 1 0 274.364 3.705 20 5 CHBDRO CC(C)(C)CC[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000437797294 330708951 /nfs/dbraw/zinc/70/89/51/330708951.db2.gz SSYFJQJLJOAGPI-UHFFFAOYSA-N 1 0 284.787 3.817 20 5 CHBDRO Cc1cc(NC[C@@H]2C[C@@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000159447381 330848034 /nfs/dbraw/zinc/84/80/34/330848034.db2.gz OFBIAKZBAUIACP-ONGXEEELSA-N 1 0 271.320 3.519 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447597378 330872730 /nfs/dbraw/zinc/87/27/30/330872730.db2.gz FGHLPYCLBCPKIJ-KFNAQCHYSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)c1ccccc1 ZINC000449065413 330896498 /nfs/dbraw/zinc/89/64/98/330896498.db2.gz UHXKQCVLIVHNIE-CABCVRRESA-N 1 0 298.386 3.919 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449350457 330917361 /nfs/dbraw/zinc/91/73/61/330917361.db2.gz WFKNBVWBLCCYAT-IUIKQTSFSA-N 1 0 274.364 3.824 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H]1CCCC1(F)F ZINC000449491244 330930567 /nfs/dbraw/zinc/93/05/67/330930567.db2.gz FYJWYMZDNQDWLV-DIECRNLCSA-N 1 0 296.317 3.633 20 5 CHBDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000163352111 331025237 /nfs/dbraw/zinc/02/52/37/331025237.db2.gz XISYPVBWGDGTLF-JTQLQIEISA-N 1 0 290.285 3.806 20 5 CHBDRO CCc1cccnc1[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000453250639 331107484 /nfs/dbraw/zinc/10/74/84/331107484.db2.gz YGOUDNUYGWCVDU-STQMWFEESA-N 1 0 299.374 3.964 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H]1Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000195651201 331179411 /nfs/dbraw/zinc/17/94/11/331179411.db2.gz DFHPFJAFGUOIAS-CRAIPNDOSA-N 1 0 296.370 3.975 20 5 CHBDRO CCC1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000510666392 332910143 /nfs/dbraw/zinc/91/01/43/332910143.db2.gz SWVWVKMXNHTBQK-FNORWQNLSA-N 1 0 274.364 3.730 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[NH2+]C1(C2CCC2)CCC1 ZINC000459755293 331298639 /nfs/dbraw/zinc/29/86/39/331298639.db2.gz DZZYGZFUBSRAEO-UHFFFAOYSA-N 1 0 278.327 3.546 20 5 CHBDRO O=[N+]([O-])c1cc(F)c(C[NH2+]C2(C3CCC3)CCC2)c(F)c1 ZINC000459758355 331298891 /nfs/dbraw/zinc/29/88/91/331298891.db2.gz PZVCAKBDXBYLRO-UHFFFAOYSA-N 1 0 296.317 3.685 20 5 CHBDRO C=Cc1ccc(CC[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000462915687 331335050 /nfs/dbraw/zinc/33/50/50/331335050.db2.gz YRHYRNBMDSCEGN-UHFFFAOYSA-N 1 0 282.343 3.570 20 5 CHBDRO CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])CC(C)(C)C ZINC000463366168 331346630 /nfs/dbraw/zinc/34/66/30/331346630.db2.gz IYBRLBPDAXDGFS-UHFFFAOYSA-N 1 0 268.332 3.602 20 5 CHBDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000464743416 331365786 /nfs/dbraw/zinc/36/57/86/331365786.db2.gz YJGBKONLDFYXLW-HIFRSBDPSA-N 1 0 276.380 3.995 20 5 CHBDRO CCCCC[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000464783078 331368182 /nfs/dbraw/zinc/36/81/82/331368182.db2.gz FVRIKGHAWUEITI-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO CCSCC[C@@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000464857373 331371375 /nfs/dbraw/zinc/37/13/75/331371375.db2.gz NHIIUTMSBMLPQP-GFCCVEGCSA-N 1 0 296.436 3.867 20 5 CHBDRO Cc1ccccc1C[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000478493196 331707243 /nfs/dbraw/zinc/70/72/43/331707243.db2.gz RTWFLAGMSKUJPQ-AWEZNQCLSA-N 1 0 298.386 3.932 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000481165840 331799425 /nfs/dbraw/zinc/79/94/25/331799425.db2.gz ATGWJMBTPNOKDT-KBPBESRZSA-N 1 0 292.379 3.532 20 5 CHBDRO CC(C)(C)C[C@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000488402929 332004345 /nfs/dbraw/zinc/00/43/45/332004345.db2.gz KTFZIIKVUCQOLE-CQSZACIVSA-N 1 0 276.380 3.995 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2CC(C(C)C)C2)cc1[N+](=O)[O-] ZINC000488446074 332009638 /nfs/dbraw/zinc/00/96/38/332009638.db2.gz STUMKWUDSLTETD-GRTSSRMGSA-N 1 0 276.380 3.988 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000489126458 332042284 /nfs/dbraw/zinc/04/22/84/332042284.db2.gz BVYPFSLDQXVETQ-CYBMUJFWSA-N 1 0 276.380 3.854 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CCC(F)(F)F ZINC000489135639 332042307 /nfs/dbraw/zinc/04/23/07/332042307.db2.gz HNXIATWHSNMTJB-JTQLQIEISA-N 1 0 290.285 3.848 20 5 CHBDRO COc1cc(C[N@@H+]2CCC[C@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000489198465 332043241 /nfs/dbraw/zinc/04/32/41/332043241.db2.gz RARDSKBCXVMERC-HNNXBMFYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489228744 332043721 /nfs/dbraw/zinc/04/37/21/332043721.db2.gz XAWCAEGLPCFWAU-DGCLKSJQSA-N 1 0 264.369 3.942 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C(F)F)CC1 ZINC000489965142 332075011 /nfs/dbraw/zinc/07/50/11/332075011.db2.gz LCNJWXUWOGZMCW-NSHDSACASA-N 1 0 298.333 3.941 20 5 CHBDRO COc1cc(C[N@@H+]2C[C@@H](C)CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000490029444 332077567 /nfs/dbraw/zinc/07/75/67/332077567.db2.gz KIMCXNCUPXRCHA-QWHCGFSZSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490043090 332078174 /nfs/dbraw/zinc/07/81/74/332078174.db2.gz XSXMLYSVEGGBSF-MRXNPFEDSA-N 1 0 292.379 3.616 20 5 CHBDRO CC[C@@H]1C[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCS1 ZINC000490088537 332080733 /nfs/dbraw/zinc/08/07/33/332080733.db2.gz OWZRDLMMELKVNA-GXTWGEPZSA-N 1 0 294.420 3.792 20 5 CHBDRO CC[C@@H]1C[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CCS1 ZINC000490088540 332080890 /nfs/dbraw/zinc/08/08/90/332080890.db2.gz OWZRDLMMELKVNA-TZMCWYRMSA-N 1 0 294.420 3.792 20 5 CHBDRO C[C@@H]1C[C@@H]1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000490164318 332083190 /nfs/dbraw/zinc/08/31/90/332083190.db2.gz LKIZKZXANGLYGQ-QBIMZIAESA-N 1 0 296.370 3.930 20 5 CHBDRO CC(C)([NH2+]Cc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000492308501 332391910 /nfs/dbraw/zinc/39/19/10/332391910.db2.gz BOJTWLQYSOPRHX-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H](C)CC2)ccc1[N+](=O)[O-] ZINC000492416511 332396540 /nfs/dbraw/zinc/39/65/40/332396540.db2.gz KPTOHWIIQWJUAW-CYBMUJFWSA-N 1 0 292.379 3.616 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]C[C@H]2C[C@H]2c2ccccc2)c1 ZINC000503040989 332679418 /nfs/dbraw/zinc/67/94/18/332679418.db2.gz CWZLYRYHWOMULK-AEFFLSMTSA-N 1 0 296.370 3.531 20 5 CHBDRO CC(C)C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000307832480 333017671 /nfs/dbraw/zinc/01/76/71/333017671.db2.gz LOIHFRQYOBIGTQ-LBPRGKRZSA-N 1 0 280.343 3.602 20 5 CHBDRO CC(C)[C@H]1CC[C@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000513655108 333029525 /nfs/dbraw/zinc/02/95/25/333029525.db2.gz LBEUXFCVPXOIAB-NILFDRSVSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@H]1c2ccccc2CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000513689859 333032467 /nfs/dbraw/zinc/03/24/67/333032467.db2.gz GAICOPGQLGMNAJ-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000311920647 333074410 /nfs/dbraw/zinc/07/44/10/333074410.db2.gz DQOGJFXGJMOFNX-RISCZKNCSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1cc(NCC[NH+]2[C@@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000517393908 333098801 /nfs/dbraw/zinc/09/88/01/333098801.db2.gz WBYBMXPXSZGCLR-KBPBESRZSA-N 1 0 291.395 3.578 20 5 CHBDRO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CC(C)C ZINC000521818351 333189650 /nfs/dbraw/zinc/18/96/50/333189650.db2.gz YBBRSGOGDVISOA-UHFFFAOYSA-N 1 0 264.369 3.771 20 5 CHBDRO CCC[C@H]([NH2+]CCCCCOC)c1cccc([N+](=O)[O-])c1 ZINC000222978895 333203040 /nfs/dbraw/zinc/20/30/40/333203040.db2.gz JVRJTMHMLBQACC-INIZCTEOSA-N 1 0 294.395 3.842 20 5 CHBDRO CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000223722631 333211360 /nfs/dbraw/zinc/21/13/60/333211360.db2.gz RAVNQYCWZBZNPY-CORIIIEPSA-N 1 0 294.420 3.920 20 5 CHBDRO CCC(CC)[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)C1CC1 ZINC000522057111 333232317 /nfs/dbraw/zinc/23/23/17/333232317.db2.gz NKYPOHHXKFUKON-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000226179028 333253264 /nfs/dbraw/zinc/25/32/64/333253264.db2.gz WBOCSCKHXMQRPQ-WWGRRREGSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000312915619 333376985 /nfs/dbraw/zinc/37/69/85/333376985.db2.gz BQXHXWKKFZFYAP-ZDUSSCGKSA-N 1 0 276.380 3.901 20 5 CHBDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000524811130 333388976 /nfs/dbraw/zinc/38/89/76/333388976.db2.gz AHTCGYFVQFODLB-CZUORRHYSA-N 1 0 276.380 3.995 20 5 CHBDRO C[C@@H](Cc1cccs1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000036992575 333452326 /nfs/dbraw/zinc/45/23/26/333452326.db2.gz PVZSVWOQLVOOQO-RYUDHWBXSA-N 1 0 290.388 3.938 20 5 CHBDRO CC[C@@H]([NH2+]C1(C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000538553937 333604880 /nfs/dbraw/zinc/60/48/80/333604880.db2.gz OCFLIEAHHBDERU-CQSZACIVSA-N 1 0 260.337 3.578 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH+](CC1CC1)CC1CC1 ZINC000538728083 333618382 /nfs/dbraw/zinc/61/83/82/333618382.db2.gz UBNZZCFBEGUNGW-HWKANZROSA-N 1 0 286.375 3.730 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCc2ccsc2C1 ZINC000132850822 334007962 /nfs/dbraw/zinc/00/79/62/334007962.db2.gz GRHAGJJRZSYYEW-NSHDSACASA-N 1 0 288.372 3.776 20 5 CHBDRO C[C@H](C[N@H+](C)CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000551012152 334236366 /nfs/dbraw/zinc/23/63/66/334236366.db2.gz LZURDPIZHNJOLG-OAHLLOKOSA-N 1 0 298.386 3.873 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)[C@@H]1CCCO1 ZINC000246405453 334256368 /nfs/dbraw/zinc/25/63/68/334256368.db2.gz MASNXKNYJDSSEK-KCXAZCMYSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@@H]1C ZINC000552086313 334287575 /nfs/dbraw/zinc/28/75/75/334287575.db2.gz CFMOLMLVSOJSSX-YNEHKIRRSA-N 1 0 294.420 3.854 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2(C)CCC2)cccc1[N+](=O)[O-] ZINC000090219894 334358705 /nfs/dbraw/zinc/35/87/05/334358705.db2.gz RPPVBOXPZWPXIG-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000252438783 334380175 /nfs/dbraw/zinc/38/01/75/334380175.db2.gz GKPHNGYVRROJRL-JYAVWHMHSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000253180419 334420687 /nfs/dbraw/zinc/42/06/87/334420687.db2.gz DOWCHGPDRXQZFI-YRGRVCCFSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCC2(C)C)cccc1[N+](=O)[O-] ZINC000554375026 334426468 /nfs/dbraw/zinc/42/64/68/334426468.db2.gz GDWRJUAMAONILJ-BXUZGUMPSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1F ZINC000153933032 334683322 /nfs/dbraw/zinc/68/33/22/334683322.db2.gz VQOSJCZJBFWEFG-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000576392592 335197629 /nfs/dbraw/zinc/19/76/29/335197629.db2.gz SCUTUDVEYGPBDG-ZNNBYXKUSA-N 1 0 298.386 3.873 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C1CCCCC1 ZINC000579971336 335940681 /nfs/dbraw/zinc/94/06/81/335940681.db2.gz AVKKALHUVXRUBQ-CQSZACIVSA-N 1 0 260.337 3.504 20 5 CHBDRO Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000580903531 335982418 /nfs/dbraw/zinc/98/24/18/335982418.db2.gz VSWLYQFDQOOYKI-INIZCTEOSA-N 1 0 282.343 3.680 20 5 CHBDRO CC[C@H](C)[C@@H](C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)OC ZINC000381185873 336054091 /nfs/dbraw/zinc/05/40/91/336054091.db2.gz SBVYXXBSMHGDBY-NORZTCDRSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000195670009 336057976 /nfs/dbraw/zinc/05/79/76/336057976.db2.gz OKKHOSUIYOCYDE-CZUORRHYSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000195670008 336058188 /nfs/dbraw/zinc/05/81/88/336058188.db2.gz OKKHOSUIYOCYDE-BBRMVZONSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC000381551536 336068068 /nfs/dbraw/zinc/06/80/68/336068068.db2.gz GBAZZQBFOCYDMQ-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H]1CC2CCC1CC2 ZINC000381776856 336072733 /nfs/dbraw/zinc/07/27/33/336072733.db2.gz ZACLBLNEDXTTKY-PYULLRNSSA-N 1 0 294.420 3.961 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000381796483 336073438 /nfs/dbraw/zinc/07/34/38/336073438.db2.gz SYLNWEHLNIEYJB-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO CC(C)(C)C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000381982570 336079564 /nfs/dbraw/zinc/07/95/64/336079564.db2.gz IMKFQYDFKDXVFI-UHFFFAOYSA-N 1 0 268.332 3.648 20 5 CHBDRO C[C@@H]1C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000385820715 336157690 /nfs/dbraw/zinc/15/76/90/336157690.db2.gz QUERQLQXVGSQLF-WBMJQRKESA-N 1 0 282.343 3.933 20 5 CHBDRO CCSCC[C@@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000581954011 336178756 /nfs/dbraw/zinc/17/87/56/336178756.db2.gz GPGXOAWDRSNGPP-RISCZKNCSA-N 1 0 294.420 3.703 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000120154964 520773871 /nfs/dbraw/zinc/77/38/71/520773871.db2.gz VBQWHNILRHFUCX-QGZVFWFLSA-N 1 0 299.374 3.663 20 5 CHBDRO CCC[C@H]([NH2+][C@H](C)CC(C)(C)O)c1cccc([N+](=O)[O-])c1 ZINC000296325544 521175110 /nfs/dbraw/zinc/17/51/10/521175110.db2.gz GZNGHEDQVRBNCA-DOMZBBRYSA-N 1 0 294.395 3.575 20 5 CHBDRO CO[C@]1(C)CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000280647278 521753074 /nfs/dbraw/zinc/75/30/74/521753074.db2.gz YUNRUGJUBYLTHQ-XJKSGUPXSA-N 1 0 292.379 3.547 20 5 CHBDRO COC1(C[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000277063433 522640842 /nfs/dbraw/zinc/64/08/42/522640842.db2.gz IEXJAJOYUMDBSU-QWHCGFSZSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000037010457 522655109 /nfs/dbraw/zinc/65/51/09/522655109.db2.gz HRXHUQAFNAQUIR-INIZCTEOSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000037010533 522659230 /nfs/dbraw/zinc/65/92/30/522659230.db2.gz BOSODAXMBBJSDH-AWEZNQCLSA-N 1 0 276.361 3.897 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000037010509 522700257 /nfs/dbraw/zinc/70/02/57/522700257.db2.gz ZBVJFJFYGXWTKP-WFASDCNBSA-N 1 0 285.347 3.792 20 5 CHBDRO CC[C@H]([NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000294378988 522761513 /nfs/dbraw/zinc/76/15/13/522761513.db2.gz BKCNMSHGZKJGAZ-DMEJVMROSA-N 1 0 292.379 3.592 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000149558880 522863697 /nfs/dbraw/zinc/86/36/97/522863697.db2.gz HDTSXUWPIVSENS-ZIAGYGMSSA-N 1 0 280.393 3.531 20 5 CHBDRO COc1ccc(C[NH2+][C@@H](C)c2cccs2)cc1[N+](=O)[O-] ZINC000035737060 524083469 /nfs/dbraw/zinc/08/34/69/524083469.db2.gz KPKRNXYQXFOYMG-JTQLQIEISA-N 1 0 292.360 3.516 20 5 CHBDRO Cc1ccc(C)c(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000048068868 524103937 /nfs/dbraw/zinc/10/39/37/524103937.db2.gz HBQASISOLAQBMG-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO Cc1cccc(C(C)(C)[NH2+]Cc2csc([N+](=O)[O-])c2)c1 ZINC000130442635 524233016 /nfs/dbraw/zinc/23/30/16/524233016.db2.gz OTSCHCRDMPGJRH-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000339919922 524300634 /nfs/dbraw/zinc/30/06/34/524300634.db2.gz DSCAZKPFLONZNO-ZYHUDNBSSA-N 1 0 268.382 3.667 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc([N+](=O)[O-])cc1 ZINC000130587255 525581852 /nfs/dbraw/zinc/58/18/52/525581852.db2.gz NJRUIQQKHGTNJA-MEDUHNTESA-N 1 0 298.342 3.639 20 5 CHBDRO Cc1ccoc1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000293385243 525807872 /nfs/dbraw/zinc/80/78/72/525807872.db2.gz IMVHAJPXAJLXSO-OAHLLOKOSA-N 1 0 286.331 3.663 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C2CCCCC2)cccc1[N+](=O)[O-] ZINC000152982849 525892440 /nfs/dbraw/zinc/89/24/40/525892440.db2.gz LJSSAWCUZUVNGH-GFCCVEGCSA-N 1 0 262.353 3.887 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289647962 526118674 /nfs/dbraw/zinc/11/86/74/526118674.db2.gz DPNWYLLAMMMXHU-GHMZBOCLSA-N 1 0 284.306 3.633 20 5 CHBDRO Cc1nc(C)c([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])s1 ZINC000042273860 526746082 /nfs/dbraw/zinc/74/60/82/526746082.db2.gz LLTIBAKWZMSMCX-SECBINFHSA-N 1 0 291.376 3.519 20 5 CHBDRO CC[NH+](CC)CCCSCc1ccc([N+](=O)[O-])cc1 ZINC000355939690 528113591 /nfs/dbraw/zinc/11/35/91/528113591.db2.gz IQQUGNLSZXKFSV-UHFFFAOYSA-N 1 0 282.409 3.560 20 5 CHBDRO CCS[C@H]1CCCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000353611235 529225325 /nfs/dbraw/zinc/22/53/25/529225325.db2.gz YEQYOQKPFKENDO-HNNXBMFYSA-N 1 0 294.420 3.702 20 5 CHBDRO CC[C@@H]([NH2+]CCC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000036721092 1117747674 /nfs/dbraw/zinc/74/76/74/1117747674.db2.gz AUVWFTAMNICEFP-CQSZACIVSA-N 1 0 250.342 3.682 20 5 CHBDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000042857665 1121317999 /nfs/dbraw/zinc/31/79/99/1121317999.db2.gz SUOAJIIYZYGFSE-STQMWFEESA-N 1 0 262.353 3.511 20 5 CHBDRO CC[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)F ZINC000852097628 1123397450 /nfs/dbraw/zinc/39/74/50/1123397450.db2.gz YBXMHHQKHLNGRO-WDEREUQCSA-N 1 0 286.322 3.927 20 5 CHBDRO CC[C@H](CCC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000872047774 1124665400 /nfs/dbraw/zinc/66/54/00/1124665400.db2.gz VKOXPZUYVMUGFU-LLVKDONJSA-N 1 0 290.285 3.806 20 5 CHBDRO C[C@H]([NH2+]CC(C)(C)CC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000883258542 1125386320 /nfs/dbraw/zinc/38/63/20/1125386320.db2.gz GEQZXXBUCIMANQ-JTQLQIEISA-N 1 0 286.322 3.927 20 5 CHBDRO C[C@@]1([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC=CCC1 ZINC000839191718 1132190275 /nfs/dbraw/zinc/19/02/75/1132190275.db2.gz JRIVOFCJFFQFTF-CQSZACIVSA-N 1 0 280.755 3.837 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC000251997766 1125533871 /nfs/dbraw/zinc/53/38/71/1125533871.db2.gz ZSUFFIFHQVRPFH-OUCADQQQSA-N 1 0 292.379 3.518 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000348325405 1125560887 /nfs/dbraw/zinc/56/08/87/1125560887.db2.gz LJIQMYJQJGLFOH-IPYPFGDCSA-N 1 0 280.343 3.916 20 5 CHBDRO CC[C@@H](c1ccccc1)[N@H+](CC)Cc1cccnc1[N+](=O)[O-] ZINC000885969345 1125631561 /nfs/dbraw/zinc/63/15/61/1125631561.db2.gz PHEZCNDGNYBXHA-INIZCTEOSA-N 1 0 299.374 3.963 20 5 CHBDRO Cc1ccccc1[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C1CC1 ZINC000886114319 1125651236 /nfs/dbraw/zinc/65/12/36/1125651236.db2.gz MOSRIXJPQYWNQA-MRXNPFEDSA-N 1 0 297.358 3.539 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C2CCCC2)cc1[N+](=O)[O-] ZINC000152529482 1125730598 /nfs/dbraw/zinc/73/05/98/1125730598.db2.gz IEENAXNXBIVJGJ-LLVKDONJSA-N 1 0 278.352 3.587 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C23CC4CC(CC(C4)C2)C3)cs1 ZINC000037562403 1125789235 /nfs/dbraw/zinc/78/92/35/1125789235.db2.gz NWWUHLBSTCXFKA-UHFFFAOYSA-N 1 0 292.404 3.715 20 5 CHBDRO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC1CCC1 ZINC000483130628 1126769138 /nfs/dbraw/zinc/76/91/38/1126769138.db2.gz OPWHHNZJEYKTOB-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO CC(C)[C@H](C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000484160483 1126812040 /nfs/dbraw/zinc/81/20/40/1126812040.db2.gz LJJDYSNLFPPUDW-CJNGLKHVSA-N 1 0 290.407 3.798 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCCc2ccccn2)cccc1[N+](=O)[O-] ZINC000181487802 1126856651 /nfs/dbraw/zinc/85/66/51/1126856651.db2.gz AZRLUDREQUOKRM-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000037176851 1126923808 /nfs/dbraw/zinc/92/38/08/1126923808.db2.gz OSXUTKZKHIHZJL-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000037260531 1126984289 /nfs/dbraw/zinc/98/42/89/1126984289.db2.gz GARYVBMJXARMEN-VXGBXAGGSA-N 1 0 250.342 3.680 20 5 CHBDRO C[N+](C)(C)CCOC1CCC(C2CCCCC2)CC1 ZINC001224774880 1126990034 /nfs/dbraw/zinc/99/00/34/1126990034.db2.gz GXFNXBKZVVQIHX-UHFFFAOYSA-N 1 0 268.465 3.848 20 5 CHBDRO C[C@@H](OCC[N+](C)(C)C)c1ccc(Cl)c(Cl)c1 ZINC001224775750 1126993661 /nfs/dbraw/zinc/99/36/61/1126993661.db2.gz OFQBBIXFJMZRIX-SNVBAGLBSA-N 1 0 277.215 3.777 20 5 CHBDRO CCCC(C)(C)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000111387239 1127079620 /nfs/dbraw/zinc/07/96/20/1127079620.db2.gz GBEZZWFKFQDKEM-VQHVLOKHSA-N 1 0 262.353 3.776 20 5 CHBDRO Cc1cccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000571297467 1127159346 /nfs/dbraw/zinc/15/93/46/1127159346.db2.gz NDXBCUYJVGNIBI-INIZCTEOSA-N 1 0 282.343 3.680 20 5 CHBDRO CCC[C@H](N[C@H](C)c1ccon1)c1cccc([N+](=O)[O-])c1 ZINC000349832913 1127163578 /nfs/dbraw/zinc/16/35/78/1127163578.db2.gz KDNURFWQJZHECT-ABAIWWIYSA-N 1 0 289.335 3.775 20 5 CHBDRO CC(C)CCC[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000571779775 1127177197 /nfs/dbraw/zinc/17/71/97/1127177197.db2.gz YHLLDUNXIHETAV-UHFFFAOYSA-N 1 0 264.369 3.505 20 5 CHBDRO CC[C@H]1CC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000588230222 1127181955 /nfs/dbraw/zinc/18/19/55/1127181955.db2.gz JFQMPYZVKQLUPR-GXFFZTMASA-N 1 0 282.771 3.569 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1C=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000698194857 1127189374 /nfs/dbraw/zinc/18/93/74/1127189374.db2.gz HJSRWVVVRPQWRQ-DZGCQCFKSA-N 1 0 260.337 3.744 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC(C2CC2)CC1 ZINC000590052721 1127246555 /nfs/dbraw/zinc/24/65/55/1127246555.db2.gz IASIVNWRWDBPPE-HWKANZROSA-N 1 0 286.375 3.730 20 5 CHBDRO Cc1ccnc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000285975202 1127250675 /nfs/dbraw/zinc/25/06/75/1127250675.db2.gz HJGHYRXNSFKUJA-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)cs1 ZINC000353897341 1127276673 /nfs/dbraw/zinc/27/66/73/1127276673.db2.gz HXLTZPFZBDMKHE-HNNXBMFYSA-N 1 0 292.404 3.979 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@@H](F)C1)CCCC2 ZINC000591348167 1127299149 /nfs/dbraw/zinc/29/91/49/1127299149.db2.gz AXBFKUZLDQVIRO-XJKCOSOUSA-N 1 0 292.354 3.843 20 5 CHBDRO Cc1ccccc1C1([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000592139417 1127338426 /nfs/dbraw/zinc/33/84/26/1127338426.db2.gz FRTHRAATWISQGB-UHFFFAOYSA-N 1 0 282.343 3.682 20 5 CHBDRO Cc1ccc(C[NH2+]C2(c3ccccc3C)CC2)cc1[N+](=O)[O-] ZINC000592372855 1127343633 /nfs/dbraw/zinc/34/36/33/1127343633.db2.gz WRGQTBRVAMAPNC-UHFFFAOYSA-N 1 0 296.370 3.991 20 5 CHBDRO Cc1ccc(C[NH2+]CC2CCC(F)CC2)cc1[N+](=O)[O-] ZINC000592377531 1127346285 /nfs/dbraw/zinc/34/62/85/1127346285.db2.gz UTLLVBNVUTZMKU-UHFFFAOYSA-N 1 0 280.343 3.521 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000592400815 1127373061 /nfs/dbraw/zinc/37/30/61/1127373061.db2.gz WBQMUGPBLGZQIE-REWJHTLYSA-N 1 0 274.364 3.742 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C)SC2)cc1[N+](=O)[O-] ZINC000594497775 1127418077 /nfs/dbraw/zinc/41/80/77/1127418077.db2.gz GEEXERIIBDTGIS-OBJOEFQTSA-N 1 0 294.420 3.838 20 5 CHBDRO Cc1cc[nH+]c(NCc2csc([N+](=O)[O-])c2)c1C1CC1 ZINC000594969862 1127437502 /nfs/dbraw/zinc/43/75/02/1127437502.db2.gz RFBXXPWUQJWDET-UHFFFAOYSA-N 1 0 289.360 3.849 20 5 CHBDRO Cc1cc(C)cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000594973697 1127437969 /nfs/dbraw/zinc/43/79/69/1127437969.db2.gz PNQSXWGBKZRDNS-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@]1(C)CC1(F)F ZINC000594976367 1127438106 /nfs/dbraw/zinc/43/81/06/1127438106.db2.gz BGOZHYUJLYOTEL-JBNJFFQFSA-N 1 0 296.317 3.633 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@]23C[C@H]2CCC3)cc1[N+](=O)[O-] ZINC000594954035 1127440011 /nfs/dbraw/zinc/44/00/11/1127440011.db2.gz WSLZBZMFSXQPAR-CZUORRHYSA-N 1 0 274.364 3.750 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2CC(CF)(CF)C2)cc1[N+](=O)[O-] ZINC000595025021 1127442960 /nfs/dbraw/zinc/44/29/60/1127442960.db2.gz DOXARHMDTCORRC-NSHDSACASA-N 1 0 298.333 3.642 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000594992486 1127444452 /nfs/dbraw/zinc/44/44/52/1127444452.db2.gz FPGMMYVEXWAUFL-UHFFFAOYSA-N 1 0 274.364 3.572 20 5 CHBDRO CCOC1CCC([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000595029260 1127449421 /nfs/dbraw/zinc/44/94/21/1127449421.db2.gz YEFFKJHPHLMCDH-HSBZDZAISA-N 1 0 292.379 3.593 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CC12CCCC2 ZINC000595044181 1127450618 /nfs/dbraw/zinc/45/06/18/1127450618.db2.gz LTODJTALJWHWNK-XHDPSFHLSA-N 1 0 290.363 3.587 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CC12CCCC2 ZINC000595044177 1127450739 /nfs/dbraw/zinc/45/07/39/1127450739.db2.gz LTODJTALJWHWNK-ABAIWWIYSA-N 1 0 290.363 3.587 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)O1)c1cccc([N+](=O)[O-])c1 ZINC000595079264 1127453604 /nfs/dbraw/zinc/45/36/04/1127453604.db2.gz JHTQXYRYAJHCON-KCXAZCMYSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000595093885 1127454767 /nfs/dbraw/zinc/45/47/67/1127454767.db2.gz PTFQHGBLAGMESF-BXKDBHETSA-N 1 0 284.306 3.537 20 5 CHBDRO CC(C)CC1([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000595095380 1127455557 /nfs/dbraw/zinc/45/55/57/1127455557.db2.gz LZJXDRPTNKSMMT-LBPRGKRZSA-N 1 0 262.353 3.824 20 5 CHBDRO CCSC1(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000595098507 1127456149 /nfs/dbraw/zinc/45/61/49/1127456149.db2.gz GUTPARRPPZJAOU-LBPRGKRZSA-N 1 0 294.420 3.840 20 5 CHBDRO CCN(CCC(F)(F)F)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595300338 1127457992 /nfs/dbraw/zinc/45/79/92/1127457992.db2.gz ABAXGYFNBIPZDA-UHFFFAOYSA-N 1 0 294.248 3.508 20 5 CHBDRO Cc1noc(C[NH2+][C@H]2CCCC[C@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595364508 1127461539 /nfs/dbraw/zinc/46/15/39/1127461539.db2.gz SMTBPKHUYUEWQG-NEPJUHHUSA-N 1 0 295.383 3.586 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000293579568 1127506601 /nfs/dbraw/zinc/50/66/01/1127506601.db2.gz DVCFOTSYLWRQNX-QWHCGFSZSA-N 1 0 299.374 3.897 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000293807241 1127522045 /nfs/dbraw/zinc/52/20/45/1127522045.db2.gz RIUIKOXVSRUYSA-WBMJQRKESA-N 1 0 299.374 3.979 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000293807238 1127522144 /nfs/dbraw/zinc/52/21/44/1127522144.db2.gz RIUIKOXVSRUYSA-MLGOLLRUSA-N 1 0 299.374 3.979 20 5 CHBDRO CC[C@@H](C)[C@H](C)[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000060562502 1127544409 /nfs/dbraw/zinc/54/44/09/1127544409.db2.gz FTASCVBBXDRLPF-OLZOCXBDSA-N 1 0 276.380 3.994 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000602504114 1127587799 /nfs/dbraw/zinc/58/77/99/1127587799.db2.gz SIQOBSURPOGPMN-MRVPVSSYSA-N 1 0 288.269 3.502 20 5 CHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CC1(F)F ZINC000602560635 1127593184 /nfs/dbraw/zinc/59/31/84/1127593184.db2.gz ODBFJCVENKCRMK-BXUZGUMPSA-N 1 0 298.333 3.551 20 5 CHBDRO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294889016 1127606222 /nfs/dbraw/zinc/60/62/22/1127606222.db2.gz VEZHBMKBBYDJJT-GFCCVEGCSA-N 1 0 297.358 3.517 20 5 CHBDRO CSC1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000602924395 1127622454 /nfs/dbraw/zinc/62/24/54/1127622454.db2.gz VRYKBBMYHYEGAB-LBPRGKRZSA-N 1 0 294.420 3.792 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CC1(F)F ZINC000598677583 1127631089 /nfs/dbraw/zinc/63/10/89/1127631089.db2.gz PLLBRNXBXSIEBM-DGCLKSJQSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2CC(C)C2)cccc1[N+](=O)[O-] ZINC000598678902 1127631130 /nfs/dbraw/zinc/63/11/30/1127631130.db2.gz AKCVPPPLFAUJTB-YXMLORGKSA-N 1 0 262.353 3.600 20 5 CHBDRO CCC[C@H](C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)OCC ZINC000599057944 1127653543 /nfs/dbraw/zinc/65/35/43/1127653543.db2.gz CUJYMZIBXZLICT-UKRRQHHQSA-N 1 0 294.395 3.759 20 5 CHBDRO CCC[C@@H](C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)OCC ZINC000599057942 1127653734 /nfs/dbraw/zinc/65/37/34/1127653734.db2.gz CUJYMZIBXZLICT-HIFRSBDPSA-N 1 0 294.395 3.759 20 5 CHBDRO CCCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C(C)C ZINC000603845649 1127676144 /nfs/dbraw/zinc/67/61/44/1127676144.db2.gz DXNCMBIANJCIMX-UHFFFAOYSA-N 1 0 264.369 3.995 20 5 CHBDRO CCCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000603849965 1127676680 /nfs/dbraw/zinc/67/66/80/1127676680.db2.gz ZXLDVWMCBUACMK-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@H+](C2CC2)C2CCCCC2)cc1 ZINC000603875064 1127679956 /nfs/dbraw/zinc/67/99/56/1127679956.db2.gz ZMCGMWDQAYEPPG-UHFFFAOYSA-N 1 0 288.391 3.934 20 5 CHBDRO CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H](C)C(C)C ZINC000604475236 1127706499 /nfs/dbraw/zinc/70/64/99/1127706499.db2.gz QXUQJPUMGJYNQM-CQSZACIVSA-N 1 0 294.395 3.730 20 5 CHBDRO CCC(CC)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1)SC ZINC000230707735 1127772390 /nfs/dbraw/zinc/77/23/90/1127772390.db2.gz UMNPKABKAOGZOL-UHFFFAOYSA-N 1 0 282.409 3.606 20 5 CHBDRO CC(C)(C)C1=CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000533957637 1127778741 /nfs/dbraw/zinc/77/87/41/1127778741.db2.gz CUHRVJSPSKHBMK-UHFFFAOYSA-N 1 0 274.364 3.773 20 5 CHBDRO CCc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc1 ZINC000411472370 1127861206 /nfs/dbraw/zinc/86/12/06/1127861206.db2.gz HLZFDXYASCZRLQ-CYBMUJFWSA-N 1 0 299.374 3.711 20 5 CHBDRO CC1(C)C[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836557 1127889532 /nfs/dbraw/zinc/88/95/32/1127889532.db2.gz SBQCICMPBGEJLR-OAHLLOKOSA-N 1 0 286.331 3.743 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000539500758 1127925763 /nfs/dbraw/zinc/92/57/63/1127925763.db2.gz OZOFEJZYCHAHQZ-VNHYZAJKSA-N 1 0 274.364 3.653 20 5 CHBDRO Cc1ccc(C[N@@H+]2C[C@H](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000539824828 1127941298 /nfs/dbraw/zinc/94/12/98/1127941298.db2.gz LGHUFINXMASNRK-YPMHNXCESA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000466903938 1127949480 /nfs/dbraw/zinc/94/94/80/1127949480.db2.gz BALZSDCOPXRKLB-RISCZKNCSA-N 1 0 262.353 3.524 20 5 CHBDRO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000543979973 1127954476 /nfs/dbraw/zinc/95/44/76/1127954476.db2.gz BCIUSASXWDJJEY-QWHCGFSZSA-N 1 0 299.374 3.964 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000540153217 1127965078 /nfs/dbraw/zinc/96/50/78/1127965078.db2.gz AUAQDBAPUJPEBU-ZDUSSCGKSA-N 1 0 276.380 3.990 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC[C@H](C)C1 ZINC000468257581 1127999623 /nfs/dbraw/zinc/99/96/23/1127999623.db2.gz SUNANIUJYJEGTC-STQMWFEESA-N 1 0 262.353 3.778 20 5 CHBDRO CS[C@@H]1CCCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468258100 1128000153 /nfs/dbraw/zinc/00/01/53/1128000153.db2.gz AVGHYVXOISAXKT-CHWSQXEVSA-N 1 0 294.420 3.873 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)CC(F)(F)F ZINC000545236198 1128007092 /nfs/dbraw/zinc/00/70/92/1128007092.db2.gz WSQRZKLQXJGGKY-ZJUUUORDSA-N 1 0 290.285 3.895 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@@]1(C)CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000094797515 1128057982 /nfs/dbraw/zinc/05/79/82/1128057982.db2.gz YECDNJZWJQUDMG-HZPDHXFCSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000470170767 1128063904 /nfs/dbraw/zinc/06/39/04/1128063904.db2.gz ADDAQDMDIZXACR-LCYFTJDESA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccco1 ZINC000470175315 1128064554 /nfs/dbraw/zinc/06/45/54/1128064554.db2.gz PWJROLPYXWBNJE-LCYFTJDESA-N 1 0 286.331 3.723 20 5 CHBDRO CCC(C)(C)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000471023208 1128085277 /nfs/dbraw/zinc/08/52/77/1128085277.db2.gz SXWHSQOCQWGGMO-UHFFFAOYSA-N 1 0 270.760 3.869 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H](CC)C2)ccc1[N+](=O)[O-] ZINC000492542637 1128102203 /nfs/dbraw/zinc/10/22/03/1128102203.db2.gz XGEUFIOKWUQPGQ-CYBMUJFWSA-N 1 0 292.379 3.616 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@@H](C)CC2(C)C)ccc1[N+](=O)[O-] ZINC000492789869 1128113131 /nfs/dbraw/zinc/11/31/31/1128113131.db2.gz NRBANUSMXIWSAQ-LBPRGKRZSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1cccc2c1[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC000925310425 1128127841 /nfs/dbraw/zinc/12/78/41/1128127841.db2.gz AFIZTRYBTKZSTG-INIZCTEOSA-N 1 0 282.343 3.680 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)s1 ZINC000761522449 1128132583 /nfs/dbraw/zinc/13/25/83/1128132583.db2.gz QHIOTTZTPQTUBM-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO CC[C@H]1CCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761528332 1128133889 /nfs/dbraw/zinc/13/38/89/1128133889.db2.gz QQAFXVASARCYKD-WCQYABFASA-N 1 0 282.771 3.917 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1C(C)(C)C ZINC000609195399 1128170937 /nfs/dbraw/zinc/17/09/37/1128170937.db2.gz DTSZDPVPVXXFFH-OAHLLOKOSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@H](C)[C@@H](C)[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000609204311 1128173303 /nfs/dbraw/zinc/17/33/03/1128173303.db2.gz FTASCVBBXDRLPF-QWHCGFSZSA-N 1 0 276.380 3.994 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035081395 1128255692 /nfs/dbraw/zinc/25/56/92/1128255692.db2.gz QNPWRBLRSOOYRU-SNVBAGLBSA-N 1 0 270.760 3.772 20 5 CHBDRO C[C@@H]([NH2+]C[C@]12C[C@H]1CCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000927122163 1128220111 /nfs/dbraw/zinc/22/01/11/1128220111.db2.gz ODXUAKKROZCTNH-HFAKWTLXSA-N 1 0 278.327 3.575 20 5 CHBDRO Cc1cscc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000094877794 1128237094 /nfs/dbraw/zinc/23/70/94/1128237094.db2.gz FDKFGVCNXBWMFZ-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000089512602 1128295832 /nfs/dbraw/zinc/29/58/32/1128295832.db2.gz FJLKYTZXILJOJY-UONOGXRCSA-N 1 0 284.359 3.877 20 5 CHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000915685329 1128333973 /nfs/dbraw/zinc/33/39/73/1128333973.db2.gz VEFPDVRKNMDXGB-FZMZJTMJSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H]1CCC[N@H+](CCCCNc2ccccc2[N+](=O)[O-])C1 ZINC000301119365 1128390710 /nfs/dbraw/zinc/39/07/10/1128390710.db2.gz VTDDAXNEUALYSM-CQSZACIVSA-N 1 0 291.395 3.519 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000916369079 1128417607 /nfs/dbraw/zinc/41/76/07/1128417607.db2.gz KXGAAPDLFYTUAY-CYBMUJFWSA-N 1 0 282.343 3.714 20 5 CHBDRO CC(C)CN(Cc1ccccn1)Cc1ccccc1[N+](=O)[O-] ZINC000932443310 1128410016 /nfs/dbraw/zinc/41/00/16/1128410016.db2.gz QAYMKTVGPKDPFM-UHFFFAOYSA-N 1 0 299.374 3.648 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1cncs1 ZINC000934194815 1128453592 /nfs/dbraw/zinc/45/35/92/1128453592.db2.gz HPPMIMUIMVJBTI-MNOVXSKESA-N 1 0 291.376 3.772 20 5 CHBDRO COc1cc(C[NH2+]C2[C@@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000564070661 1128492221 /nfs/dbraw/zinc/49/22/21/1128492221.db2.gz YZQUSEISOFHPOO-RYUDHWBXSA-N 1 0 292.379 3.518 20 5 CHBDRO CC(C)CC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000042338336 1128573446 /nfs/dbraw/zinc/57/34/46/1128573446.db2.gz UAGRMBHJNFIBGB-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCCc3ccccc3C2)cc1 ZINC000498904932 1128618784 /nfs/dbraw/zinc/61/87/84/1128618784.db2.gz LXLJOWVGUTVERK-UHFFFAOYSA-N 1 0 296.370 3.586 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000570611840 1128628366 /nfs/dbraw/zinc/62/83/66/1128628366.db2.gz ADEHSSFXVSABCO-INIZCTEOSA-N 1 0 286.375 3.668 20 5 CHBDRO CC[C@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000556895059 1128635410 /nfs/dbraw/zinc/63/54/10/1128635410.db2.gz HWIWJMUEQGUOFS-MQMHXKEQSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)nc1C ZINC000556888224 1128635869 /nfs/dbraw/zinc/63/58/69/1128635869.db2.gz GMUXNWGOIRRWGN-CQSZACIVSA-N 1 0 299.374 3.766 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc([C@@H]3CCC[NH2+]3)cc2)cc1 ZINC000600783012 1128680964 /nfs/dbraw/zinc/68/09/64/1128680964.db2.gz BQCJHBPGWWMSKC-INIZCTEOSA-N 1 0 268.316 3.686 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1-c1cccc([C@H]2CCC[NH2+]2)c1 ZINC000600788185 1128680979 /nfs/dbraw/zinc/68/09/79/1128680979.db2.gz CUNCXQFWTOKMLP-OAHLLOKOSA-N 1 0 286.306 3.825 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C3CC[NH2+]CC3)cc2)cc1 ZINC000600783720 1128681044 /nfs/dbraw/zinc/68/10/44/1128681044.db2.gz GVJVFSCQJATDII-UHFFFAOYSA-N 1 0 282.343 3.729 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1CCCC12CC2 ZINC000601138115 1128700317 /nfs/dbraw/zinc/70/03/17/1128700317.db2.gz PDEZHYFFCYLZDH-VOKGJARPSA-N 1 0 272.348 3.530 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000578403733 1128716661 /nfs/dbraw/zinc/71/66/61/1128716661.db2.gz RXINZOYANGBZFK-GFCCVEGCSA-N 1 0 250.342 3.605 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609631874 1128721404 /nfs/dbraw/zinc/72/14/04/1128721404.db2.gz BPKRWLMLQKSMLZ-ZDUSSCGKSA-N 1 0 294.370 3.992 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000609766728 1128725176 /nfs/dbraw/zinc/72/51/76/1128725176.db2.gz JUDJGRRCFURRHG-LLVKDONJSA-N 1 0 268.382 3.668 20 5 CHBDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610001969 1128734031 /nfs/dbraw/zinc/73/40/31/1128734031.db2.gz PVAFRERVEVUQMX-XJKSGUPXSA-N 1 0 276.380 3.995 20 5 CHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CCC1 ZINC000610001965 1128734159 /nfs/dbraw/zinc/73/41/59/1128734159.db2.gz POGUFZQCLDICTH-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000610080189 1128737855 /nfs/dbraw/zinc/73/78/55/1128737855.db2.gz WHEFJLSQFUUQMW-CQSZACIVSA-N 1 0 292.379 3.758 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000610080161 1128738236 /nfs/dbraw/zinc/73/82/36/1128738236.db2.gz KFWQRTQAMTVOHN-GFCCVEGCSA-N 1 0 268.382 3.811 20 5 CHBDRO Cc1cc(NC[C@@H](C)[N@@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000510096002 1117882245 /nfs/dbraw/zinc/88/22/45/1117882245.db2.gz VQUJWRPEDIFWKW-ZIAGYGMSSA-N 1 0 291.395 3.578 20 5 CHBDRO COc1ccc(C[N@H+](C)C2CCCCCC2)cc1[N+](=O)[O-] ZINC000097472612 1117895582 /nfs/dbraw/zinc/89/55/82/1117895582.db2.gz CWUFLIKSBWQJJH-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO CC[C@H](CO)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000073221839 1117947848 /nfs/dbraw/zinc/94/78/48/1117947848.db2.gz KKBQLHDHLRUTGI-MRXNPFEDSA-N 1 0 279.383 3.854 20 5 CHBDRO Cc1cc(C)cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000038076767 1118077167 /nfs/dbraw/zinc/07/71/67/1118077167.db2.gz ZLTRDRSTYVBFOX-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO O=[N+]([O-])c1cccc(Nc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC001204455927 1118085379 /nfs/dbraw/zinc/08/53/79/1118085379.db2.gz GDSODSABEKDCMZ-UHFFFAOYSA-N 1 0 297.358 3.934 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1F ZINC000610340765 1118333506 /nfs/dbraw/zinc/33/35/06/1118333506.db2.gz VZZPZJATFWHMFF-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000610369521 1118362563 /nfs/dbraw/zinc/36/25/63/1118362563.db2.gz KUFNWEVDXSFLNZ-OLZOCXBDSA-N 1 0 286.331 3.738 20 5 CHBDRO C[NH+](C)[C@H]1CCCC[C@@H]1Nc1cc([N+](=O)[O-])ccc1Cl ZINC001168601579 1118368121 /nfs/dbraw/zinc/36/81/21/1118368121.db2.gz PHJLEIGMDZOGAU-JSGCOSHPSA-N 1 0 297.786 3.533 20 5 CHBDRO C[C@H](Cc1ccco1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963512 1118387924 /nfs/dbraw/zinc/38/79/24/1118387924.db2.gz SQKUJTINEBCRQX-SNVBAGLBSA-N 1 0 294.738 3.562 20 5 CHBDRO C[C@@H](Cc1ccco1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963511 1118388177 /nfs/dbraw/zinc/38/81/77/1118388177.db2.gz SQKUJTINEBCRQX-JTQLQIEISA-N 1 0 294.738 3.562 20 5 CHBDRO C[C@@H]([N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])C1(C)CC1 ZINC000255331688 1118415160 /nfs/dbraw/zinc/41/51/60/1118415160.db2.gz DSNUFLJBKYPHLY-FWPCIQOSSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1ccc(CC[NH+](C)C)cc1 ZINC001211290167 1118498319 /nfs/dbraw/zinc/49/83/19/1118498319.db2.gz QQNQMMABNPTXBF-UHFFFAOYSA-N 1 0 299.374 3.751 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCc1ccccc1 ZINC000050508414 1118505077 /nfs/dbraw/zinc/50/50/77/1118505077.db2.gz UFZOVAVFXUTPDZ-CQSZACIVSA-N 1 0 284.359 3.830 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)C(F)(F)F ZINC000548157555 1118554487 /nfs/dbraw/zinc/55/44/87/1118554487.db2.gz KWUPJSREKWIAHA-ZJUUUORDSA-N 1 0 290.285 3.752 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCOC2CCCC2)cccc1[N+](=O)[O-] ZINC000178071590 1118623159 /nfs/dbraw/zinc/62/31/59/1118623159.db2.gz ASMSBOXRIKGOKF-ZDUSSCGKSA-N 1 0 292.379 3.513 20 5 CHBDRO C[C@@H]([NH2+]C[C@H](C)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000098005625 1118686920 /nfs/dbraw/zinc/68/69/20/1118686920.db2.gz LNSOHVPZSDGHHI-NWDGAFQWSA-N 1 0 264.369 3.928 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@H]2CCCF)cc1 ZINC000510696559 1118788446 /nfs/dbraw/zinc/78/84/46/1118788446.db2.gz RESFNKGNUXZNKJ-DZGCQCFKSA-N 1 0 280.343 3.603 20 5 CHBDRO CCC[C@H]([NH2+]CCOC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000308733233 1118844149 /nfs/dbraw/zinc/84/41/49/1118844149.db2.gz KJINPWWFIUGHBN-HNNXBMFYSA-N 1 0 294.395 3.841 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3C4CCC3CC4)o2)c1 ZINC000535782610 1118884169 /nfs/dbraw/zinc/88/41/69/1118884169.db2.gz BSTYXYGQAZWXEB-UHFFFAOYSA-N 1 0 298.342 3.982 20 5 CHBDRO C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CC1 ZINC000610805354 1118892919 /nfs/dbraw/zinc/89/29/19/1118892919.db2.gz VVDRCJWFNDSVSZ-MLGOLLRUSA-N 1 0 288.391 3.552 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000610830978 1118899041 /nfs/dbraw/zinc/89/90/41/1118899041.db2.gz SUTYGKDHYFTHKJ-UONOGXRCSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC[C@H]2CCCF)cccc1[N+](=O)[O-] ZINC000510995243 1118932143 /nfs/dbraw/zinc/93/21/43/1118932143.db2.gz QXICSXNQKYPVIO-ZFWWWQNUSA-N 1 0 294.370 3.911 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCCCS1)c1cccc([N+](=O)[O-])c1 ZINC000158086541 1118965671 /nfs/dbraw/zinc/96/56/71/1118965671.db2.gz SGCIIPIZCOGTIL-RISCZKNCSA-N 1 0 280.393 3.531 20 5 CHBDRO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCC1 ZINC000339005961 1119090062 /nfs/dbraw/zinc/09/00/62/1119090062.db2.gz JQAVMFBOIPNCOJ-UHFFFAOYSA-N 1 0 288.269 3.598 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000050443198 1119125084 /nfs/dbraw/zinc/12/50/84/1119125084.db2.gz KFVSEKAVZDWXKS-MFKMUULPSA-N 1 0 282.771 3.917 20 5 CHBDRO CCCCOCCC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000128024704 1119140876 /nfs/dbraw/zinc/14/08/76/1119140876.db2.gz AZOMZLCSIFFXKU-CQSZACIVSA-N 1 0 294.395 3.761 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000050225219 1119160557 /nfs/dbraw/zinc/16/05/57/1119160557.db2.gz JHGIBHIWEYZCLP-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C ZINC000226178436 1119251136 /nfs/dbraw/zinc/25/11/36/1119251136.db2.gz TVZOHZGSCWTTRA-SLEUVZQESA-N 1 0 292.379 3.518 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H](OC)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000154967677 1119324015 /nfs/dbraw/zinc/32/40/15/1119324015.db2.gz KSCWBPAKGLAJJP-LSDHHAIUSA-N 1 0 294.395 3.697 20 5 CHBDRO CC(C)C[NH+](Cc1ccccc1[N+](=O)[O-])CC(C)C ZINC000248239717 1119335571 /nfs/dbraw/zinc/33/55/71/1119335571.db2.gz NYQVMVCNPIYTIZ-UHFFFAOYSA-N 1 0 264.369 3.709 20 5 CHBDRO Cc1cc(NCC[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000583951887 1119438794 /nfs/dbraw/zinc/43/87/94/1119438794.db2.gz VVSWUFQBDZLLAJ-UHFFFAOYSA-N 1 0 291.395 3.580 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCCc2occc21 ZINC000584063067 1119469422 /nfs/dbraw/zinc/46/94/22/1119469422.db2.gz GTKQWDIJGGCKEK-HUUCEWRRSA-N 1 0 298.342 3.842 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000250898837 1119538456 /nfs/dbraw/zinc/53/84/56/1119538456.db2.gz YBBDTZRLLSIZEG-YWPYICTPSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1c(C[NH2+]CC(C)(C)CC(F)F)cccc1[N+](=O)[O-] ZINC000694014225 1119651130 /nfs/dbraw/zinc/65/11/30/1119651130.db2.gz ISTLMQCPJGSJRG-UHFFFAOYSA-N 1 0 286.322 3.674 20 5 CHBDRO CCC[C@@H]([NH2+]CC1(OC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000180201397 1119948434 /nfs/dbraw/zinc/94/84/34/1119948434.db2.gz UAXPSPCNNVQBOA-OAHLLOKOSA-N 1 0 292.379 3.595 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000180261494 1119965520 /nfs/dbraw/zinc/96/55/20/1119965520.db2.gz GWGCLDAFIPMSEB-HIFRSBDPSA-N 1 0 292.379 3.513 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000180261524 1119965695 /nfs/dbraw/zinc/96/56/95/1119965695.db2.gz GWGCLDAFIPMSEB-UKRRQHHQSA-N 1 0 292.379 3.513 20 5 CHBDRO C[C@H]([NH2+]CC(C)(C)c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000414327740 1119984893 /nfs/dbraw/zinc/98/48/93/1119984893.db2.gz NCMSYXJEIIGZJU-ZDUSSCGKSA-N 1 0 299.374 3.618 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C)[C@H]1C ZINC000470180543 1120029078 /nfs/dbraw/zinc/02/90/78/1120029078.db2.gz OQZOPUGEGPPXTC-JKOFNFNQSA-N 1 0 274.364 3.728 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C/C=C/Cl ZINC000903446561 1120109174 /nfs/dbraw/zinc/10/91/74/1120109174.db2.gz YLMORZGXYMFHBG-SWTNXBIASA-N 1 0 286.784 3.720 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)CC[C@H]1C ZINC000542701426 1120122052 /nfs/dbraw/zinc/12/20/52/1120122052.db2.gz FDIKXQCYPQTBHL-WCQYABFASA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@H](C[C@@](C)(O)CC)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000926893197 1120203650 /nfs/dbraw/zinc/20/36/50/1120203650.db2.gz QTZPEUOMVSHDPM-XPKDYRNWSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1ccccc1[C@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000062726456 1120206025 /nfs/dbraw/zinc/20/60/25/1120206025.db2.gz KEXHROPTGLNTLO-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCCCOC(C)C ZINC001168681077 1120238300 /nfs/dbraw/zinc/23/83/00/1120238300.db2.gz JUUMNPSTQUIPEJ-UHFFFAOYSA-N 1 0 279.448 3.510 20 5 CHBDRO O=[N+]([O-])c1ccccc1NCCCCC[NH+]1CCCCC1 ZINC000202011828 1120249639 /nfs/dbraw/zinc/24/96/39/1120249639.db2.gz YGBMXHDMLDBIQS-UHFFFAOYSA-N 1 0 291.395 3.663 20 5 CHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000542974914 1120305227 /nfs/dbraw/zinc/30/52/27/1120305227.db2.gz FWFFUPCSSBJMNE-COXVUDFISA-N 1 0 288.391 3.648 20 5 CHBDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000525636065 1120385195 /nfs/dbraw/zinc/38/51/95/1120385195.db2.gz DBJLNJRZWIYSKV-WDEREUQCSA-N 1 0 282.771 3.869 20 5 CHBDRO CC(C)([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000314075058 1120422156 /nfs/dbraw/zinc/42/21/56/1120422156.db2.gz VJJZNANRQQCPCK-UHFFFAOYSA-N 1 0 284.359 3.662 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@H]1CC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000417340144 1120428619 /nfs/dbraw/zinc/42/86/19/1120428619.db2.gz ACKFVKLNWGLSBP-UKRRQHHQSA-N 1 0 274.364 3.826 20 5 CHBDRO CC[C@@H](C)C[N@H+](CC)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000466201939 1120448676 /nfs/dbraw/zinc/44/86/76/1120448676.db2.gz KNCRIXHCPQLNIH-LLVKDONJSA-N 1 0 298.358 3.611 20 5 CHBDRO CCC[C@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618561388 1128918860 /nfs/dbraw/zinc/91/88/60/1128918860.db2.gz CQQUECAQFZUKAM-NHYWBVRUSA-N 1 0 262.353 3.750 20 5 CHBDRO C[C@H]([NH2+]CCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000020091139 1120482315 /nfs/dbraw/zinc/48/23/15/1120482315.db2.gz CIVBBNBGBMVLEU-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000020090654 1120492168 /nfs/dbraw/zinc/49/21/68/1120492168.db2.gz YQBJVMMZIYBROF-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO CC1CC[NH+](CCCCNc2sccc2[N+](=O)[O-])CC1 ZINC000301984681 1120513766 /nfs/dbraw/zinc/51/37/66/1120513766.db2.gz JAZMOFWZLAIPSK-UHFFFAOYSA-N 1 0 297.424 3.580 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CCC(F)(F)C1)CCC2 ZINC000618574954 1128921341 /nfs/dbraw/zinc/92/13/41/1128921341.db2.gz QMPYRXDZRTUKNE-FZMZJTMJSA-N 1 0 296.317 3.750 20 5 CHBDRO Cc1cc(N2CCC(C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302167159 1120649459 /nfs/dbraw/zinc/64/94/59/1120649459.db2.gz LBABVHLHAMWZMH-UHFFFAOYSA-N 1 0 285.347 3.688 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000302754088 1120657063 /nfs/dbraw/zinc/65/70/63/1120657063.db2.gz ZNOODGQOSSLVAM-JHJVBQTASA-N 1 0 262.353 3.634 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH+](C2CCC2)C2CCC2)cc1 ZINC000429156877 1120690513 /nfs/dbraw/zinc/69/05/13/1120690513.db2.gz SIHLZSOGXJGUJZ-UHFFFAOYSA-N 1 0 274.364 3.544 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C/C=C\C1CC1 ZINC001117745256 1120701878 /nfs/dbraw/zinc/70/18/78/1120701878.db2.gz KAUJQTCLIZKLSG-MLJFPUFMSA-N 1 0 272.348 3.554 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C/C=C/C1CC1 ZINC001117745255 1120702570 /nfs/dbraw/zinc/70/25/70/1120702570.db2.gz KAUJQTCLIZKLSG-KOUJJRQTSA-N 1 0 272.348 3.554 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CC1CCCC1 ZINC000107701345 1120722015 /nfs/dbraw/zinc/72/20/15/1120722015.db2.gz MYJMRNDGOZBTHL-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC1CCC(F)(F)CC1 ZINC000500440656 1120949154 /nfs/dbraw/zinc/94/91/54/1120949154.db2.gz MXYJHIMUYVHSOE-UHFFFAOYSA-N 1 0 298.333 3.818 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCC2CCC2)cc1[N+](=O)[O-] ZINC000163498049 1121025208 /nfs/dbraw/zinc/02/52/08/1121025208.db2.gz RHIHTDKPXSOOMA-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO Cc1c(C[N@H+]2CCCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000512203217 1121198741 /nfs/dbraw/zinc/19/87/41/1121198741.db2.gz PFGWYKPZFZOQFS-GFCCVEGCSA-N 1 0 262.353 3.668 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCC1(F)CCC1 ZINC000702504617 1121200535 /nfs/dbraw/zinc/20/05/35/1121200535.db2.gz SMYRLGVYJQFKTO-UHFFFAOYSA-N 1 0 286.734 3.620 20 5 CHBDRO CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000512224247 1121213047 /nfs/dbraw/zinc/21/30/47/1121213047.db2.gz ARUMYVDTLXJAEA-ZDUSSCGKSA-N 1 0 264.369 3.770 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000096610061 1121402968 /nfs/dbraw/zinc/40/29/68/1121402968.db2.gz VRUJQXIPJKWOAL-GFCCVEGCSA-N 1 0 264.369 3.675 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@@H]1CC=CCC1 ZINC000543621601 1121529289 /nfs/dbraw/zinc/52/92/89/1121529289.db2.gz VYKDXKKYXWAPDI-CQSZACIVSA-N 1 0 274.364 3.691 20 5 CHBDRO C[C@@H]1CC[C@H]([N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000433037399 1121532205 /nfs/dbraw/zinc/53/22/05/1121532205.db2.gz FACAXIAXFLZVDJ-LGVMCUBASA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000543631498 1121539104 /nfs/dbraw/zinc/53/91/04/1121539104.db2.gz NNLZYKUZOCVZCK-CZUORRHYSA-N 1 0 274.364 3.668 20 5 CHBDRO Nc1ccc2cc3ccc(NC4=CCOCC4)cc3[nH+]c2c1 ZINC001176148387 1121551654 /nfs/dbraw/zinc/55/16/54/1121551654.db2.gz AUIFTBOPEQQMRM-UHFFFAOYSA-N 1 0 291.354 3.686 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccnc1 ZINC000611191206 1121630962 /nfs/dbraw/zinc/63/09/62/1121630962.db2.gz KGQLVFTUCNHIBK-AWEZNQCLSA-N 1 0 299.374 3.615 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000611271342 1121634248 /nfs/dbraw/zinc/63/42/48/1121634248.db2.gz SNRPIEXWYVGVTP-BYPUDFOVSA-N 1 0 298.342 3.691 20 5 CHBDRO Cc1cccc2c1CC[C@H]2[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000611337334 1121638279 /nfs/dbraw/zinc/63/82/79/1121638279.db2.gz RYSMADKVIYNRCY-GOSISDBHSA-N 1 0 296.370 3.723 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC(F)(F)C1 ZINC000611475902 1121650919 /nfs/dbraw/zinc/65/09/19/1121650919.db2.gz PHPUFOITOBHNMH-AAEUAGOBSA-N 1 0 298.333 3.693 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCC(C)C ZINC000611515312 1121653739 /nfs/dbraw/zinc/65/37/39/1121653739.db2.gz FVASCICPBDVYAG-ZDUSSCGKSA-N 1 0 264.369 3.942 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCc2ccccc21 ZINC000611549038 1121655540 /nfs/dbraw/zinc/65/55/40/1121655540.db2.gz KVGJFCPTDAXCGL-HNNXBMFYSA-N 1 0 296.370 3.757 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC=CC23CCCCC3)cc1[N+](=O)[O-] ZINC001176994621 1121704926 /nfs/dbraw/zinc/70/49/26/1121704926.db2.gz AAHZGYWTOYUPRW-UHFFFAOYSA-N 1 0 286.375 3.978 20 5 CHBDRO C[C@@H](CCC1CC1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000398213975 1121713114 /nfs/dbraw/zinc/71/31/14/1121713114.db2.gz LACRMCQASZLKJE-RYUDHWBXSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H]1CCC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC001178386796 1121781758 /nfs/dbraw/zinc/78/17/58/1121781758.db2.gz NCHYTENKUIVJOH-DZGCQCFKSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@@H]1CCC[C@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC001178748965 1121811340 /nfs/dbraw/zinc/81/13/40/1121811340.db2.gz XYFLQBMXYSUQKW-HIFRSBDPSA-N 1 0 276.380 3.819 20 5 CHBDRO CC[C@@H]([NH2+]CC1CC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000293663034 1121816238 /nfs/dbraw/zinc/81/62/38/1121816238.db2.gz MCZYGKOVNOKNML-CYBMUJFWSA-N 1 0 284.306 3.681 20 5 CHBDRO CCC(CC)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000037775541 1129011798 /nfs/dbraw/zinc/01/17/98/1129011798.db2.gz AFRDXWNCDWHKAT-NSHDSACASA-N 1 0 250.342 3.682 20 5 CHBDRO COc1cc(C[NH2+][C@@H](C)c2ccsc2)ccc1[N+](=O)[O-] ZINC000619783805 1129013770 /nfs/dbraw/zinc/01/37/70/1129013770.db2.gz ZFMYYQPJRAKBHF-JTQLQIEISA-N 1 0 292.360 3.516 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000070113017 1121939295 /nfs/dbraw/zinc/93/92/95/1121939295.db2.gz TVZOHZGSCWTTRA-LALPHHSUSA-N 1 0 292.379 3.518 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000421376212 1122105635 /nfs/dbraw/zinc/10/56/35/1122105635.db2.gz IZYIQFMDCGVEBB-CHWSQXEVSA-N 1 0 264.369 3.552 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)c1 ZINC000503040990 1122163456 /nfs/dbraw/zinc/16/34/56/1122163456.db2.gz CWZLYRYHWOMULK-FUHWJXTLSA-N 1 0 296.370 3.531 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000503938126 1122279777 /nfs/dbraw/zinc/27/97/77/1122279777.db2.gz RDOOSGAUKGQOOP-MBNYWOFBSA-N 1 0 292.379 3.833 20 5 CHBDRO Cc1c(C[N@@H+]2CCSC(C)(C)CC2)cccc1[N+](=O)[O-] ZINC000434685646 1122394157 /nfs/dbraw/zinc/39/41/57/1122394157.db2.gz QUWAJMVCPJSZLS-UHFFFAOYSA-N 1 0 294.420 3.621 20 5 CHBDRO Cc1ccccc1C[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505596649 1122432112 /nfs/dbraw/zinc/43/21/12/1122432112.db2.gz LZNQANYFDHNCGQ-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CC1CCCC1 ZINC000435418034 1122464700 /nfs/dbraw/zinc/46/47/00/1122464700.db2.gz WAKOQUQTGPKKEO-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@H]([NH2+]CCF)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000436308457 1122538125 /nfs/dbraw/zinc/53/81/25/1122538125.db2.gz PRQOQYMHTZWENQ-JTQLQIEISA-N 1 0 294.351 3.943 20 5 CHBDRO CC[C@@H]1C[C@H]1C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001192079680 1122627669 /nfs/dbraw/zinc/62/76/69/1122627669.db2.gz CEEJCXXHHJZHQH-MNOVXSKESA-N 1 0 282.771 3.726 20 5 CHBDRO Cc1c(C[N@H+]2C[C@@H](C)CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC001192500879 1122649035 /nfs/dbraw/zinc/64/90/35/1122649035.db2.gz JUXNMROKDWDXIT-LBPRGKRZSA-N 1 0 276.380 3.771 20 5 CHBDRO Cc1c(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC001192481517 1122649615 /nfs/dbraw/zinc/64/96/15/1122649615.db2.gz NCVPHPDEZOWGAS-MJEQTWJJSA-N 1 0 288.391 3.914 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC1(c2ccccc2)CC1 ZINC000438276321 1122688965 /nfs/dbraw/zinc/68/89/65/1122688965.db2.gz LAUCBUBSSCEART-UHFFFAOYSA-N 1 0 296.370 3.758 20 5 CHBDRO CCc1cccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC001193744106 1122712156 /nfs/dbraw/zinc/71/21/56/1122712156.db2.gz ZEGSZGULKVHVPV-UHFFFAOYSA-N 1 0 298.386 3.832 20 5 CHBDRO CC[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000506324240 1122717811 /nfs/dbraw/zinc/71/78/11/1122717811.db2.gz CPNJSGVINWQAIB-UHFFFAOYSA-N 1 0 276.361 3.775 20 5 CHBDRO CCC[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000506482093 1122752573 /nfs/dbraw/zinc/75/25/73/1122752573.db2.gz RWHWRKUWJRJNDW-UHFFFAOYSA-N 1 0 274.320 3.697 20 5 CHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000506622156 1122792920 /nfs/dbraw/zinc/79/29/20/1122792920.db2.gz ALLNFCKXAVMBPQ-GFCCVEGCSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc2ccccc2[nH]1 ZINC000775626735 1122829988 /nfs/dbraw/zinc/82/99/88/1122829988.db2.gz KJTMZFJCLJZVHO-LBPRGKRZSA-N 1 0 295.342 3.927 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@H](C)[C@H]1C ZINC001195277910 1122859654 /nfs/dbraw/zinc/85/96/54/1122859654.db2.gz HDJRJOXALBBZSU-YVECIDJPSA-N 1 0 262.353 3.632 20 5 CHBDRO COc1cc(C[N@H+](C)C2CCCCC2)c([N+](=O)[O-])cc1F ZINC000184233887 1122880158 /nfs/dbraw/zinc/88/01/58/1122880158.db2.gz WRYCYEIZHGMWCX-UHFFFAOYSA-N 1 0 296.342 3.507 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507020287 1122919545 /nfs/dbraw/zinc/91/95/45/1122919545.db2.gz HHMQZBAGYQPYBH-PGJNLMOESA-N 1 0 262.353 3.728 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)[C@]23C[C@H]2CCCC3)cccc1[N+](=O)[O-] ZINC001196878187 1122936714 /nfs/dbraw/zinc/93/67/14/1122936714.db2.gz IKZNGEUXLCKGGO-UNEWFSDZSA-N 1 0 288.391 3.962 20 5 CHBDRO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000507221545 1122939828 /nfs/dbraw/zinc/93/98/28/1122939828.db2.gz LCFWDZQNIDUCEL-UHFFFAOYSA-N 1 0 286.331 3.839 20 5 CHBDRO C[N@H+](CCC1CCCCC1)Cc1cccc([N+](=O)[O-])c1 ZINC000507614665 1122977115 /nfs/dbraw/zinc/97/71/15/1122977115.db2.gz IMNVFHZMVCCMQP-UHFFFAOYSA-N 1 0 276.380 3.997 20 5 CHBDRO C[C@H](Cc1ccsc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000081599885 1122986336 /nfs/dbraw/zinc/98/63/36/1122986336.db2.gz WVXPZIXCAHCBGT-GFCCVEGCSA-N 1 0 290.388 3.719 20 5 CHBDRO Cc1ccccc1CC[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001200980742 1123065968 /nfs/dbraw/zinc/06/59/68/1123065968.db2.gz POELOCCAOUNGNR-UHFFFAOYSA-N 1 0 298.386 3.852 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC2(C3CC3)CC2)cc1[N+](=O)[O-] ZINC001201587633 1123128392 /nfs/dbraw/zinc/12/83/92/1123128392.db2.gz REZZCLMBQWHEHO-UHFFFAOYSA-N 1 0 288.391 3.998 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000294396801 1123151813 /nfs/dbraw/zinc/15/18/13/1123151813.db2.gz KUMQFQPRRKYKGN-ZDUSSCGKSA-N 1 0 276.361 3.897 20 5 CHBDRO C[C@H]1CCC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)CC1 ZINC001201823231 1123153041 /nfs/dbraw/zinc/15/30/41/1123153041.db2.gz XJWRVPUSVISHLX-ZFWWWQNUSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@H](C[NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC001201822961 1123153189 /nfs/dbraw/zinc/15/31/89/1123153189.db2.gz SRVZMESBDLPSLH-MRXNPFEDSA-N 1 0 298.386 3.921 20 5 CHBDRO CC[C@H](C)[C@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520590532 1123180765 /nfs/dbraw/zinc/18/07/65/1123180765.db2.gz LIGHQTXNIJNEPO-STQMWFEESA-N 1 0 276.380 3.994 20 5 CHBDRO Cc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000850522211 1123280249 /nfs/dbraw/zinc/28/02/49/1123280249.db2.gz IWTOIEQVGLPNOU-ZDUSSCGKSA-N 1 0 299.374 3.645 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000776884014 1123559465 /nfs/dbraw/zinc/55/94/65/1123559465.db2.gz VRHCGPQFWREJRM-RYUDHWBXSA-N 1 0 292.379 3.833 20 5 CHBDRO Cc1cccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000020526199 1123647319 /nfs/dbraw/zinc/64/73/19/1123647319.db2.gz LLGNYDBCZIMOIL-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO CCC[C@@H]([NH2+]CCOC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000777117574 1123706430 /nfs/dbraw/zinc/70/64/30/1123706430.db2.gz NDDDNFNYQPOKTR-MRXNPFEDSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000522712684 1123719672 /nfs/dbraw/zinc/71/96/72/1123719672.db2.gz AJBBDYBDMHEEFZ-CYBMUJFWSA-N 1 0 292.379 3.616 20 5 CHBDRO CC1(c2ccccc2)CC([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000545285667 1123779072 /nfs/dbraw/zinc/77/90/72/1123779072.db2.gz OLZCEHDRRWQTMX-UHFFFAOYSA-N 1 0 296.370 3.805 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000323752604 1123948104 /nfs/dbraw/zinc/94/81/04/1123948104.db2.gz SIIWLUWUFXJRCY-CYBMUJFWSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1ccc(C[NH2+]CC2CCCCC2)cc1[N+](=O)[O-] ZINC000034994772 1124021323 /nfs/dbraw/zinc/02/13/23/1124021323.db2.gz JCVDDEVEJMPPDT-UHFFFAOYSA-N 1 0 262.353 3.573 20 5 CHBDRO CC(C)[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000866274193 1124045867 /nfs/dbraw/zinc/04/58/67/1124045867.db2.gz HWINMKUHZHWDBL-KRWDZBQOSA-N 1 0 299.374 3.519 20 5 CHBDRO Cc1cc(CN(C)Cc2csc([N+](=O)[O-])c2)ccc1F ZINC000444744801 1124059132 /nfs/dbraw/zinc/05/91/32/1124059132.db2.gz OLUNRAXPYXHTMC-UHFFFAOYSA-N 1 0 294.351 3.736 20 5 CHBDRO CCc1cccnc1[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866540919 1124080599 /nfs/dbraw/zinc/08/05/99/1124080599.db2.gz SZBXLQMHKYWRHN-ZDUSSCGKSA-N 1 0 299.374 3.711 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000034995984 1124110615 /nfs/dbraw/zinc/11/06/15/1124110615.db2.gz LOZPXKQAHMTCPJ-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000035010001 1124127768 /nfs/dbraw/zinc/12/77/68/1124127768.db2.gz CCXVCVGOTGIGFA-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@H](Cc1ccco1)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872020397 1124657802 /nfs/dbraw/zinc/65/78/02/1124657802.db2.gz HANNUTNKGBXZPU-GHMZBOCLSA-N 1 0 292.310 3.609 20 5 CHBDRO CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCO1 ZINC000449169737 1124659538 /nfs/dbraw/zinc/65/95/38/1124659538.db2.gz HLSMAMHTLUSYMX-AEGPPILISA-N 1 0 292.379 3.511 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872038779 1124663389 /nfs/dbraw/zinc/66/33/89/1124663389.db2.gz OFGPIANKBMBGLB-OUAUKWLOSA-N 1 0 298.383 3.669 20 5 CHBDRO CSCCCC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038480 1124663527 /nfs/dbraw/zinc/66/35/27/1124663527.db2.gz OAWNMLDJNDWDSV-SNVBAGLBSA-N 1 0 286.372 3.528 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC=CC1 ZINC000872044629 1124665470 /nfs/dbraw/zinc/66/54/70/1124665470.db2.gz VKHNMUPFAPIRIQ-SNVBAGLBSA-N 1 0 278.377 3.686 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872053613 1124667467 /nfs/dbraw/zinc/66/74/67/1124667467.db2.gz LIZHSYNVLIPDHA-VHSXEESVSA-N 1 0 286.372 3.526 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1(C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872055123 1124667663 /nfs/dbraw/zinc/66/76/63/1124667663.db2.gz DZJLGGBZYKLESP-UWVGGRQHSA-N 1 0 266.316 3.573 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872053607 1124667724 /nfs/dbraw/zinc/66/77/24/1124667724.db2.gz LIZHSYNVLIPDHA-NXEZZACHSA-N 1 0 286.372 3.526 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CC12CC2 ZINC000872081690 1124677166 /nfs/dbraw/zinc/67/71/66/1124677166.db2.gz JIYDBNHYMWJAKW-NOZJJQNGSA-N 1 0 278.377 3.520 20 5 CHBDRO CC[C@H]([NH2+]CCC(C)(C)COC)c1cccc([N+](=O)[O-])c1 ZINC000872105163 1124683822 /nfs/dbraw/zinc/68/38/22/1124683822.db2.gz BNMZUQALTNNVFC-HNNXBMFYSA-N 1 0 294.395 3.698 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C2CC(C)(F)C2)cc1[N+](=O)[O-] ZINC000449369810 1124703267 /nfs/dbraw/zinc/70/32/67/1124703267.db2.gz GFFHHVMAIHOIGQ-UHFFFAOYSA-N 1 0 280.343 3.698 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H]3C3CC3)o2)c1 ZINC000449423986 1124732992 /nfs/dbraw/zinc/73/29/92/1124732992.db2.gz ITUJLGZWKNIMLX-INIZCTEOSA-N 1 0 298.342 3.839 20 5 CHBDRO O[C@H]1C[C@H](C[NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000873176994 1124748042 /nfs/dbraw/zinc/74/80/42/1124748042.db2.gz XFLQITNDRCJMDF-CZIWCDLHSA-N 1 0 291.394 3.854 20 5 CHBDRO C[C@H]1CCCC[C@]1(C)[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC001170947870 1131290203 /nfs/dbraw/zinc/29/02/03/1131290203.db2.gz BRWOEYZHFLVHBK-NHYWBVRUSA-N 1 0 280.343 3.792 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783676796 1125173005 /nfs/dbraw/zinc/17/30/05/1125173005.db2.gz QSKSRXXTZALKKB-SNVBAGLBSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000879749064 1125229391 /nfs/dbraw/zinc/22/93/91/1125229391.db2.gz STTFSRGMALDIRG-KRWDZBQOSA-N 1 0 297.358 3.635 20 5 CHBDRO Cc1cncc([C@H]2CCCN2Cc2ccccc2[N+](=O)[O-])c1 ZINC000879748374 1125230142 /nfs/dbraw/zinc/23/01/42/1125230142.db2.gz ICWLMFRAYJEEBT-MRXNPFEDSA-N 1 0 297.358 3.635 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000532072998 1125233150 /nfs/dbraw/zinc/23/31/50/1125233150.db2.gz WOHXTWVWGDAMRA-ZDUSSCGKSA-N 1 0 292.379 3.616 20 5 CHBDRO C[C@H]([NH2+][C@H](C1CC1)C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000324713841 1125335064 /nfs/dbraw/zinc/33/50/64/1125335064.db2.gz XCYJCHRCKVQAET-ZBEGNZNMSA-N 1 0 274.364 3.824 20 5 CHBDRO CC(C)(C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])CC(F)F ZINC000883251742 1125385080 /nfs/dbraw/zinc/38/50/80/1125385080.db2.gz AUOLZPZBVAWPDT-ALCCZGGFSA-N 1 0 298.333 3.879 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC[C@@H]2CCCC2(F)F)cc1 ZINC000883266781 1125389246 /nfs/dbraw/zinc/38/92/46/1125389246.db2.gz JIHUXWQSVCDMIF-LBPRGKRZSA-N 1 0 284.306 3.510 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC[C@@H]2CCCC2(F)F)c1 ZINC000883266676 1125389515 /nfs/dbraw/zinc/38/95/15/1125389515.db2.gz GUCXZGQDAKCWKX-LBPRGKRZSA-N 1 0 284.306 3.510 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(C)(C)C ZINC000532461878 1125394961 /nfs/dbraw/zinc/39/49/61/1125394961.db2.gz JWHGTHADLKTLPT-LLVKDONJSA-N 1 0 250.342 3.600 20 5 CHBDRO C[C@@H](C[NH2+][C@@H]1CC[C@@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000897461638 1125424169 /nfs/dbraw/zinc/42/41/69/1125424169.db2.gz UIMWOWFRCIIEHO-YNEHKIRRSA-N 1 0 294.420 3.572 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037913722 1129290513 /nfs/dbraw/zinc/29/05/13/1129290513.db2.gz NNKHXIBLCIVLKW-LLVKDONJSA-N 1 0 268.744 3.623 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000734152218 1129296095 /nfs/dbraw/zinc/29/60/95/1129296095.db2.gz HLTFWLKLIKNNIA-CYBMUJFWSA-N 1 0 294.370 3.992 20 5 CHBDRO Cc1ccccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774419 1129451717 /nfs/dbraw/zinc/45/17/17/1129451717.db2.gz LZQLVSWEYUFZCE-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2C2CCCC2)cc1F ZINC000094774714 1129452049 /nfs/dbraw/zinc/45/20/49/1129452049.db2.gz PESPLRKUUBAJEX-OAHLLOKOSA-N 1 0 292.354 3.889 20 5 CHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000741795664 1129453950 /nfs/dbraw/zinc/45/39/50/1129453950.db2.gz QKBHONMNCFYQCU-NWDGAFQWSA-N 1 0 280.343 3.744 20 5 CHBDRO CC(C)[NH+](CCCNc1cccc(F)c1[N+](=O)[O-])C(C)C ZINC000746391994 1129654942 /nfs/dbraw/zinc/65/49/42/1129654942.db2.gz RBADGJAONQAGRA-UHFFFAOYSA-N 1 0 297.374 3.655 20 5 CHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]CCC2CCCCCCC2)C1 ZINC001168976994 1129686482 /nfs/dbraw/zinc/68/64/82/1129686482.db2.gz GQEDNBXQJZGGMY-HOTGVXAUSA-N 1 0 282.428 3.772 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc2ccccc2c1 ZINC001168978243 1129686608 /nfs/dbraw/zinc/68/66/08/1129686608.db2.gz QENDDRUNGZJTCV-LBTNJELSSA-N 1 0 298.386 3.936 20 5 CHBDRO CC(C)[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168981775 1129686817 /nfs/dbraw/zinc/68/68/17/1129686817.db2.gz HGUAUMWNWMHEMD-MAZHCROVSA-N 1 0 294.370 3.558 20 5 CHBDRO CCC(CC)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168965913 1129687655 /nfs/dbraw/zinc/68/76/55/1129687655.db2.gz DJXVBDKSJBDDLZ-GOEBONIOSA-N 1 0 290.407 3.737 20 5 CHBDRO CC(C)C[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168971401 1129688531 /nfs/dbraw/zinc/68/85/31/1129688531.db2.gz KDUQFNSANIUTIV-UAGQMJEPSA-N 1 0 290.407 3.809 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H]([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169006533 1129689280 /nfs/dbraw/zinc/68/92/80/1129689280.db2.gz YRYILSXOBWFOSK-APIJFGDWSA-N 1 0 282.428 3.626 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cc(C)cc(C)c1 ZINC001169001885 1129689301 /nfs/dbraw/zinc/68/93/01/1129689301.db2.gz IHXIAIMNCGBEDG-UAGQMJEPSA-N 1 0 290.407 3.790 20 5 CHBDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169012543 1129689905 /nfs/dbraw/zinc/68/99/05/1129689905.db2.gz QXBXTIXSMMUYRF-VYDXJSESSA-N 1 0 288.391 3.577 20 5 CHBDRO Cc1ccc([C@@H]2CCC[N@@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169025016 1129691211 /nfs/dbraw/zinc/69/12/11/1129691211.db2.gz ILURVVJBSNOLED-PVAVHDDUSA-N 1 0 288.391 3.577 20 5 CHBDRO C[N@H+](Cc1ccc2ccccc2c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046787 1129691423 /nfs/dbraw/zinc/69/14/23/1129691423.db2.gz NANWOJCGYNPXLE-QAPCUYQASA-N 1 0 298.386 3.717 20 5 CHBDRO CC(C)[N@H+]([C@@H](C)c1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169048721 1129692151 /nfs/dbraw/zinc/69/21/51/1129692151.db2.gz AXLMVPHBFVVJNI-YQQAZPJKSA-N 1 0 290.407 3.903 20 5 CHBDRO Cc1ccccc1[C@H]1CCC[N@@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169055866 1129693155 /nfs/dbraw/zinc/69/31/55/1129693155.db2.gz QXBXTIXSMMUYRF-BFYDXBDKSA-N 1 0 288.391 3.577 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796541695 1129777202 /nfs/dbraw/zinc/77/72/02/1129777202.db2.gz XACADVJBMBJURR-LLVKDONJSA-N 1 0 284.306 3.695 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(F)(F)CC1 ZINC000796541696 1129777482 /nfs/dbraw/zinc/77/74/82/1129777482.db2.gz XACADVJBMBJURR-NSHDSACASA-N 1 0 284.306 3.695 20 5 CHBDRO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C(C1CC1)C1CC1 ZINC000768540908 1129860762 /nfs/dbraw/zinc/86/07/62/1129860762.db2.gz BGMMFOREYSBMKO-UHFFFAOYSA-N 1 0 294.782 3.869 20 5 CHBDRO CCO[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000902766421 1130053933 /nfs/dbraw/zinc/05/39/33/1130053933.db2.gz KFRIQZXXPZBBDL-DUVNUKRYSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccco1)c1ccccc1[N+](=O)[O-] ZINC000903245728 1130135683 /nfs/dbraw/zinc/13/56/83/1130135683.db2.gz OOEVCBVRLPTCCB-RYUDHWBXSA-N 1 0 274.320 3.642 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000903245729 1130135898 /nfs/dbraw/zinc/13/58/98/1130135898.db2.gz OOEVCBVRLPTCCB-VXGBXAGGSA-N 1 0 274.320 3.642 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])c1cscn1 ZINC000903246862 1130135908 /nfs/dbraw/zinc/13/59/08/1130135908.db2.gz XWXCYUWSYNWMAO-GHMZBOCLSA-N 1 0 291.376 3.506 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1C1CC1 ZINC000746667096 1130143449 /nfs/dbraw/zinc/14/34/49/1130143449.db2.gz VOJOANQTTLLEFU-CYBMUJFWSA-N 1 0 280.755 3.623 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000903287344 1130146518 /nfs/dbraw/zinc/14/65/18/1130146518.db2.gz OJXFOHCZPMFTAZ-BXUZGUMPSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@H]([NH2+][C@@H]1C[C@@H]2CCC[C@@H]12)c1c(F)cccc1[N+](=O)[O-] ZINC000903318539 1130153521 /nfs/dbraw/zinc/15/35/21/1130153521.db2.gz QGHNSNOIDSAJAL-MEWQQHAOSA-N 1 0 278.327 3.573 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788480515 1130189749 /nfs/dbraw/zinc/18/97/49/1130189749.db2.gz KXKCNHWOGPDNFW-ZLDLUXBVSA-N 1 0 292.354 3.887 20 5 CHBDRO c1ccc2c(c1)nc(C1=CCC[NH2+]C1)c1ccccc21 ZINC001240652580 1130402674 /nfs/dbraw/zinc/40/26/74/1130402674.db2.gz ZIEWTZUUYLJREZ-UHFFFAOYSA-N 1 0 260.340 3.765 20 5 CHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1C=CCCCCC1 ZINC001170192572 1130457418 /nfs/dbraw/zinc/45/74/18/1130457418.db2.gz AFXSKHSYSFXIFI-MRXNPFEDSA-N 1 0 288.391 3.958 20 5 CHBDRO CN(Cc1c2ccccc2cc2ccccc21)[C@H]1CC[NH2+]C1 ZINC001235738597 1130775385 /nfs/dbraw/zinc/77/53/85/1130775385.db2.gz FQFPLWAJEIIOEY-KRWDZBQOSA-N 1 0 290.410 3.787 20 5 CHBDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678029 1130846782 /nfs/dbraw/zinc/84/67/82/1130846782.db2.gz BCZSWMOMLCIVPU-GXFFZTMASA-N 1 0 282.771 3.869 20 5 CHBDRO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000784388953 1130902983 /nfs/dbraw/zinc/90/29/83/1130902983.db2.gz BDELDNHFWATTCO-LBPRGKRZSA-N 1 0 278.327 3.522 20 5 CHBDRO C[C@H]([NH2+]CCC1=CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815553033 1130998618 /nfs/dbraw/zinc/99/86/18/1130998618.db2.gz QFGAMIGAXPERBF-LBPRGKRZSA-N 1 0 289.379 3.718 20 5 CHBDRO C[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000798962429 1131064529 /nfs/dbraw/zinc/06/45/29/1131064529.db2.gz MGDDNDUWAJNSDO-CMPLNLGQSA-N 1 0 282.771 3.774 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2C[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000816646778 1131118625 /nfs/dbraw/zinc/11/86/25/1131118625.db2.gz IYCGQDQGAPHAPP-VXGBXAGGSA-N 1 0 262.353 3.558 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001170845410 1131128722 /nfs/dbraw/zinc/12/87/22/1131128722.db2.gz BEMJHWDJYILJKV-ZDUSSCGKSA-N 1 0 264.369 3.914 20 5 CHBDRO CCCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001116190632 1131133274 /nfs/dbraw/zinc/13/32/74/1131133274.db2.gz MAIIOUUJOVJGDQ-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001171087147 1131510158 /nfs/dbraw/zinc/51/01/58/1131510158.db2.gz MJCUSOMBAQSOIT-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844436101 1131563360 /nfs/dbraw/zinc/56/33/60/1131563360.db2.gz GQIKIGALNHFCQW-BXUZGUMPSA-N 1 0 296.317 3.777 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(C3CCC3)CC2)cc1Cl ZINC000846056688 1131678883 /nfs/dbraw/zinc/67/88/83/1131678883.db2.gz XEJVFHRPGUAPPR-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC2CC=CC2)cc1[N+](=O)[O-] ZINC001203149264 1131775107 /nfs/dbraw/zinc/77/51/07/1131775107.db2.gz GZAXSNRJZPSTDN-UHFFFAOYSA-N 1 0 274.364 3.774 20 5 CHBDRO C/C=C/c1ccc(OCC)c(O[C@H](C)C[N+](C)(C)C)c1 ZINC001228375193 1131869673 /nfs/dbraw/zinc/86/96/73/1131869673.db2.gz YWOVZEICLDOQHG-RCQQVGEISA-N 1 0 278.416 3.592 20 5 CHBDRO Cc1nc(-c2ccccc2O[C@H](C)C[N+](C)(C)C)cs1 ZINC001228463111 1131888112 /nfs/dbraw/zinc/88/81/12/1131888112.db2.gz VIHPBANKXWCOPK-GFCCVEGCSA-N 1 0 291.440 3.592 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000773122466 1131951930 /nfs/dbraw/zinc/95/19/30/1131951930.db2.gz UABKRYRGDRXJPS-VXGBXAGGSA-N 1 0 273.336 3.643 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000036993414 1131985546 /nfs/dbraw/zinc/98/55/46/1131985546.db2.gz WETKAWACLRXDNV-CHWSQXEVSA-N 1 0 288.347 3.778 20 5 CHBDRO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000037097275 1131994395 /nfs/dbraw/zinc/99/43/95/1131994395.db2.gz UUVHUZKKRJDHMT-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccns1)c1cccc([N+](=O)[O-])c1 ZINC000716059466 1132003800 /nfs/dbraw/zinc/00/38/00/1132003800.db2.gz ZMNKIZSZWCSJSB-GWCFXTLKSA-N 1 0 291.376 3.853 20 5 CHBDRO C[C@@H]([NH2+]C1CCCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000037177036 1132006292 /nfs/dbraw/zinc/00/62/92/1132006292.db2.gz NJLRERWYKFSFOM-GFCCVEGCSA-N 1 0 262.353 3.968 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037173074 1132007138 /nfs/dbraw/zinc/00/71/38/1132007138.db2.gz AOPWGAMCQLBOTG-SNVBAGLBSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@]1([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC=CCC1 ZINC000839191714 1132190264 /nfs/dbraw/zinc/19/02/64/1132190264.db2.gz JRIVOFCJFFQFTF-AWEZNQCLSA-N 1 0 280.755 3.837 20 5 CHBDRO Cc1cc(Cl)c(O[C@@H](C)C[N+](C)(C)C)c(Cl)c1 ZINC001231220626 1132272842 /nfs/dbraw/zinc/27/28/42/1132272842.db2.gz HXYRFARTEDBNNC-JTQLQIEISA-N 1 0 277.215 3.775 20 5 CHBDRO CCC[C@H](C)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172903826 1132347144 /nfs/dbraw/zinc/34/71/44/1132347144.db2.gz JPGZYCCXOCTCNH-SWLSCSKDSA-N 1 0 276.380 3.620 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCC1CCC1)CC2 ZINC001172902166 1132347644 /nfs/dbraw/zinc/34/76/44/1132347644.db2.gz WIWKBVVPYSBRPD-INIZCTEOSA-N 1 0 288.391 3.622 20 5 CHBDRO CCCCC[N@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907907 1132349460 /nfs/dbraw/zinc/34/94/60/1132349460.db2.gz JLIISUXECSAGIK-MRXNPFEDSA-N 1 0 290.407 3.964 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911557 1132371365 /nfs/dbraw/zinc/37/13/65/1132371365.db2.gz JPGZYCCXOCTCNH-DOMZBBRYSA-N 1 0 276.380 3.620 20 5 CHBDRO CC(C)[NH+](C(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910090 1132372035 /nfs/dbraw/zinc/37/20/35/1132372035.db2.gz WVCJIQLKRROULL-MRXNPFEDSA-N 1 0 290.407 3.961 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC12CCCCC2 ZINC001173221357 1132411119 /nfs/dbraw/zinc/41/11/19/1132411119.db2.gz MLJUCRKYYUGGKW-CJNGLKHVSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C(C)(C)CC1CC1 ZINC001173220496 1132411216 /nfs/dbraw/zinc/41/12/16/1132411216.db2.gz CJYCCRWSCSCBKU-GFCCVEGCSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC[C@@H]1C ZINC001173217902 1132411450 /nfs/dbraw/zinc/41/14/50/1132411450.db2.gz HINYDLZUIBCMOD-HEHGZKQESA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)C(C)(C)C ZINC001173215742 1132411892 /nfs/dbraw/zinc/41/18/92/1132411892.db2.gz ZBVRFRMDAFHESF-VXGBXAGGSA-N 1 0 264.369 3.550 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001173225681 1132412640 /nfs/dbraw/zinc/41/26/40/1132412640.db2.gz FISJPSFCCSNFIS-AAEUAGOBSA-N 1 0 298.333 3.503 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)[C@@H]1C ZINC001173227905 1132412686 /nfs/dbraw/zinc/41/26/86/1132412686.db2.gz SHVXPKZHKMITSG-RDBSUJKOSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)CC1CC1 ZINC001173225577 1132412819 /nfs/dbraw/zinc/41/28/19/1132412819.db2.gz SDLFBWYTFIZIRW-ZDUSSCGKSA-N 1 0 290.407 3.942 20 5 CHBDRO Cc1cccc([C@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001173231989 1132413895 /nfs/dbraw/zinc/41/38/95/1132413895.db2.gz BXZDICBYTFDADM-KGLIPLIRSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(C)CCCCC1 ZINC001173212240 1132416154 /nfs/dbraw/zinc/41/61/54/1132416154.db2.gz YBEDDLURVWNAFR-ZDUSSCGKSA-N 1 0 276.380 3.838 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC001173210719 1132416455 /nfs/dbraw/zinc/41/64/55/1132416455.db2.gz MPBMJGPVIMTWBZ-UMVBOHGHSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCCCCC1 ZINC001173213824 1132416570 /nfs/dbraw/zinc/41/65/70/1132416570.db2.gz HXOMYFPRCFVCKZ-ZDUSSCGKSA-N 1 0 276.380 3.838 20 5 CHBDRO C[C@@H]1CCC[N@@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232219883 1132438726 /nfs/dbraw/zinc/43/87/26/1132438726.db2.gz VNHKOZNOQJKORR-CYBMUJFWSA-N 1 0 277.371 3.767 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)cc1Cl ZINC000843434684 1132535020 /nfs/dbraw/zinc/53/50/20/1132535020.db2.gz MMNSEFCSRBRVKH-IJLUTSLNSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc(-c2ccc(F)cc2)c1 ZINC001233822861 1132685182 /nfs/dbraw/zinc/68/51/82/1132685182.db2.gz BDGZGHKHUFQGDC-AWEZNQCLSA-N 1 0 288.386 3.966 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1ccc([C@H]2CC[NH2+]C2)cc1 ZINC001159775556 1132906654 /nfs/dbraw/zinc/90/66/54/1132906654.db2.gz ITXJUQJTTUPKQI-AWEZNQCLSA-N 1 0 297.358 3.724 20 5 CHBDRO CC1(C)C[NH2+]Cc2cc(Nc3ccc([N+](=O)[O-])cc3)ccc21 ZINC001160286945 1132958234 /nfs/dbraw/zinc/95/82/34/1132958234.db2.gz UMFDABXPOLTJPY-UHFFFAOYSA-N 1 0 297.358 3.719 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC001174705306 1132960582 /nfs/dbraw/zinc/96/05/82/1132960582.db2.gz UFXRJWYAHLKHSB-AWEZNQCLSA-N 1 0 274.364 3.607 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H](C)[N@@H+]2CCCC[C@H]2C)c1 ZINC001162152894 1133055230 /nfs/dbraw/zinc/05/52/30/1133055230.db2.gz JKJVHHQQVCEHAL-KGLIPLIRSA-N 1 0 291.395 3.578 20 5 CHBDRO [NH3+]C1CN(Cc2ccc3ccc4cccc5ccc2c3c45)C1 ZINC001204853997 1133492588 /nfs/dbraw/zinc/49/25/88/1133492588.db2.gz GYUVEYGOOGRZAB-UHFFFAOYSA-N 1 0 286.378 3.727 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)Cc1ccsc1 ZINC001205628009 1133596248 /nfs/dbraw/zinc/59/62/48/1133596248.db2.gz CMOONERWZMBQQO-UHFFFAOYSA-N 1 0 290.388 3.905 20 5 CHBDRO CC(C)(C)c1cc(Nc2ccc(N)c([N+](=O)[O-])c2)cc[nH+]1 ZINC001209933807 1134103173 /nfs/dbraw/zinc/10/31/73/1134103173.db2.gz FKAYHQDEGYJNOU-UHFFFAOYSA-N 1 0 286.335 3.613 20 5 CHBDRO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000176444837 1134470074 /nfs/dbraw/zinc/47/00/74/1134470074.db2.gz VTFXQNQCNDTBBF-JTQLQIEISA-N 1 0 296.417 3.781 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000403400012 1134769922 /nfs/dbraw/zinc/76/99/22/1134769922.db2.gz RYBZMAHDPHWNSY-MYZSUADSSA-N 1 0 274.364 3.682 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)c(Cl)c1 ZINC000403393129 1134770657 /nfs/dbraw/zinc/77/06/57/1134770657.db2.gz SKOQYINNWAPDQJ-WZRBSPASSA-N 1 0 294.782 3.774 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)cc1[N+](=O)[O-] ZINC000403672296 1134831337 /nfs/dbraw/zinc/83/13/37/1134831337.db2.gz VGBQUIKAZGGFBV-CYUUQNCZSA-N 1 0 274.364 3.742 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@H]3CCCC[NH2+]C3)c12 ZINC001217973600 1135034104 /nfs/dbraw/zinc/03/41/04/1135034104.db2.gz YASWGFLTXKPWEI-INIZCTEOSA-N 1 0 292.382 3.909 20 5 CHBDRO C[C@@H]1C[C@H](Oc2nccc3c4ccccc4ccc32)CC[NH2+]1 ZINC001218061328 1135052468 /nfs/dbraw/zinc/05/24/68/1135052468.db2.gz PKNDFVVHIMRFFC-UKRRQHHQSA-N 1 0 292.382 3.907 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2O[C@@H]1C[C@@H]2C[NH2+]C[C@H]12 ZINC001218329306 1135088695 /nfs/dbraw/zinc/08/86/95/1135088695.db2.gz BENSNRHFCDKCJV-AYOQOUSVSA-N 1 0 289.378 3.980 20 5 CHBDRO C[C@H]1CC[C@H](Oc2nccc3c4ccccc4ccc32)C[NH2+]1 ZINC001218404040 1135100371 /nfs/dbraw/zinc/10/03/71/1135100371.db2.gz YYTLOUYFSPIQTR-ZFWWWQNUSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@@H]1C[NH2+]CC[C@H]1Oc1cccc2cc3ccccc3nc21 ZINC001218415750 1135101442 /nfs/dbraw/zinc/10/14/42/1135101442.db2.gz QAUFDPFOTLKTCH-CXAGYDPISA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@H]1C[NH2+]CC[C@@H]1Oc1nccc2c3ccccc3ccc21 ZINC001218426422 1135103002 /nfs/dbraw/zinc/10/30/02/1135103002.db2.gz WVXHKJMJDRWARB-UGSOOPFHSA-N 1 0 292.382 3.765 20 5 CHBDRO c1ccc2c(c1)nc(O[C@@H]1[C@@H]3CC[C@H]1[NH2+]C3)c1ccccc21 ZINC001218440890 1135106188 /nfs/dbraw/zinc/10/61/88/1135106188.db2.gz BDZJNPPEATZNHL-NXOUGTEYSA-N 1 0 290.366 3.517 20 5 CHBDRO Cc1ccc(CO[C@@H](C)C[N+](C)(C)C)c2ccccc12 ZINC001222796655 1135273784 /nfs/dbraw/zinc/27/37/84/1135273784.db2.gz VRYRXGWFYKLCGQ-HNNXBMFYSA-N 1 0 272.412 3.760 20 5 CHBDRO C[C@@H](OC1CCC([NH+](C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC001224021600 1135411264 /nfs/dbraw/zinc/41/12/64/1135411264.db2.gz ASXWKHOCVWMHCN-XEBKBJJBSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@@H](OCCC[N+](C)(C)C)c1cccc(Cl)c1 ZINC001224620736 1135462248 /nfs/dbraw/zinc/46/22/48/1135462248.db2.gz CKDZXVJDUZRDIV-GFCCVEGCSA-N 1 0 256.797 3.514 20 5 CHBDRO C[N+](C)(C)CCCOC1c2ccccc2Oc2ccccc21 ZINC001224623002 1135462605 /nfs/dbraw/zinc/46/26/05/1135462605.db2.gz JRXWAXSNYFMMHF-UHFFFAOYSA-N 1 0 298.406 3.995 20 5 CHBDRO CCCC[C@H](OCC[N+](C)(C)C)c1ccccc1 ZINC001224773228 1135480523 /nfs/dbraw/zinc/48/05/23/1135480523.db2.gz GNJUHJDYKTUTAQ-INIZCTEOSA-N 1 0 250.406 3.641 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccccc1Cc1ccccc1 ZINC001225222169 1135518357 /nfs/dbraw/zinc/51/83/57/1135518357.db2.gz XUWBCBPRAPKTFI-INIZCTEOSA-N 1 0 284.423 3.751 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(Cl)c2ccccc12 ZINC001225269245 1135531991 /nfs/dbraw/zinc/53/19/91/1135531991.db2.gz MXTSFKPHERELEO-GFCCVEGCSA-N 1 0 278.803 3.967 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1c(Cl)c(F)cc(F)c1Cl ZINC001226000378 1135650299 /nfs/dbraw/zinc/65/02/99/1135650299.db2.gz QNKHUARFPPZUMZ-SSDOTTSWSA-N 1 0 299.168 3.745 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc(-c2ccccc2)c1 ZINC001227540829 1135844414 /nfs/dbraw/zinc/84/44/14/1135844414.db2.gz MGRQAODZQUURIQ-OAHLLOKOSA-N 1 0 270.396 3.827 20 5 CHBDRO CCSCC[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000080530550 260180689 /nfs/dbraw/zinc/18/06/89/260180689.db2.gz PSWNEEZPXJGILY-LBPRGKRZSA-N 1 0 282.409 3.525 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000573749730 334963620 /nfs/dbraw/zinc/96/36/20/334963620.db2.gz XHVGZGLDXYUQNW-QEJZJMRPSA-N 1 0 276.380 3.988 20 5 CHBDRO COc1ccc(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000519968917 260035388 /nfs/dbraw/zinc/03/53/88/260035388.db2.gz VXLRSALXGJSINS-TZMCWYRMSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCCCCF)C2CC2)cc1 ZINC000341913955 130127134 /nfs/dbraw/zinc/12/71/34/130127134.db2.gz YATNIXKCSKNZQS-UHFFFAOYSA-N 1 0 280.343 3.699 20 5 CHBDRO C[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000342071541 130235836 /nfs/dbraw/zinc/23/58/36/130235836.db2.gz NFJYRFYTBYVULO-AOOOYVTPSA-N 1 0 268.744 3.621 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C(C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000020131478 171020020 /nfs/dbraw/zinc/02/00/20/171020020.db2.gz CCXYKKUBJCRXGH-LLVKDONJSA-N 1 0 274.364 3.742 20 5 CHBDRO CCCCC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000020560947 171251820 /nfs/dbraw/zinc/25/18/20/171251820.db2.gz HKBUJWYFHMXNQJ-LBPRGKRZSA-N 1 0 250.342 3.744 20 5 CHBDRO CCC[C@@H]([NH2+]CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000021011424 171287216 /nfs/dbraw/zinc/28/72/16/171287216.db2.gz OIMHTHNFSDLRCK-CQSZACIVSA-N 1 0 250.342 3.682 20 5 CHBDRO CCCC[NH2+][C@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000021518580 171314508 /nfs/dbraw/zinc/31/45/08/171314508.db2.gz CDJQEWHOKBGILD-CQSZACIVSA-N 1 0 250.342 3.826 20 5 CHBDRO CCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000035014109 171930859 /nfs/dbraw/zinc/93/08/59/171930859.db2.gz BYVFPVKUWJZMBV-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO CCCCC[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000035135648 172003335 /nfs/dbraw/zinc/00/33/35/172003335.db2.gz SCNLGFCEUIFDBX-GFCCVEGCSA-N 1 0 250.342 3.653 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCc2cccs2)c1 ZINC000035368133 172159935 /nfs/dbraw/zinc/15/99/35/172159935.db2.gz XHJXNSDNOPGTBQ-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO C[C@H]([NH2+]CC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000037259255 173069570 /nfs/dbraw/zinc/06/95/70/173069570.db2.gz CWGDTVMUEZMJLF-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353878478 228161806 /nfs/dbraw/zinc/16/18/06/228161806.db2.gz DEXKCVKVDVTXOY-QWRGUYRKSA-N 1 0 268.382 3.667 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H](C)C2 ZINC000180825182 260133197 /nfs/dbraw/zinc/13/31/97/260133197.db2.gz OOCLOETVRDQBOL-SCLBCKFNSA-N 1 0 296.370 3.926 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000126169152 260346216 /nfs/dbraw/zinc/34/62/16/260346216.db2.gz JIJOSJNLXUERHI-QGZVFWFLSA-N 1 0 299.374 3.663 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000040675879 260349097 /nfs/dbraw/zinc/34/90/97/260349097.db2.gz AIPJCERGBXKRPW-KRWDZBQOSA-N 1 0 284.359 3.878 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426773465 260351681 /nfs/dbraw/zinc/35/16/81/260351681.db2.gz JUAKLAKNOVVOIS-MELADBBJSA-N 1 0 274.364 3.778 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CC=CCC1 ZINC000518562609 260454966 /nfs/dbraw/zinc/45/49/66/260454966.db2.gz MQLYIFKMUZHFFU-DOMZBBRYSA-N 1 0 272.348 3.528 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000045628924 260652186 /nfs/dbraw/zinc/65/21/86/260652186.db2.gz QEKGOSMBTWPCKP-CJNGLKHVSA-N 1 0 274.364 3.992 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000152367553 261063407 /nfs/dbraw/zinc/06/34/07/261063407.db2.gz ISVZQQVBVYSFPF-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000163765942 261328532 /nfs/dbraw/zinc/32/85/32/261328532.db2.gz YHIXHHNUJJFXNT-BLLLJJGKSA-N 1 0 285.347 3.792 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000183350454 261485753 /nfs/dbraw/zinc/48/57/53/261485753.db2.gz IIOKOIVHDVMLFK-HOCLYGCPSA-N 1 0 292.379 3.595 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCC2(F)F)cc1[N+](=O)[O-] ZINC000390592733 262224706 /nfs/dbraw/zinc/22/47/06/262224706.db2.gz SHAOQLGKSXTBGS-DGCLKSJQSA-N 1 0 298.333 3.989 20 5 CHBDRO CCSCCC[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000311481162 262265949 /nfs/dbraw/zinc/26/59/49/262265949.db2.gz KWJQRHRMDNRDBI-CQSZACIVSA-N 1 0 282.409 3.779 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000228554658 262341746 /nfs/dbraw/zinc/34/17/46/262341746.db2.gz NJZWDARBPLEOTB-DOMZBBRYSA-N 1 0 294.420 3.779 20 5 CHBDRO CCC[C@H]([NH2+]CCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000063099272 262444788 /nfs/dbraw/zinc/44/47/88/262444788.db2.gz DVFXKDGRPAYNNJ-LBPRGKRZSA-N 1 0 290.285 3.978 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000414584954 263000517 /nfs/dbraw/zinc/00/05/17/263000517.db2.gz NHFMAKXRJQRAFT-SKYCBFMCSA-N 1 0 298.342 3.737 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cncc(F)c1 ZINC000155811334 263016568 /nfs/dbraw/zinc/01/65/68/263016568.db2.gz WONKOLAWUZWOQD-WDEREUQCSA-N 1 0 289.310 3.541 20 5 CHBDRO CC[NH2+]Cc1cccc(NCc2ccc([N+](=O)[O-])cc2C)c1 ZINC000414866737 263078700 /nfs/dbraw/zinc/07/87/00/263078700.db2.gz MTXRNMSNKMEZRX-UHFFFAOYSA-N 1 0 299.374 3.625 20 5 CHBDRO CO[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)CC(C)C ZINC000417357713 263799959 /nfs/dbraw/zinc/79/99/59/263799959.db2.gz HDPOLWKYINQZKW-KBPBESRZSA-N 1 0 294.395 3.615 20 5 CHBDRO CCC(C)(C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000189992535 264345001 /nfs/dbraw/zinc/34/50/01/264345001.db2.gz SWYCUCHWEKFRMA-LLVKDONJSA-N 1 0 250.342 3.682 20 5 CHBDRO Cc1ccccc1CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000094182659 265225993 /nfs/dbraw/zinc/22/59/93/265225993.db2.gz QPAJFLDJJYKAAT-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(F)cc(F)c1 ZINC000094826956 265259641 /nfs/dbraw/zinc/25/96/41/265259641.db2.gz HQIDPAJRGKQIJN-SNVBAGLBSA-N 1 0 292.285 3.724 20 5 CHBDRO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000358373378 266458534 /nfs/dbraw/zinc/45/85/34/266458534.db2.gz DGCNGKKPKULYIL-SJCJKPOMSA-N 1 0 297.358 3.792 20 5 CHBDRO CC[C@H]([NH2+]CCC1(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000359004898 266521864 /nfs/dbraw/zinc/52/18/64/266521864.db2.gz QJASRGQBHZIHQA-AWEZNQCLSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359293513 266560839 /nfs/dbraw/zinc/56/08/39/266560839.db2.gz FPFTUFGXWWVTIJ-CJNGLKHVSA-N 1 0 274.364 3.607 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)C[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000360930378 266756839 /nfs/dbraw/zinc/75/68/39/266756839.db2.gz LCHOYVUTLIICGA-FPMFFAJLSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C1CCC(F)(F)CC1 ZINC000580215789 327736132 /nfs/dbraw/zinc/73/61/32/327736132.db2.gz DOGFWMPJKHNLLG-CYBMUJFWSA-N 1 0 296.317 3.750 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000062726404 327894538 /nfs/dbraw/zinc/89/45/38/327894538.db2.gz YFXYOZVKUUEOCL-UKRRQHHQSA-N 1 0 276.380 3.696 20 5 CHBDRO CCC[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494506449 327903241 /nfs/dbraw/zinc/90/32/41/327903241.db2.gz KYPZQKQMEXMXDA-VIFPVBQESA-N 1 0 290.285 3.892 20 5 CHBDRO C[C@H]1C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC(C)(C)C1 ZINC000040675902 328015555 /nfs/dbraw/zinc/01/55/55/328015555.db2.gz FAZOZBXEJQEJMT-DZGCQCFKSA-N 1 0 290.407 3.942 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000040675886 328015566 /nfs/dbraw/zinc/01/55/66/328015566.db2.gz KXTUHUGFGDHYCF-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000040676000 328015625 /nfs/dbraw/zinc/01/56/25/328015625.db2.gz GNSRJDAABQZYSH-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000281042580 328238582 /nfs/dbraw/zinc/23/85/82/328238582.db2.gz HAXWRHZCDUWMDZ-VXGBXAGGSA-N 1 0 298.333 3.989 20 5 CHBDRO C[C@H](C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000534513142 328305068 /nfs/dbraw/zinc/30/50/68/328305068.db2.gz KKHLUWKPFFWFEL-CQSZACIVSA-N 1 0 296.370 3.757 20 5 CHBDRO CC(C)[N@H+](CCOc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000111173015 328332537 /nfs/dbraw/zinc/33/25/37/328332537.db2.gz RTUMVTGGLYJBLN-UHFFFAOYSA-N 1 0 292.379 3.627 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc2C1 ZINC000303512433 328352758 /nfs/dbraw/zinc/35/27/58/328352758.db2.gz BOKDKNRIWOCWDL-GOSISDBHSA-N 1 0 296.370 3.584 20 5 CHBDRO C[C@H]([NH2+]CCOC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000111636505 328370093 /nfs/dbraw/zinc/37/00/93/328370093.db2.gz DLWNBKCSCVONHW-ZDUSSCGKSA-N 1 0 292.379 3.595 20 5 CHBDRO Cc1ccc(C[NH2+]CC2(C)CCCC2)cc1[N+](=O)[O-] ZINC000111618287 328370391 /nfs/dbraw/zinc/37/03/91/328370391.db2.gz JZJNXQHOVLOLRW-UHFFFAOYSA-N 1 0 262.353 3.573 20 5 CHBDRO Cc1cc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000049687034 328378296 /nfs/dbraw/zinc/37/82/96/328378296.db2.gz GEMYSGABWQWTHQ-UHFFFAOYSA-N 1 0 290.388 3.605 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CCCCC2)c(Cl)c1 ZINC000049963045 328379833 /nfs/dbraw/zinc/37/98/33/328379833.db2.gz CKXIRSDQNPHCAL-UHFFFAOYSA-N 1 0 268.744 3.671 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCCSC2)cc1[N+](=O)[O-] ZINC000330686105 328467023 /nfs/dbraw/zinc/46/70/23/328467023.db2.gz SFWQDAJQMBAUJX-CYBMUJFWSA-N 1 0 294.420 3.703 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000035257017 326815619 /nfs/dbraw/zinc/81/56/19/326815619.db2.gz UZULXCZYUDWGHN-UKRRQHHQSA-N 1 0 262.353 3.653 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCC12CCCC2 ZINC000394213429 326869376 /nfs/dbraw/zinc/86/93/76/326869376.db2.gz HDTAGMNSHGYJQQ-OAHLLOKOSA-N 1 0 274.364 3.797 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000537951190 326870099 /nfs/dbraw/zinc/87/00/99/326870099.db2.gz CBUNJSGNLKVQMS-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)CCC2CC2)cc1[N+](=O)[O-] ZINC000398193335 326874179 /nfs/dbraw/zinc/87/41/79/326874179.db2.gz BJGSCGZDYDCWKO-LBPRGKRZSA-N 1 0 262.353 3.572 20 5 CHBDRO CCC(C)(CC)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255873566 327023498 /nfs/dbraw/zinc/02/34/98/327023498.db2.gz RTGFADQIYCFPEJ-NTMALXAHSA-N 1 0 262.353 3.776 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000558259599 327082971 /nfs/dbraw/zinc/08/29/71/327082971.db2.gz UJZAHGLDUHYAFM-LSDHHAIUSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC1(C)C ZINC000558256937 327083505 /nfs/dbraw/zinc/08/35/05/327083505.db2.gz LFGULXCJMCNPIN-SMDDNHRTSA-N 1 0 262.353 3.742 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000558257483 327083533 /nfs/dbraw/zinc/08/35/33/327083533.db2.gz LPTQGPDLBRSFFD-HOCLYGCPSA-N 1 0 288.391 3.694 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000569533794 327194588 /nfs/dbraw/zinc/19/45/88/327194588.db2.gz OXWLETRKDPMYEP-LLVKDONJSA-N 1 0 298.358 3.753 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCCC12CCCC2 ZINC000559766223 327260068 /nfs/dbraw/zinc/26/00/68/327260068.db2.gz HGDHNLJPQAFFRT-MRXNPFEDSA-N 1 0 288.391 3.840 20 5 CHBDRO Cc1[nH+]ccc(NCc2cccc([N+](=O)[O-])c2)c1Cl ZINC000312116769 327526149 /nfs/dbraw/zinc/52/61/49/327526149.db2.gz QRCZLRJXVSSSOW-UHFFFAOYSA-N 1 0 277.711 3.564 20 5 CHBDRO CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000507462274 332807009 /nfs/dbraw/zinc/80/70/09/332807009.db2.gz OOTVSPFBEFMCQT-QWHCGFSZSA-N 1 0 299.374 3.964 20 5 CHBDRO CC1(C)CCC[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000389048802 328607821 /nfs/dbraw/zinc/60/78/21/328607821.db2.gz RPTIELWZHZFNNW-ZDUSSCGKSA-N 1 0 262.353 3.511 20 5 CHBDRO C[C@H]([NH2+][C@H](C1CC1)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000324663209 328772140 /nfs/dbraw/zinc/77/21/40/328772140.db2.gz ISQXOQOAXYQDJG-ZBEGNZNMSA-N 1 0 274.364 3.824 20 5 CHBDRO CC[C@@H]([NH2+]CC1(SC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000193802300 329062810 /nfs/dbraw/zinc/06/28/10/329062810.db2.gz ZDEVAKFMAHMXJB-CQSZACIVSA-N 1 0 294.420 3.921 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)C1CC1 ZINC000582921342 329288813 /nfs/dbraw/zinc/28/88/13/329288813.db2.gz XQKHGBKWGZUHMT-GFCCVEGCSA-N 1 0 292.379 3.612 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000584366893 329295466 /nfs/dbraw/zinc/29/54/66/329295466.db2.gz SMERGVCVOXGRPJ-LUYZLQTOSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000584366892 329295485 /nfs/dbraw/zinc/29/54/85/329295485.db2.gz SMERGVCVOXGRPJ-BFJAYTPKSA-N 1 0 288.391 3.694 20 5 CHBDRO CCCC[C@H](C[NH3+])N[C@@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000423301654 330188988 /nfs/dbraw/zinc/18/89/88/330188988.db2.gz UHMWYMNNSWYPOB-ZBFHGGJFSA-N 1 0 293.411 3.543 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](C)CC1 ZINC000533247087 330355187 /nfs/dbraw/zinc/35/51/87/330355187.db2.gz LMQZXEYFOYAJKK-CHWSQXEVSA-N 1 0 262.353 3.778 20 5 CHBDRO CCCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433134470 330618000 /nfs/dbraw/zinc/61/80/00/330618000.db2.gz KTRLQPNJVNDFQQ-CQSZACIVSA-N 1 0 262.353 3.707 20 5 CHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000444014881 330809443 /nfs/dbraw/zinc/80/94/43/330809443.db2.gz JKHKYSNXOKWZOU-UJZCVKTISA-N 1 0 298.342 3.664 20 5 CHBDRO Cc1c(C[NH2+]C[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000159363228 330846435 /nfs/dbraw/zinc/84/64/35/330846435.db2.gz FGZWAJAGQNNCFY-ZDUSSCGKSA-N 1 0 284.359 3.797 20 5 CHBDRO CC(C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CCC1 ZINC000449521545 330933527 /nfs/dbraw/zinc/93/35/27/330933527.db2.gz SCLNOFKMUPBBON-VURMDHGXSA-N 1 0 274.364 3.776 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000162717541 330952550 /nfs/dbraw/zinc/95/25/50/330952550.db2.gz WNKVWCBTGBDNRN-ZDUSSCGKSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000163352214 331025169 /nfs/dbraw/zinc/02/51/69/331025169.db2.gz XISYPVBWGDGTLF-SNVBAGLBSA-N 1 0 290.285 3.806 20 5 CHBDRO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CCC23CCCC3)c(F)c1 ZINC000451465089 331030503 /nfs/dbraw/zinc/03/05/03/331030503.db2.gz ZMZWGHNPOQVDQX-CQSZACIVSA-N 1 0 296.317 3.685 20 5 CHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CCCCCF)C2)cc1 ZINC000451545544 331033441 /nfs/dbraw/zinc/03/34/41/331033441.db2.gz HRSMHMLYXWQSLI-HNNXBMFYSA-N 1 0 294.370 3.914 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000453176756 331097403 /nfs/dbraw/zinc/09/74/03/331097403.db2.gz MYPWPUHZZSSOMX-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2CCCC2(F)F)cccc1[N+](=O)[O-] ZINC000453326688 331117113 /nfs/dbraw/zinc/11/71/13/331117113.db2.gz YNUPGCPAFOSPBI-VXGBXAGGSA-N 1 0 298.333 3.989 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]CC2(C3CCC3)CCC2)cs1 ZINC000453588105 331135129 /nfs/dbraw/zinc/13/51/29/331135129.db2.gz YDXBZPUEYOZWBV-UHFFFAOYSA-N 1 0 280.393 3.716 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@@H]2CCCF)c1 ZINC000510661045 332910050 /nfs/dbraw/zinc/91/00/50/332910050.db2.gz FPOPVHOBCYEISU-GDBMZVCRSA-N 1 0 294.370 3.645 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2C[C@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000462768154 331328109 /nfs/dbraw/zinc/32/81/09/331328109.db2.gz XMSSKBYSJWCHQV-JKSUJKDBSA-N 1 0 288.391 3.962 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C(C)C ZINC000468656648 331438417 /nfs/dbraw/zinc/43/84/17/331438417.db2.gz YNQUSVGTUARFFA-YLHGKKIISA-N 1 0 276.380 3.880 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1CCSCC1)c1ccccc1[N+](=O)[O-] ZINC000474892274 331603158 /nfs/dbraw/zinc/60/31/58/331603158.db2.gz RSZHECNWIQXLHU-NWDGAFQWSA-N 1 0 294.420 3.777 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C1CCSCC1 ZINC000474892273 331603163 /nfs/dbraw/zinc/60/31/63/331603163.db2.gz RSZHECNWIQXLHU-NEPJUHHUSA-N 1 0 294.420 3.777 20 5 CHBDRO Cc1c(C[NH2+][C@H]2c3ccccc3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000478499223 331707439 /nfs/dbraw/zinc/70/74/39/331707439.db2.gz DMQHIDBADAGMJP-KZULUSFZSA-N 1 0 296.370 3.926 20 5 CHBDRO CC(C)=CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000479294863 331723828 /nfs/dbraw/zinc/72/38/28/331723828.db2.gz UOSPPWGJKHKHAG-GDBMZVCRSA-N 1 0 288.391 3.862 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000479972855 331753038 /nfs/dbraw/zinc/75/30/38/331753038.db2.gz WSBOXSFYARMOQL-GHMZBOCLSA-N 1 0 280.343 3.648 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000481179809 331799996 /nfs/dbraw/zinc/79/99/96/331799996.db2.gz JOQKUOLOGKJLGD-BXUZGUMPSA-N 1 0 280.343 3.792 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000482896199 331851430 /nfs/dbraw/zinc/85/14/30/331851430.db2.gz FLLGIKHDCNHOHE-CJNGLKHVSA-N 1 0 296.370 3.975 20 5 CHBDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])CS1 ZINC000488420177 332005949 /nfs/dbraw/zinc/00/59/49/332005949.db2.gz PWJJBRDNFOVKFM-OCCSQVGLSA-N 1 0 294.420 3.605 20 5 CHBDRO CC(C)C1CC([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000488440489 332008680 /nfs/dbraw/zinc/00/86/80/332008680.db2.gz JKBBYNLEIWWNOC-HIFPTAJRSA-N 1 0 262.353 3.680 20 5 CHBDRO CC[N@H+](CC(C)C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000488539016 332016128 /nfs/dbraw/zinc/01/61/28/332016128.db2.gz IAJZRKIHEIZRIJ-LBPRGKRZSA-N 1 0 250.342 3.634 20 5 CHBDRO CCC[N@H+](CC)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489108287 332041789 /nfs/dbraw/zinc/04/17/89/332041789.db2.gz VGUHDPVIDOVSDA-LBPRGKRZSA-N 1 0 250.342 3.696 20 5 CHBDRO COc1cc(C[N@@H+]2CCC[C@@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000489140074 332042527 /nfs/dbraw/zinc/04/25/27/332042527.db2.gz PFTNKWQDCYXVOG-CQSZACIVSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489228746 332043806 /nfs/dbraw/zinc/04/38/06/332043806.db2.gz XAWCAEGLPCFWAU-YPMHNXCESA-N 1 0 264.369 3.942 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490036324 332077721 /nfs/dbraw/zinc/07/77/21/332077721.db2.gz FSMAMRRILHQPGM-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@H](C)[C@H](C)C1 ZINC000490036535 332077728 /nfs/dbraw/zinc/07/77/28/332077728.db2.gz FVJOFTXDIRHTCX-XQQFMLRXSA-N 1 0 262.353 3.552 20 5 CHBDRO CCC1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000490383454 332087917 /nfs/dbraw/zinc/08/79/17/332087917.db2.gz ZASBXESDBLFTKX-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490551771 332091300 /nfs/dbraw/zinc/09/13/00/332091300.db2.gz ZJQKRJKTPPJZNU-XHBSWPGZSA-N 1 0 292.354 3.887 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)cc1 ZINC000491575350 332240884 /nfs/dbraw/zinc/24/08/84/332240884.db2.gz ZQVZSTCLQHGUAC-ZDUSSCGKSA-N 1 0 298.333 3.900 20 5 CHBDRO CCOc1cc(C[NH2+][C@@H]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000491813156 332365090 /nfs/dbraw/zinc/36/50/90/332365090.db2.gz LTCHXTHXRLNUHK-TZMCWYRMSA-N 1 0 292.379 3.662 20 5 CHBDRO CCOc1cc(C[NH2+][C@H]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000491813155 332365150 /nfs/dbraw/zinc/36/51/50/332365150.db2.gz LTCHXTHXRLNUHK-OCCSQVGLSA-N 1 0 292.379 3.662 20 5 CHBDRO CCOc1cc(C[NH+]2CCC(CC)CC2)ccc1[N+](=O)[O-] ZINC000492414645 332396367 /nfs/dbraw/zinc/39/63/67/332396367.db2.gz BSFXXSKYEAHBPK-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO CC[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494445570 332473495 /nfs/dbraw/zinc/47/34/95/332473495.db2.gz JTCRTMVUBCRKIK-MRVPVSSYSA-N 1 0 276.258 3.502 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000504930417 332725572 /nfs/dbraw/zinc/72/55/72/332725572.db2.gz PTRUSKIOCKZXRI-QWHCGFSZSA-N 1 0 294.395 3.936 20 5 CHBDRO CCC(C)(C)OCC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000308548270 333034612 /nfs/dbraw/zinc/03/46/12/333034612.db2.gz RKKBIQFVRPYSJO-ZDUSSCGKSA-N 1 0 294.395 3.759 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CCCC3)CC2)cc1 ZINC000513724065 333035746 /nfs/dbraw/zinc/03/57/46/333035746.db2.gz CBJXZNDCKCEEGP-UHFFFAOYSA-N 1 0 274.364 3.751 20 5 CHBDRO CC(C)(C)C(C)(C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000310785370 333061422 /nfs/dbraw/zinc/06/14/22/333061422.db2.gz CKWGOZQDZLOPTC-UHFFFAOYSA-N 1 0 250.342 3.509 20 5 CHBDRO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)CC(C)C ZINC000311439776 333068269 /nfs/dbraw/zinc/06/82/69/333068269.db2.gz PBBXVGNINMQRGL-UHFFFAOYSA-N 1 0 268.332 3.602 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1C2CCC1CC2 ZINC000517094532 333092625 /nfs/dbraw/zinc/09/26/25/333092625.db2.gz WXHMHFZLNPXSHN-UHFFFAOYSA-N 1 0 290.363 3.509 20 5 CHBDRO CCOCC(C)(C)C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000336847686 335121017 /nfs/dbraw/zinc/12/10/17/335121017.db2.gz FYYOQIWTAXLUAY-HNNXBMFYSA-N 1 0 294.395 3.698 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C1CCSCC1 ZINC000187070401 333167649 /nfs/dbraw/zinc/16/76/49/333167649.db2.gz BQRFGIASJGQRNJ-NEPJUHHUSA-N 1 0 294.420 3.777 20 5 CHBDRO CC[C@H]([NH2+]CC1(C)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000222218415 333177364 /nfs/dbraw/zinc/17/73/64/333177364.db2.gz UGZUQJCIUJVANA-AWEZNQCLSA-N 1 0 262.353 3.826 20 5 CHBDRO CCCC[C@H](CC)C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000223448195 333207947 /nfs/dbraw/zinc/20/79/47/333207947.db2.gz GRACSNWCZKBDNZ-ZDUSSCGKSA-N 1 0 294.395 3.909 20 5 CHBDRO CCC[NH+](CCC)CCCNc1ccccc1[N+](=O)[O-] ZINC000524411290 333361685 /nfs/dbraw/zinc/36/16/85/333361685.db2.gz YLWNOUFRCDJMDY-UHFFFAOYSA-N 1 0 279.384 3.519 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000036992517 333452325 /nfs/dbraw/zinc/45/23/25/333452325.db2.gz RSIQJONBLAXKNS-NWDGAFQWSA-N 1 0 290.388 3.938 20 5 CHBDRO CCc1ccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)o1 ZINC000123323448 333455828 /nfs/dbraw/zinc/45/58/28/333455828.db2.gz LPOFRTNGOFBURL-LBPRGKRZSA-N 1 0 288.347 3.644 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCC1CCCCC1 ZINC000037739953 333537350 /nfs/dbraw/zinc/53/73/50/333537350.db2.gz PNYPZEXQRBICSS-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000539214287 333661289 /nfs/dbraw/zinc/66/12/89/333661289.db2.gz GVETVSRWTAAWNS-QWHCGFSZSA-N 1 0 299.374 3.964 20 5 CHBDRO CC(C)[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000541846162 333794099 /nfs/dbraw/zinc/79/40/99/333794099.db2.gz OXAPIWHXWPVVGQ-HNNXBMFYSA-N 1 0 296.798 3.815 20 5 CHBDRO C[C@@H]1CCC[C@@H](CC[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000070546759 333815858 /nfs/dbraw/zinc/81/58/58/333815858.db2.gz RSEGVJKABLJCEX-KGLIPLIRSA-N 1 0 276.380 3.901 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000544610927 333940028 /nfs/dbraw/zinc/94/00/28/333940028.db2.gz FOEKJJCZEODVTK-HUUCEWRRSA-N 1 0 274.364 3.525 20 5 CHBDRO CC1([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CCCCC1 ZINC000236653855 334062614 /nfs/dbraw/zinc/06/26/14/334062614.db2.gz PBGZYNPSVDLSDJ-VQHVLOKHSA-N 1 0 274.364 3.920 20 5 CHBDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000564324907 334101185 /nfs/dbraw/zinc/10/11/85/334101185.db2.gz JIVDRTIKERMZED-TZMCWYRMSA-N 1 0 262.353 3.666 20 5 CHBDRO C[C@@H]1CCCCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000547931337 334129742 /nfs/dbraw/zinc/12/97/42/334129742.db2.gz JZHYRYDFUNLXLB-JKEYDSJLSA-N 1 0 274.364 3.873 20 5 CHBDRO CC1(C)CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000079645077 334159199 /nfs/dbraw/zinc/15/91/99/334159199.db2.gz HVMOBZGZIRWMQM-UHFFFAOYSA-N 1 0 262.353 3.653 20 5 CHBDRO CC1(C)CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000079652110 334159358 /nfs/dbraw/zinc/15/93/58/334159358.db2.gz NOFGMLSPBZWWGP-UHFFFAOYSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc(C[N@H+]2CCCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000548587380 334162998 /nfs/dbraw/zinc/16/29/98/334162998.db2.gz IWAGTLCTKPTFRV-ZDUSSCGKSA-N 1 0 262.353 3.668 20 5 CHBDRO Cc1ccsc1C[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000080347215 334170707 /nfs/dbraw/zinc/17/07/07/334170707.db2.gz JMTRKTZUMMWJGB-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO C[C@H](c1ccccc1)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549169004 334187052 /nfs/dbraw/zinc/18/70/52/334187052.db2.gz RHAQRJOAGARZML-CQSZACIVSA-N 1 0 284.359 3.830 20 5 CHBDRO Cc1cc(NCCCCC[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000549239540 334188620 /nfs/dbraw/zinc/18/86/20/334188620.db2.gz GHDVWSSQIZMALW-UHFFFAOYSA-N 1 0 291.395 3.581 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@H](C3CC3)C2)cc1 ZINC000081637088 334201384 /nfs/dbraw/zinc/20/13/84/334201384.db2.gz QZCVCWNNVLODHL-JKSUJKDBSA-N 1 0 288.391 3.696 20 5 CHBDRO CC1(C)C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@H]21 ZINC000550442912 334222620 /nfs/dbraw/zinc/22/26/20/334222620.db2.gz BTUXODZBHCEPIJ-CVEARBPZSA-N 1 0 288.391 3.648 20 5 CHBDRO CC(F)(F)C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000551240970 334242332 /nfs/dbraw/zinc/24/23/32/334242332.db2.gz IZEPLPJFKMCWHO-AAEUAGOBSA-N 1 0 298.333 3.551 20 5 CHBDRO CC1=CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000551279307 334244873 /nfs/dbraw/zinc/24/48/73/334244873.db2.gz DWBCQILFFIOVCT-GFCCVEGCSA-N 1 0 280.755 3.837 20 5 CHBDRO CCC1CC([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000551787848 334261113 /nfs/dbraw/zinc/26/11/13/334261113.db2.gz MWTKAEMZNPJZPK-UHFFFAOYSA-N 1 0 276.380 3.696 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H](COC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000086695563 334315241 /nfs/dbraw/zinc/31/52/41/334315241.db2.gz OMCBUVRUDJFGHL-CVEARBPZSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000250927656 334353472 /nfs/dbraw/zinc/35/34/72/334353472.db2.gz YCDYNJQNFDWGBI-OSMZGAPFSA-N 1 0 262.353 3.742 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CC=CCC1)C1CC1 ZINC000090035857 334355932 /nfs/dbraw/zinc/35/59/32/334355932.db2.gz LQJCRDXBLZMDRJ-JKSUJKDBSA-N 1 0 286.375 3.614 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000251816016 334370255 /nfs/dbraw/zinc/37/02/55/334370255.db2.gz MQIPGLOGXFOXFG-OUCADQQQSA-N 1 0 292.379 3.518 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000251828320 334370499 /nfs/dbraw/zinc/37/04/99/334370499.db2.gz NGYKTDFHMOIXOS-BZPMIXESSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000252454432 334380726 /nfs/dbraw/zinc/38/07/26/334380726.db2.gz FXGRPIWSWBQPTA-DVOMOZLQSA-N 1 0 276.380 3.552 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)cc1 ZINC000576851281 335255973 /nfs/dbraw/zinc/25/59/73/335255973.db2.gz MLSRVJWNNAZDRR-KRWDZBQOSA-N 1 0 296.370 3.974 20 5 CHBDRO C[C@@H](CNc1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000347322337 335376136 /nfs/dbraw/zinc/37/61/36/335376136.db2.gz VETXKVNNKAKASI-AWEZNQCLSA-N 1 0 299.374 3.527 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000578337682 335614461 /nfs/dbraw/zinc/61/44/61/335614461.db2.gz NSQZYRBQIDUQCB-ZWNOBZJWSA-N 1 0 262.353 3.606 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](c2ccccc2)C2CC2)cc1 ZINC000578458969 335637678 /nfs/dbraw/zinc/63/76/78/335637678.db2.gz UCCNAEHZJWMQPO-SFHVURJKSA-N 1 0 296.370 3.878 20 5 CHBDRO CCCC(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000183468128 335894640 /nfs/dbraw/zinc/89/46/40/335894640.db2.gz XCOUMDDZWVNLHK-UHFFFAOYSA-N 1 0 250.342 3.572 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC2CCC1CC2)c1ccc([N+](=O)[O-])cc1 ZINC000380684436 336016817 /nfs/dbraw/zinc/01/68/17/336016817.db2.gz DCXNTDIHJQWUMR-OJSNXCTFSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H]1CC2CCC1CC2 ZINC000381776858 336072905 /nfs/dbraw/zinc/07/29/05/336072905.db2.gz ZACLBLNEDXTTKY-XXIIAIFYSA-N 1 0 294.420 3.961 20 5 CHBDRO CC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1CCCC1 ZINC000382771628 336096754 /nfs/dbraw/zinc/09/67/54/336096754.db2.gz LWSSAIYOFOAOGL-GFCCVEGCSA-N 1 0 268.382 3.715 20 5 CHBDRO COc1ccc(C[NH2+][C@H](C)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000384454893 336124559 /nfs/dbraw/zinc/12/45/59/336124559.db2.gz KPKLWOBCQUZEGM-LLVKDONJSA-N 1 0 280.368 3.518 20 5 CHBDRO CCC(C)(C)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000581767990 336144524 /nfs/dbraw/zinc/14/45/24/336144524.db2.gz FFVFJNDQILIAFR-NSHDSACASA-N 1 0 250.342 3.509 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000387189694 336187589 /nfs/dbraw/zinc/18/75/89/336187589.db2.gz WFFZHIIMXKJSHC-BXUZGUMPSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000353665552 534074246 /nfs/dbraw/zinc/07/42/46/534074246.db2.gz LDXRQMKPCMFWGS-CYBMUJFWSA-N 1 0 282.343 3.542 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H](C)CC(C)(C)O)c1cccc([N+](=O)[O-])c1 ZINC000296325549 520788920 /nfs/dbraw/zinc/78/89/20/520788920.db2.gz GZNGHEDQVRBNCA-SWLSCSKDSA-N 1 0 294.395 3.575 20 5 CHBDRO CCC[C@H]([NH2+]CCc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000120154840 521158135 /nfs/dbraw/zinc/15/81/35/521158135.db2.gz VBQWHNILRHFUCX-KRWDZBQOSA-N 1 0 299.374 3.663 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000037010458 522884969 /nfs/dbraw/zinc/88/49/69/522884969.db2.gz HRXHUQAFNAQUIR-MRXNPFEDSA-N 1 0 288.322 3.975 20 5 CHBDRO COc1ccc(C[NH+](C2CCC2)C2CCC2)cc1[N+](=O)[O-] ZINC000292543570 524011398 /nfs/dbraw/zinc/01/13/98/524011398.db2.gz YAHCKEBZORHWBR-UHFFFAOYSA-N 1 0 290.363 3.510 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2coc3ccccc23)cc1[N+](=O)[O-] ZINC000339408850 524586495 /nfs/dbraw/zinc/58/64/95/524586495.db2.gz FEENWJMHELXYFF-UHFFFAOYSA-N 1 0 296.326 3.939 20 5 CHBDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000050564681 525641481 /nfs/dbraw/zinc/64/14/81/525641481.db2.gz JKNWDXIKNWROJR-WDEREUQCSA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)C)cc1[N+](=O)[O-] ZINC000040492737 525723124 /nfs/dbraw/zinc/72/31/24/525723124.db2.gz RKROPCKIAGTKFB-LLVKDONJSA-N 1 0 250.342 3.600 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc2occc2c1 ZINC000352811488 534886897 /nfs/dbraw/zinc/88/68/97/534886897.db2.gz DNQVTAJZERYGSC-UHFFFAOYSA-N 1 0 282.299 3.631 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCC(F)(F)F)cc1[N+](=O)[O-] ZINC000126793716 525918573 /nfs/dbraw/zinc/91/85/73/525918573.db2.gz SHRZLGKDCZEPBK-JTQLQIEISA-N 1 0 290.285 3.896 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccncc1 ZINC000347376659 527528892 /nfs/dbraw/zinc/52/88/92/527528892.db2.gz OKFPIONJGQNEHD-GXDHUFHOSA-N 1 0 297.358 3.525 20 5 CHBDRO CC1(C2CC2)CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000352176772 527905063 /nfs/dbraw/zinc/90/50/63/527905063.db2.gz UJVKDKJVPNNTOV-UHFFFAOYSA-N 1 0 280.393 3.668 20 5 CHBDRO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)CC1CCC1 ZINC000355596510 528795342 /nfs/dbraw/zinc/79/53/42/528795342.db2.gz CVSSUGKCDXLHDG-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1ccc([N+](=O)[O-])s1 ZINC000610908679 1118908650 /nfs/dbraw/zinc/90/86/50/1118908650.db2.gz QEGXXSCPXQLIJA-LLVKDONJSA-N 1 0 285.413 3.579 20 5 CHBDRO C[C@@H](CCC1CC1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783676795 1125174013 /nfs/dbraw/zinc/17/40/13/1125174013.db2.gz QSKSRXXTZALKKB-JTQLQIEISA-N 1 0 282.771 3.917 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(C3CCC3)CC2)ccc1Cl ZINC000697376822 1125310158 /nfs/dbraw/zinc/31/01/58/1125310158.db2.gz SLALAGWSIVASSH-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000129899565 1125353181 /nfs/dbraw/zinc/35/31/81/1125353181.db2.gz XYTQUJPSKNBSPV-NWDGAFQWSA-N 1 0 262.353 3.600 20 5 CHBDRO CCC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1 ZINC000037097276 1131993419 /nfs/dbraw/zinc/99/34/19/1131993419.db2.gz CPQDRLFDSCEFBM-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CCCC[C@@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230843 1132413782 /nfs/dbraw/zinc/41/37/82/1132413782.db2.gz VDYVQCRXPHDNFI-CHWSQXEVSA-N 1 0 264.369 3.694 20 5 CHBDRO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(C2CC2)c1 ZINC000886221196 1125662530 /nfs/dbraw/zinc/66/25/30/1125662530.db2.gz VLJDBNVXVLTDCA-LBPRGKRZSA-N 1 0 297.358 3.718 20 5 CHBDRO Cc1ccc([C@@H](C)C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000237382449 1125691728 /nfs/dbraw/zinc/69/17/28/1125691728.db2.gz FNAIVBHNXCPQJD-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO CC[N@H+](C)Cc1cccc(CNc2ccccc2[N+](=O)[O-])c1 ZINC000067710843 1125706388 /nfs/dbraw/zinc/70/63/88/1125706388.db2.gz JANDCUWOAABXOQ-UHFFFAOYSA-N 1 0 299.374 3.659 20 5 CHBDRO CC(C)SCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000338271758 1126729092 /nfs/dbraw/zinc/72/90/92/1126729092.db2.gz OXXHFNGFDJEQKH-UHFFFAOYSA-N 1 0 294.420 3.701 20 5 CHBDRO C[C@H]1CCCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000482314779 1126751015 /nfs/dbraw/zinc/75/10/15/1126751015.db2.gz WIIWIRSVNUCTJB-PIZKADEWSA-N 1 0 274.364 3.730 20 5 CHBDRO C[C@H]1CCCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000482314368 1126751126 /nfs/dbraw/zinc/75/11/26/1126751126.db2.gz WIIWIRSVNUCTJB-MRZGDXHCSA-N 1 0 274.364 3.730 20 5 CHBDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000482489462 1126761151 /nfs/dbraw/zinc/76/11/51/1126761151.db2.gz KJWJYVJZIUHWQI-XHDPSFHLSA-N 1 0 262.353 3.524 20 5 CHBDRO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC000483120474 1126767640 /nfs/dbraw/zinc/76/76/40/1126767640.db2.gz UJOPONADPYSTJY-LLVKDONJSA-N 1 0 280.343 3.744 20 5 CHBDRO CC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC1CCC1 ZINC000483124272 1126769129 /nfs/dbraw/zinc/76/91/29/1126769129.db2.gz TWSOIYSQLDIBAY-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO CC[N@H+](CC1CCC1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000483131151 1126769178 /nfs/dbraw/zinc/76/91/78/1126769178.db2.gz YVEBBNPAEFMNOD-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO C[N@H+](Cc1ccc(Cl)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000042977997 1126866499 /nfs/dbraw/zinc/86/64/99/1126866499.db2.gz FZKXJOTYDIIXTK-UHFFFAOYSA-N 1 0 290.750 3.880 20 5 CHBDRO CC[N@H+](CC(C)C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485718684 1126946300 /nfs/dbraw/zinc/94/63/00/1126946300.db2.gz SEZATZILKRFDEC-ZDUSSCGKSA-N 1 0 264.369 3.942 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccnc1 ZINC000192609277 1126962148 /nfs/dbraw/zinc/96/21/48/1126962148.db2.gz KZOQTOPNKGBZHW-SJKOYZFVSA-N 1 0 297.358 3.718 20 5 CHBDRO CC[C@@H]([NH2+]C/C=C\c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000487266156 1127027319 /nfs/dbraw/zinc/02/73/19/1127027319.db2.gz IMKNGVQUXUGKPX-VGOKWCNXSA-N 1 0 297.358 3.744 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271486014 1127085581 /nfs/dbraw/zinc/08/55/81/1127085581.db2.gz DWSOLOBGHXOZCF-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2c2ccccc2)c1 ZINC000054669777 1127086181 /nfs/dbraw/zinc/08/61/81/1127086181.db2.gz ZCVOVGXPQOBCSQ-KRWDZBQOSA-N 1 0 282.343 3.932 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000589209389 1127216334 /nfs/dbraw/zinc/21/63/34/1127216334.db2.gz KXHRHBVMMGDYNU-QQNRWZHASA-N 1 0 286.375 3.730 20 5 CHBDRO CC(C)CC[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000057627036 1127268901 /nfs/dbraw/zinc/26/89/01/1127268901.db2.gz GLSCTKVJUHOGIV-LBPRGKRZSA-N 1 0 250.342 3.634 20 5 CHBDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573046306 1127281124 /nfs/dbraw/zinc/28/11/24/1127281124.db2.gz XFKRKANPCKCJCA-GXTWGEPZSA-N 1 0 262.353 3.666 20 5 CHBDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573046310 1127281432 /nfs/dbraw/zinc/28/14/32/1127281432.db2.gz XFKRKANPCKCJCA-TZMCWYRMSA-N 1 0 262.353 3.666 20 5 CHBDRO C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000166557138 1127288716 /nfs/dbraw/zinc/28/87/16/1127288716.db2.gz GIAQQCOBQCJSQC-UTUOFQBUSA-N 1 0 280.343 3.600 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CCCSC2)cccc1[N+](=O)[O-] ZINC000287125830 1127290899 /nfs/dbraw/zinc/29/08/99/1127290899.db2.gz RIJUVAOAYZAPCZ-STQMWFEESA-N 1 0 294.420 3.697 20 5 CHBDRO Cc1ccc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC001168400617 1127298136 /nfs/dbraw/zinc/29/81/36/1127298136.db2.gz BZSOBHUPGSWDDL-NUEKZKHPSA-N 1 0 288.391 3.914 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[C@@H](F)C1)CCCC2 ZINC000591348164 1127299134 /nfs/dbraw/zinc/29/91/34/1127299134.db2.gz AXBFKUZLDQVIRO-DVOMOZLQSA-N 1 0 292.354 3.843 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000355108024 1127318228 /nfs/dbraw/zinc/31/82/28/1127318228.db2.gz KBYJZIVHXZCVIQ-MNOVXSKESA-N 1 0 268.382 3.524 20 5 CHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CC(F)F ZINC000592373063 1127370887 /nfs/dbraw/zinc/37/08/87/1127370887.db2.gz SKJAVNXADXMGRZ-MRVPVSSYSA-N 1 0 292.713 3.629 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C)SC2)cc1[N+](=O)[O-] ZINC000594497773 1127418517 /nfs/dbraw/zinc/41/85/17/1127418517.db2.gz GEEXERIIBDTGIS-DYEKYZERSA-N 1 0 294.420 3.838 20 5 CHBDRO Cc1cc2c(c(C)c1)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CC2 ZINC000594503330 1127418833 /nfs/dbraw/zinc/41/88/33/1127418833.db2.gz VSNBALWPTXLFHH-INIZCTEOSA-N 1 0 296.370 3.989 20 5 CHBDRO Cc1cc(C)cc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000594974167 1127438172 /nfs/dbraw/zinc/43/81/72/1127438172.db2.gz UPLJEEOXCXMREZ-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO Cc1cc(C)cc(C[NH2+]Cc2csc([N+](=O)[O-])c2)c1 ZINC000594974353 1127438217 /nfs/dbraw/zinc/43/82/17/1127438217.db2.gz YNRIDJQCYLLVBO-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO CC1(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000358984837 1127442257 /nfs/dbraw/zinc/44/22/57/1127442257.db2.gz LIHCKIGYGNBRJO-OAHLLOKOSA-N 1 0 274.364 3.752 20 5 CHBDRO CC[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000594980252 1127443352 /nfs/dbraw/zinc/44/33/52/1127443352.db2.gz NQDQNMOGQUOYDH-OAHLLOKOSA-N 1 0 262.353 3.572 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@@H]2c2ccccc2)cc1 ZINC000594994279 1127444470 /nfs/dbraw/zinc/44/44/70/1127444470.db2.gz JGKWRXRRUSYZFO-IAGOWNOFSA-N 1 0 282.343 3.631 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000595005181 1127445218 /nfs/dbraw/zinc/44/52/18/1127445218.db2.gz DSFGGWPPATXPTO-AAEUAGOBSA-N 1 0 280.393 3.531 20 5 CHBDRO CC1(C)CC([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000595108414 1127452796 /nfs/dbraw/zinc/45/27/96/1127452796.db2.gz ZJYRKNCRFYBARN-OAHLLOKOSA-N 1 0 288.391 3.694 20 5 CHBDRO CCC[C@H]([NH2+]CCc1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000595076052 1127453108 /nfs/dbraw/zinc/45/31/08/1127453108.db2.gz CWABLCBFAQMOJZ-INIZCTEOSA-N 1 0 288.347 3.861 20 5 CHBDRO CC[C@H]([NH2+]C[C@]1(C)CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595079652 1127453609 /nfs/dbraw/zinc/45/36/09/1127453609.db2.gz MDEKYBNKHFODHV-STQMWFEESA-N 1 0 284.306 3.681 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](CC)C2CC2)cc1[N+](=O)[O-] ZINC000595082291 1127453628 /nfs/dbraw/zinc/45/36/28/1127453628.db2.gz XZXYZXXEFMESKQ-RISCZKNCSA-N 1 0 292.379 3.833 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[C@@H](C)O2)cccc1[N+](=O)[O-] ZINC000595082001 1127453772 /nfs/dbraw/zinc/45/37/72/1127453772.db2.gz VKENFWAXILVDSA-XBFCOCLRSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC000595090360 1127454036 /nfs/dbraw/zinc/45/40/36/1127454036.db2.gz BBJUWTVKFKYANQ-GWCFXTLKSA-N 1 0 298.333 3.845 20 5 CHBDRO CCSC1(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000595097648 1127456013 /nfs/dbraw/zinc/45/60/13/1127456013.db2.gz AZJXPNZYKASGKP-GFCCVEGCSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1noc(C[NH2+][C@@H]2CCCC[C@@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595364509 1127461896 /nfs/dbraw/zinc/46/18/96/1127461896.db2.gz SMTBPKHUYUEWQG-NWDGAFQWSA-N 1 0 295.383 3.586 20 5 CHBDRO CCC[C@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])C1CCCCC1 ZINC000595423188 1127462473 /nfs/dbraw/zinc/46/24/73/1127462473.db2.gz MKJBMBMBXDBPHL-ZDUSSCGKSA-N 1 0 295.383 3.730 20 5 CHBDRO CCC1([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])CCCC1 ZINC000595531810 1127465797 /nfs/dbraw/zinc/46/57/97/1127465797.db2.gz UPWMONJHDWMXGT-UHFFFAOYSA-N 1 0 266.316 3.546 20 5 CHBDRO Cc1noc(C[N@@H+](C)[C@@H]2CCC[C@@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595553259 1127467039 /nfs/dbraw/zinc/46/70/39/1127467039.db2.gz WKWBBUIYEFISAH-NWDGAFQWSA-N 1 0 295.383 3.538 20 5 CHBDRO Cc1noc(C[N@@H+](C)[C@@H]2CCC[C@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595553261 1127467321 /nfs/dbraw/zinc/46/73/21/1127467321.db2.gz WKWBBUIYEFISAH-VXGBXAGGSA-N 1 0 295.383 3.538 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccco3)CC2)cc1 ZINC000595618651 1127467829 /nfs/dbraw/zinc/46/78/29/1127467829.db2.gz RYEQOIMPCJWDIR-UHFFFAOYSA-N 1 0 286.331 3.567 20 5 CHBDRO CC1CC([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602571941 1127594426 /nfs/dbraw/zinc/59/44/26/1127594426.db2.gz HQJKLCLVDZOUIF-UHFFFAOYSA-N 1 0 288.269 3.502 20 5 CHBDRO CC(C)(C)C(C)(C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602670880 1127602196 /nfs/dbraw/zinc/60/21/96/1127602196.db2.gz RHNMRJPKTWKGDM-UHFFFAOYSA-N 1 0 291.351 3.650 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)Cc2ccncc2)cccc1[N+](=O)[O-] ZINC000361967271 1127602879 /nfs/dbraw/zinc/60/28/79/1127602879.db2.gz KALCCINIQRGSRP-GXTWGEPZSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H](CC(C)(C)C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602689659 1127604219 /nfs/dbraw/zinc/60/42/19/1127604219.db2.gz WWPKNVZFUFPRAV-SNVBAGLBSA-N 1 0 291.351 3.650 20 5 CHBDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)n1 ZINC000602803220 1127615347 /nfs/dbraw/zinc/61/53/47/1127615347.db2.gz AADNFRIUCPQPLV-ZDUSSCGKSA-N 1 0 299.374 3.766 20 5 CHBDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000362187305 1127617932 /nfs/dbraw/zinc/61/79/32/1127617932.db2.gz DBZJOXICYSYMHD-JQWIXIFHSA-N 1 0 296.342 3.505 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000598680109 1127631290 /nfs/dbraw/zinc/63/12/90/1127631290.db2.gz UJFWBQGRIPZHQV-CMPLNLGQSA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1ccnc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000295963454 1127658870 /nfs/dbraw/zinc/65/88/70/1127658870.db2.gz IAQMNVYPDUCKRX-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO CCc1cccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000593687825 1127659150 /nfs/dbraw/zinc/65/91/50/1127659150.db2.gz IBPDOAGGILAUPQ-UHFFFAOYSA-N 1 0 284.359 3.755 20 5 CHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1ccc([N+](=O)[O-])s1 ZINC000604409327 1127703344 /nfs/dbraw/zinc/70/33/44/1127703344.db2.gz ZJPWOZSOIHNDSI-LBPRGKRZSA-N 1 0 297.424 3.723 20 5 CHBDRO Cc1ccc(CCC[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000604478700 1127706303 /nfs/dbraw/zinc/70/63/03/1127706303.db2.gz GLTNZWBKFUNBLI-UHFFFAOYSA-N 1 0 298.386 3.934 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccc(F)cc1 ZINC000061779232 1127716739 /nfs/dbraw/zinc/71/67/39/1127716739.db2.gz VYTIWCHMDIUVPG-GFCCVEGCSA-N 1 0 288.322 3.927 20 5 CHBDRO Cc1ccsc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000061798582 1127718026 /nfs/dbraw/zinc/71/80/26/1127718026.db2.gz LCCGHDRGXYETHZ-UHFFFAOYSA-N 1 0 276.361 3.597 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000374007186 1127870888 /nfs/dbraw/zinc/87/08/88/1127870888.db2.gz CJWZFJSKXIVTJV-OCCSQVGLSA-N 1 0 286.331 3.738 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC[C@@H](C)SC1)c1cccc([N+](=O)[O-])c1 ZINC000594503199 1127903427 /nfs/dbraw/zinc/90/34/27/1127903427.db2.gz GRTDYOPTBACICH-MDZLAQPJSA-N 1 0 280.393 3.530 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c1 ZINC000535266408 1127911725 /nfs/dbraw/zinc/91/17/25/1127911725.db2.gz UJPBMKTVDQSIHX-MRXNPFEDSA-N 1 0 297.358 3.502 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(N[C@H]2C[N@@H+](C)Cc3ccccc32)c1 ZINC000535266405 1127911802 /nfs/dbraw/zinc/91/18/02/1127911802.db2.gz UJPBMKTVDQSIHX-INIZCTEOSA-N 1 0 297.358 3.502 20 5 CHBDRO Cc1ccc(C[N@H+]2C[C@@H](C)CC2(C)C)cc1[N+](=O)[O-] ZINC000539828083 1127945386 /nfs/dbraw/zinc/94/53/86/1127945386.db2.gz GIIBXRHRXIBZPT-NSHDSACASA-N 1 0 262.353 3.524 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC34CCC4)o2)cc1 ZINC000539835381 1127946537 /nfs/dbraw/zinc/94/65/37/1127946537.db2.gz ZONUOIKIBUDHCH-UHFFFAOYSA-N 1 0 298.342 3.983 20 5 CHBDRO CC(C)c1ccc(C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000539924175 1127955314 /nfs/dbraw/zinc/95/53/14/1127955314.db2.gz SDARVCVLWYCSCZ-UHFFFAOYSA-N 1 0 262.353 3.704 20 5 CHBDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000540055017 1127958944 /nfs/dbraw/zinc/95/89/44/1127958944.db2.gz AUJZCXUHJYUXAD-SMDDNHRTSA-N 1 0 262.353 3.666 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CC=CCC1 ZINC000540172294 1127965819 /nfs/dbraw/zinc/96/58/19/1127965819.db2.gz YDMOGPHCKUBPDF-STQMWFEESA-N 1 0 260.337 3.663 20 5 CHBDRO CC/C=C\CC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000467454362 1127969960 /nfs/dbraw/zinc/96/99/60/1127969960.db2.gz PABYFKKGYDUCHK-CFHLNLSMSA-N 1 0 262.353 3.910 20 5 CHBDRO CSCCC[N@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000467554102 1127973223 /nfs/dbraw/zinc/97/32/23/1127973223.db2.gz NXBFIUUYCCNSQA-JLHYYAGUSA-N 1 0 294.420 3.683 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCC[C@H]2C2CC2)c(Cl)c1 ZINC000468031403 1127988088 /nfs/dbraw/zinc/98/80/88/1127988088.db2.gz QAUXQJNIQITSEK-ZFWWWQNUSA-N 1 0 294.782 3.917 20 5 CHBDRO Cc1ccccc1C[C@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000468450531 1128007992 /nfs/dbraw/zinc/00/79/92/1128007992.db2.gz XMBWZCJTROFNMW-HNNXBMFYSA-N 1 0 298.386 3.667 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])[C@@H]1C ZINC000035308143 1128010455 /nfs/dbraw/zinc/01/04/55/1128010455.db2.gz ZVMAWDMFZNVNAK-GYSYKLTISA-N 1 0 280.343 3.648 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(C)CCC1 ZINC000468748786 1128019412 /nfs/dbraw/zinc/01/94/12/1128019412.db2.gz WBRGBKSNXAMCBZ-LCYFTJDESA-N 1 0 274.364 3.778 20 5 CHBDRO Cc1c(C[N@H+](C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000541318385 1128017719 /nfs/dbraw/zinc/01/77/19/1128017719.db2.gz JPNFNGINYHWYJC-CQSZACIVSA-N 1 0 274.364 3.691 20 5 CHBDRO CN(Cc1ccc([N+](=O)[O-])c(F)c1)Cc1ccccc1F ZINC000094774420 1128024866 /nfs/dbraw/zinc/02/48/66/1128024866.db2.gz QZLKBXVNFGSSLE-UHFFFAOYSA-N 1 0 292.285 3.505 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000271941513 1128082128 /nfs/dbraw/zinc/08/21/28/1128082128.db2.gz UGRSRUKOZFMXOK-WOSRLPQWSA-N 1 0 292.379 3.511 20 5 CHBDRO CCOc1cc(C[N@H+]2[C@H](CC)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492603722 1128105564 /nfs/dbraw/zinc/10/55/64/1128105564.db2.gz CGQNTPDDSIPKTK-GXTWGEPZSA-N 1 0 292.379 3.756 20 5 CHBDRO CCOc1cc(C[N@@H+]2CC[C@@H](C)[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492816886 1128113637 /nfs/dbraw/zinc/11/36/37/1128113637.db2.gz JKZRDAPAURMGMC-OCCSQVGLSA-N 1 0 292.379 3.614 20 5 CHBDRO CC(C)C[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC000761505021 1128132177 /nfs/dbraw/zinc/13/21/77/1128132177.db2.gz COLWSHNZAODLIR-UHFFFAOYSA-N 1 0 282.771 3.869 20 5 CHBDRO CC[C@@H](C)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524286 1128132202 /nfs/dbraw/zinc/13/22/02/1128132202.db2.gz ZNQMZTONZNJEKX-ZJUUUORDSA-N 1 0 270.760 3.772 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCC2CCCC2)cc1Cl ZINC000761521270 1128132841 /nfs/dbraw/zinc/13/28/41/1128132841.db2.gz LHGYQKNWKDMIIU-UHFFFAOYSA-N 1 0 282.771 3.918 20 5 CHBDRO C[C@H]([N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1)C1(C)CC1 ZINC000761514468 1128132992 /nfs/dbraw/zinc/13/29/92/1128132992.db2.gz JVALVMPRQPFUMO-JTQLQIEISA-N 1 0 282.771 3.869 20 5 CHBDRO CC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC(C)C ZINC000494176586 1128157828 /nfs/dbraw/zinc/15/78/28/1128157828.db2.gz QKXCQYROQPCDKI-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO CC[C@@H](C)[C@H](C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000609204552 1128173020 /nfs/dbraw/zinc/17/30/20/1128173020.db2.gz WAOSZAWMZYFBEC-OLZOCXBDSA-N 1 0 276.380 3.994 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(F)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000932176682 1128398769 /nfs/dbraw/zinc/39/87/69/1128398769.db2.gz MBGVRNNUTVPHRX-MNOVXSKESA-N 1 0 289.310 3.541 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000916369080 1128417772 /nfs/dbraw/zinc/41/77/72/1128417772.db2.gz KXGAAPDLFYTUAY-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO C[C@H]1CC[C@H](C)[NH+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154218812 1128460222 /nfs/dbraw/zinc/46/02/22/1128460222.db2.gz DYOMXPPFKYKFSU-UWVGGRQHSA-N 1 0 268.744 3.621 20 5 CHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000917040473 1128468703 /nfs/dbraw/zinc/46/87/03/1128468703.db2.gz QXOTVEXMRDZIHK-CQSZACIVSA-N 1 0 296.370 3.757 20 5 CHBDRO CCCCC[C@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000040675938 1128526765 /nfs/dbraw/zinc/52/67/65/1128526765.db2.gz OPRMEPIQYZSFFY-ZDUSSCGKSA-N 1 0 264.369 3.696 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC(C)(C)C1 ZINC000566020760 1128536970 /nfs/dbraw/zinc/53/69/70/1128536970.db2.gz CKBPGABWNLCVCQ-LBPRGKRZSA-N 1 0 276.380 3.694 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H](c2ccccc2)C2CC2)cs1 ZINC000037562973 1128620202 /nfs/dbraw/zinc/62/02/02/1128620202.db2.gz RSOOLOCYTXOUFH-HNNXBMFYSA-N 1 0 288.372 3.897 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000037565767 1128620300 /nfs/dbraw/zinc/62/03/00/1128620300.db2.gz LIKXQHFDMUCFSC-DOMZBBRYSA-N 1 0 282.343 3.585 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1-c1cccc([C@@H]2CCC[NH2+]2)c1 ZINC000600788184 1128681070 /nfs/dbraw/zinc/68/10/70/1128681070.db2.gz CUNCXQFWTOKMLP-HNNXBMFYSA-N 1 0 286.306 3.825 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1-c1ccc([C@H]2CCC[NH2+]2)cc1 ZINC000600789178 1128681799 /nfs/dbraw/zinc/68/17/99/1128681799.db2.gz IOFFDWCYLNYNMF-OAHLLOKOSA-N 1 0 286.306 3.825 20 5 CHBDRO CC(C)[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CCCC1 ZINC000609388478 1128713846 /nfs/dbraw/zinc/71/38/46/1128713846.db2.gz MMUGUGJOAXOARV-UHFFFAOYSA-N 1 0 280.343 3.887 20 5 CHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1C=CCCC1 ZINC000609417619 1128714561 /nfs/dbraw/zinc/71/45/61/1128714561.db2.gz VDNJBWKHVHNBQX-HNNXBMFYSA-N 1 0 274.364 3.914 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609631959 1128721141 /nfs/dbraw/zinc/72/11/41/1128721141.db2.gz YMYUDXVMYBYYLU-AWEZNQCLSA-N 1 0 276.380 3.853 20 5 CHBDRO Cc1ccc(C[NH2+]C2(C)CCC(C)CC2)cc1[N+](=O)[O-] ZINC000609708453 1128722489 /nfs/dbraw/zinc/72/24/89/1128722489.db2.gz DQDIWQLWGZPBAG-UHFFFAOYSA-N 1 0 276.380 3.962 20 5 CHBDRO CC[C@H]1CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000430194365 1117838693 /nfs/dbraw/zinc/83/86/93/1117838693.db2.gz UQZLZBXIENKUSZ-ZDUSSCGKSA-N 1 0 286.331 3.839 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)C1CCC(C)CC1 ZINC000430197722 1117850532 /nfs/dbraw/zinc/85/05/32/1117850532.db2.gz OXRKANLMVFSVIN-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC3(C2)CCCCC3)cs1 ZINC000610216143 1117881012 /nfs/dbraw/zinc/88/10/12/1117881012.db2.gz OZHRZHRHLBNTGN-UHFFFAOYSA-N 1 0 280.393 3.813 20 5 CHBDRO C[C@H]1CCC[C@H](C)[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215362 1117881930 /nfs/dbraw/zinc/88/19/30/1117881930.db2.gz HJLWBGMZXAOIMM-KBPBESRZSA-N 1 0 276.380 3.648 20 5 CHBDRO CC1=C[C@H](C)C[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000430280755 1117989665 /nfs/dbraw/zinc/98/96/65/1117989665.db2.gz YCORPJFFMDXTRF-AAEUAGOBSA-N 1 0 260.337 3.554 20 5 CHBDRO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)CC1CC1 ZINC000261454816 1118101078 /nfs/dbraw/zinc/10/10/78/1118101078.db2.gz JWUGIOHKUWTCFC-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H]1C1CC1 ZINC000615835583 1128764482 /nfs/dbraw/zinc/76/44/82/1128764482.db2.gz TYWXAQDVWOAMFW-JIIJFUIFSA-N 1 0 286.375 3.873 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCCC23CC3)cc1[N+](=O)[O-] ZINC000706272345 1118267702 /nfs/dbraw/zinc/26/77/02/1118267702.db2.gz ZZYKWIYNOBNAML-AWEZNQCLSA-N 1 0 274.364 3.573 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000340525759 1118316660 /nfs/dbraw/zinc/31/66/60/1118316660.db2.gz XTXYKZYFLFXBQM-IHRRRGAJSA-N 1 0 266.316 3.526 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCc1cccs1 ZINC000084439729 1118379056 /nfs/dbraw/zinc/37/90/56/1118379056.db2.gz OTGHVCIQDRIQRR-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC2CCC1CC2)c1cccc([N+](=O)[O-])c1 ZINC000312781639 1118420716 /nfs/dbraw/zinc/42/07/16/1118420716.db2.gz HTGWHZFUCRAMKF-ITDKRANNSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCC1CC1)c1ccccc1[N+](=O)[O-] ZINC000398232958 1118504105 /nfs/dbraw/zinc/50/41/05/1118504105.db2.gz UIYDYZJXNVOUHE-NWDGAFQWSA-N 1 0 262.353 3.824 20 5 CHBDRO CC1(C)CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000510535151 1118766992 /nfs/dbraw/zinc/76/69/92/1118766992.db2.gz SUIVWSJSPSEZKP-VMPITWQZSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC(C)=C[C@H](C)C1 ZINC000430884420 1118783225 /nfs/dbraw/zinc/78/32/25/1118783225.db2.gz WOVIVUADSIDVHU-PBTLCFMXSA-N 1 0 286.375 3.896 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)c1ccncc1 ZINC000610830964 1118898415 /nfs/dbraw/zinc/89/84/15/1118898415.db2.gz PBYZFOIYDOBOCA-ZIAGYGMSSA-N 1 0 299.374 3.753 20 5 CHBDRO COc1ccc(C[NH2+]C2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000084461642 1118944712 /nfs/dbraw/zinc/94/47/12/1118944712.db2.gz ZKWBSJFECVZKRK-VXGBXAGGSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000538709417 1118949270 /nfs/dbraw/zinc/94/92/70/1118949270.db2.gz IFYUSMBOHYSBDO-XQQFMLRXSA-N 1 0 294.420 3.790 20 5 CHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000071905892 1118963453 /nfs/dbraw/zinc/96/34/53/1118963453.db2.gz RAPBHFUBRFCGPI-INIZCTEOSA-N 1 0 291.395 3.517 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000084988165 1119015680 /nfs/dbraw/zinc/01/56/80/1119015680.db2.gz NGYKTDFHMOIXOS-DYEKYZERSA-N 1 0 262.353 3.509 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000582187698 1119031450 /nfs/dbraw/zinc/03/14/50/1119031450.db2.gz KZHQOHVOFUCMKU-ZIAGYGMSSA-N 1 0 294.782 3.569 20 5 CHBDRO CC1(C)CCC[C@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000149896139 1119042296 /nfs/dbraw/zinc/04/22/96/1119042296.db2.gz OCZCDRHZMGARFV-ZDUSSCGKSA-N 1 0 292.379 3.532 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC12CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000395646368 1119061584 /nfs/dbraw/zinc/06/15/84/1119061584.db2.gz NQPIPAOAVGXKIU-SMDDNHRTSA-N 1 0 260.337 3.578 20 5 CHBDRO CCC1([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCC1 ZINC000135621156 1119187209 /nfs/dbraw/zinc/18/72/09/1119187209.db2.gz WLOLAXJZQICVNZ-UHFFFAOYSA-N 1 0 268.744 3.671 20 5 CHBDRO CC(C)[NH+](Cc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000611796977 1119194567 /nfs/dbraw/zinc/19/45/67/1119194567.db2.gz SOTUHQOBYCTWBF-UHFFFAOYSA-N 1 0 270.760 3.867 20 5 CHBDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000121989182 1119254565 /nfs/dbraw/zinc/25/45/65/1119254565.db2.gz IICBFLLBLDOIKE-CHWSQXEVSA-N 1 0 294.395 3.757 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCCC1(F)F ZINC000583510698 1119370804 /nfs/dbraw/zinc/37/08/04/1119370804.db2.gz ZXNYAOHOTNTMRT-GWCFXTLKSA-N 1 0 296.317 3.607 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCC[C@@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000340521610 1119492785 /nfs/dbraw/zinc/49/27/85/1119492785.db2.gz ARSKLKJTAZNXCQ-SOUVJXGZSA-N 1 0 280.343 3.916 20 5 CHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000219697639 1119511148 /nfs/dbraw/zinc/51/11/48/1119511148.db2.gz FINOUWLVCUQVAS-SWLSCSKDSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000219697743 1119511318 /nfs/dbraw/zinc/51/13/18/1119511318.db2.gz GMUQKTQWFUGXJU-DOMZBBRYSA-N 1 0 262.353 3.605 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCCC[C@@H]1C ZINC000219699172 1119511341 /nfs/dbraw/zinc/51/13/41/1119511341.db2.gz SZAPHYCDVLUGDT-SWLSCSKDSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2C[C@H]2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000601306745 1119539167 /nfs/dbraw/zinc/53/91/67/1119539167.db2.gz PRIMGSDORRLRHO-JMJZKYOTSA-N 1 0 288.269 3.505 20 5 CHBDRO C[C@H]([NH2+]CCC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000061839542 1119656813 /nfs/dbraw/zinc/65/68/13/1119656813.db2.gz YPTZZKFYSHHNST-NSHDSACASA-N 1 0 250.342 3.682 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCCCS1)c1cccc([N+](=O)[O-])c1 ZINC000158086698 1119772850 /nfs/dbraw/zinc/77/28/50/1119772850.db2.gz SGCIIPIZCOGTIL-SMDDNHRTSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1C2CCCC1CCC2 ZINC000612578670 1119801367 /nfs/dbraw/zinc/80/13/67/1119801367.db2.gz AFNKGHBUHMOICZ-UHFFFAOYSA-N 1 0 274.364 3.810 20 5 CHBDRO CC[N@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1C ZINC000612578220 1119801400 /nfs/dbraw/zinc/80/14/00/1119801400.db2.gz KCCXWBYJYQRBIL-UHFFFAOYSA-N 1 0 290.285 3.678 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CCO[C@H]1CC)c1cccc([N+](=O)[O-])c1 ZINC000414217988 1119943968 /nfs/dbraw/zinc/94/39/68/1119943968.db2.gz ZCVOTYCLIWENSV-OAGGEKHMSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]([NH2+]CC(C)(C)c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000414327739 1119985434 /nfs/dbraw/zinc/98/54/34/1119985434.db2.gz NCMSYXJEIIGZJU-CYBMUJFWSA-N 1 0 299.374 3.618 20 5 CHBDRO C[C@H](c1ccccc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000066696331 1120047660 /nfs/dbraw/zinc/04/76/60/1120047660.db2.gz NQAGGXPVHFOEDK-CYBMUJFWSA-N 1 0 270.332 3.788 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(C)Cc2ccccc2C1 ZINC000542704884 1120123059 /nfs/dbraw/zinc/12/30/59/1120123059.db2.gz LVWNQUNTKNUHLE-UHFFFAOYSA-N 1 0 296.370 3.550 20 5 CHBDRO C[C@@H]1CC[C@]2(CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542882661 1120220279 /nfs/dbraw/zinc/22/02/79/1120220279.db2.gz CENHLVYXYMNLBE-PBHICJAKSA-N 1 0 288.391 3.649 20 5 CHBDRO CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(C)C ZINC000065299133 1120338136 /nfs/dbraw/zinc/33/81/36/1120338136.db2.gz QXUQJPUMGJYNQM-AWEZNQCLSA-N 1 0 294.395 3.730 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000481181366 1120408315 /nfs/dbraw/zinc/40/83/15/1120408315.db2.gz VWOZNHUSHOOBMH-AWEZNQCLSA-N 1 0 280.343 3.792 20 5 CHBDRO CC1(C)CCC([NH2+]CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000079679016 1120445128 /nfs/dbraw/zinc/44/51/28/1120445128.db2.gz HQEQOOKQWYWVEP-UHFFFAOYSA-N 1 0 292.379 3.532 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2CCC=CO2)cc1[N+](=O)[O-] ZINC000780566085 1120474686 /nfs/dbraw/zinc/47/46/86/1120474686.db2.gz JNSMOWWEGSGUMH-AWEZNQCLSA-N 1 0 290.363 3.501 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000310972800 1120506079 /nfs/dbraw/zinc/50/60/79/1120506079.db2.gz WCZMSXKSQXPQSB-GFCCVEGCSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1sccc1[N+](=O)[O-] ZINC000301979458 1120512256 /nfs/dbraw/zinc/51/22/56/1120512256.db2.gz FZIGITDRRJPYTR-GFCCVEGCSA-N 1 0 297.424 3.723 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000070305857 1120530657 /nfs/dbraw/zinc/53/06/57/1120530657.db2.gz PHVALFVUPBCNMO-RYUDHWBXSA-N 1 0 262.353 3.824 20 5 CHBDRO CSCC[C@H](C)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093558615 1120562637 /nfs/dbraw/zinc/56/26/37/1120562637.db2.gz JBKZEONLYGMVAS-CFNZNRNTSA-N 1 0 294.420 3.681 20 5 CHBDRO CC(C)(/C=C\Cl)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000922649056 1120571851 /nfs/dbraw/zinc/57/18/51/1120571851.db2.gz RLIACMQOWDBDNT-XGOROQTFSA-N 1 0 280.755 3.729 20 5 CHBDRO Cc1ccc(CNc2cccc(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000124552205 1120572880 /nfs/dbraw/zinc/57/28/80/1120572880.db2.gz UAEHYRXMNDQQFB-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO CCSCCC[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000500375650 1120600223 /nfs/dbraw/zinc/60/02/23/1120600223.db2.gz IOHYNTBQRMWTNI-UHFFFAOYSA-N 1 0 296.436 3.951 20 5 CHBDRO Cc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000302740915 1120656916 /nfs/dbraw/zinc/65/69/16/1120656916.db2.gz KNDAFOHELIDYRV-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO C[C@H]([NH2+]CCCNc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000131994901 1120678786 /nfs/dbraw/zinc/67/87/86/1120678786.db2.gz KFXHXQLVQIXQJZ-AWEZNQCLSA-N 1 0 299.374 3.748 20 5 CHBDRO CCSCC[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000132280882 1120685807 /nfs/dbraw/zinc/68/58/07/1120685807.db2.gz YCJAYJWAEOCNPS-NEPJUHHUSA-N 1 0 282.409 3.777 20 5 CHBDRO CC(C)CSCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000181757582 1120720190 /nfs/dbraw/zinc/72/01/90/1120720190.db2.gz SCSPRFKDAUOMRD-LBPRGKRZSA-N 1 0 282.409 3.635 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000049556689 1120860305 /nfs/dbraw/zinc/86/03/05/1120860305.db2.gz YAASWBZGDUXOOB-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@@H]([NH2+]CCCC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000163360071 1121019643 /nfs/dbraw/zinc/01/96/43/1121019643.db2.gz MOURSTFTWBYJHW-OAHLLOKOSA-N 1 0 262.353 3.826 20 5 CHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001174781182 1121027879 /nfs/dbraw/zinc/02/78/79/1121027879.db2.gz ULPKTRZJFIXTIL-UONOGXRCSA-N 1 0 292.379 3.627 20 5 CHBDRO C=C/[NH+]=c1\ccc2nc3c(cc(N)c4ccccc43)oc-2c1 ZINC001174792100 1121032364 /nfs/dbraw/zinc/03/23/64/1121032364.db2.gz SVFUDYURXCILEL-RGVLZGJSSA-N 1 0 287.322 3.712 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)cc1 ZINC000133828883 1121043743 /nfs/dbraw/zinc/04/37/43/1121043743.db2.gz UQGRUDRKVFXOIK-MRXNPFEDSA-N 1 0 286.306 3.511 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH+](CC2CC2)CC2CC2)c1 ZINC000070505275 1128984357 /nfs/dbraw/zinc/98/43/57/1128984357.db2.gz VYZLKVFRQSIUQG-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCC1 ZINC000706765108 1121439541 /nfs/dbraw/zinc/43/95/41/1121439541.db2.gz ZUKAQLQNRISSGG-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000573749729 1121487320 /nfs/dbraw/zinc/48/73/20/1121487320.db2.gz XHVGZGLDXYUQNW-NWANDNLSSA-N 1 0 276.380 3.988 20 5 CHBDRO C[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@@H]1C ZINC000512647834 1121506133 /nfs/dbraw/zinc/50/61/33/1121506133.db2.gz HTGBOAZWEOWWIW-MVUUYHCISA-N 1 0 274.364 3.728 20 5 CHBDRO C[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@H]1C ZINC000512647890 1121506904 /nfs/dbraw/zinc/50/69/04/1121506904.db2.gz HTGBOAZWEOWWIW-VVYAQTJFSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000512653208 1121509849 /nfs/dbraw/zinc/50/98/49/1121509849.db2.gz VGMYTIWHJKWOGZ-WCQYABFASA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000512653188 1121510450 /nfs/dbraw/zinc/51/04/50/1121510450.db2.gz VGMYTIWHJKWOGZ-AAEUAGOBSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1ccc(CN(C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000120463255 1121547356 /nfs/dbraw/zinc/54/73/56/1121547356.db2.gz SKZOHOOIALTPEK-UHFFFAOYSA-N 1 0 276.361 3.597 20 5 CHBDRO Cc1c(C[N@H+]2CC3(CCC3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000433256850 1121631844 /nfs/dbraw/zinc/63/18/44/1121631844.db2.gz CATFGSBYIKQYKH-LBPRGKRZSA-N 1 0 274.364 3.668 20 5 CHBDRO CSC[C@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433263783 1121632996 /nfs/dbraw/zinc/63/29/96/1121632996.db2.gz WXCAFJWKTNGPRB-HZMBPMFUSA-N 1 0 294.420 3.658 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCCC1CC1 ZINC000611336004 1121638105 /nfs/dbraw/zinc/63/81/05/1121638105.db2.gz JTIHUVRSMFQBFJ-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO CC1(C)C[C@H]([NH2+]CCC2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433290165 1121639378 /nfs/dbraw/zinc/63/93/78/1121639378.db2.gz VYAXZAPTSWRXQW-HNNXBMFYSA-N 1 0 274.364 3.707 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](C)[C@@H](F)C1 ZINC000611516984 1121654031 /nfs/dbraw/zinc/65/40/31/1121654031.db2.gz QLRXZECDDVRUCY-HUBLWGQQSA-N 1 0 280.343 3.644 20 5 CHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000445882256 1121688141 /nfs/dbraw/zinc/68/81/41/1121688141.db2.gz ZCJIGNPRWSSLIB-LLVKDONJSA-N 1 0 290.285 3.661 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CS[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000397812204 1121697871 /nfs/dbraw/zinc/69/78/71/1121697871.db2.gz GUTQXQRWQSKCDG-ZLDLUXBVSA-N 1 0 294.420 3.920 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCO[C@@H](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC001178205786 1121771099 /nfs/dbraw/zinc/77/10/99/1121771099.db2.gz UUVNEPUDMXHTOA-CWRNSKLLSA-N 1 0 292.379 3.593 20 5 CHBDRO CC/C=C/C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC001178800689 1121817384 /nfs/dbraw/zinc/81/73/84/1121817384.db2.gz INQMPVRKRHDLMB-AATRIKPKSA-N 1 0 262.353 3.774 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[C@H](C)C[C@H]1C ZINC000070113018 1121939171 /nfs/dbraw/zinc/93/91/71/1121939171.db2.gz TVZOHZGSCWTTRA-YWPYICTPSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC001180199383 1121967138 /nfs/dbraw/zinc/96/71/38/1121967138.db2.gz RNGSGNNNEAYHLT-YPMHNXCESA-N 1 0 276.380 3.690 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]1C ZINC000501902427 1122021988 /nfs/dbraw/zinc/02/19/88/1122021988.db2.gz WHRGCKHGWHRXEZ-SLEUVZQESA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])oc1C ZINC000502424927 1122085108 /nfs/dbraw/zinc/08/51/08/1122085108.db2.gz AXUBLPFJTYDMCT-LBPRGKRZSA-N 1 0 288.347 3.698 20 5 CHBDRO CCSCCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000502574335 1122114837 /nfs/dbraw/zinc/11/48/37/1122114837.db2.gz ICXNGZQPYNACTA-GFCCVEGCSA-N 1 0 282.409 3.697 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)C1CCC1 ZINC000324951524 1129032378 /nfs/dbraw/zinc/03/23/78/1129032378.db2.gz BPTTVAIQQSMYIN-CQSZACIVSA-N 1 0 280.343 3.792 20 5 CHBDRO C[C@H]([NH2+]C1CC2(C1)CCCC2)c1ccccc1[N+](=O)[O-] ZINC001183651444 1122232654 /nfs/dbraw/zinc/23/26/54/1122232654.db2.gz DNBKYVFCOXQBPZ-LBPRGKRZSA-N 1 0 274.364 3.968 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2CCCC2)cc1[N+](=O)[O-] ZINC000504911480 1122309687 /nfs/dbraw/zinc/30/96/87/1122309687.db2.gz GWEVGAXZXYMNNY-GFCCVEGCSA-N 1 0 292.379 3.834 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)C1(C)CC1 ZINC000183391751 1129051734 /nfs/dbraw/zinc/05/17/34/1129051734.db2.gz DHYPFHWFRPOHND-LBPRGKRZSA-N 1 0 262.353 3.524 20 5 CHBDRO CCN(Cc1cccs1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505592470 1122428922 /nfs/dbraw/zinc/42/89/22/1122428922.db2.gz XUDYMANCYXAYEM-UHFFFAOYSA-N 1 0 294.351 3.818 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc(C(F)(F)F)c1Cl ZINC001225889431 1122624184 /nfs/dbraw/zinc/62/41/84/1122624184.db2.gz VXEZBFCANKHPGU-SECBINFHSA-N 1 0 296.740 3.832 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000509546648 1122726391 /nfs/dbraw/zinc/72/63/91/1122726391.db2.gz WOOFNUXLZWRKIF-ZDUSSCGKSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@H]1CC[C@H]([N@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429600740 1122727406 /nfs/dbraw/zinc/72/74/06/1122727406.db2.gz WTRKEGVAQLQQQM-QWRGUYRKSA-N 1 0 282.771 3.869 20 5 CHBDRO C=C/C=C/CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194478308 1122779363 /nfs/dbraw/zinc/77/93/63/1122779363.db2.gz SOJLVIKKRRBIBZ-QDLOVBKTSA-N 1 0 286.375 3.907 20 5 CHBDRO CC[C@H](C)[N@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000507190269 1122845453 /nfs/dbraw/zinc/84/54/53/1122845453.db2.gz YKQLSVKDGJOFOP-LBPRGKRZSA-N 1 0 264.369 3.949 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H](C3CCC3)C2)cc1 ZINC001196255107 1122913053 /nfs/dbraw/zinc/91/30/53/1122913053.db2.gz QWIHQBHYQFEXCW-INIZCTEOSA-N 1 0 288.391 3.649 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1C[C@@H]1c1ccccc1 ZINC000507162060 1122932472 /nfs/dbraw/zinc/93/24/72/1122932472.db2.gz UANIIZGPPHEXKL-IAGOWNOFSA-N 1 0 296.370 3.830 20 5 CHBDRO Cc1ccc(C)c(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000507151161 1122933299 /nfs/dbraw/zinc/93/32/99/1122933299.db2.gz BDNWAQHLPAGVEX-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507227181 1122941643 /nfs/dbraw/zinc/94/16/43/1122941643.db2.gz DNXCDEOHKKKZBO-FNOHHLHBSA-N 1 0 262.353 3.584 20 5 CHBDRO C[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000507245246 1122943997 /nfs/dbraw/zinc/94/39/97/1122943997.db2.gz XKTUVWURLWBCGF-SECBINFHSA-N 1 0 288.269 3.588 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC1CC(C)(C)C1 ZINC001202031076 1123172313 /nfs/dbraw/zinc/17/23/13/1123172313.db2.gz CRQBUYCJXAMMIX-UHFFFAOYSA-N 1 0 276.380 3.737 20 5 CHBDRO CCC[NH+](CCC)Cc1cccc([N+](=O)[O-])c1C ZINC000216446682 1123219274 /nfs/dbraw/zinc/21/92/74/1123219274.db2.gz HJOWPMJMTZCCRF-UHFFFAOYSA-N 1 0 250.342 3.525 20 5 CHBDRO C[C@H]1CCC[C@@H](C[NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000507939332 1123247811 /nfs/dbraw/zinc/24/78/11/1123247811.db2.gz PRYKLNQYTQDWBX-DZGCQCFKSA-N 1 0 276.380 3.553 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1C=CCC1)CCCC2 ZINC000850505966 1123276346 /nfs/dbraw/zinc/27/63/46/1123276346.db2.gz ACTSBSMRVVIJKT-CJNGLKHVSA-N 1 0 272.348 3.671 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000134230332 1123313909 /nfs/dbraw/zinc/31/39/09/1123313909.db2.gz IJLIUXAENUIJIM-OAHLLOKOSA-N 1 0 286.306 3.511 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(CF)CC1 ZINC000449459623 1123353236 /nfs/dbraw/zinc/35/32/36/1123353236.db2.gz QQNOVYNUCWFUKF-LCYFTJDESA-N 1 0 292.354 3.680 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783547704 1123748977 /nfs/dbraw/zinc/74/89/77/1123748977.db2.gz UOSQNPZARNKDER-NSHDSACASA-N 1 0 268.744 3.623 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(C(F)F)CC1 ZINC000475214068 1123825750 /nfs/dbraw/zinc/82/57/50/1123825750.db2.gz FHBHLWTUXOPRPJ-XFFZJAGNSA-N 1 0 296.317 3.633 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1CNCc1ccc(F)cc1 ZINC000084439667 1129152189 /nfs/dbraw/zinc/15/21/89/1129152189.db2.gz RMBHRSNAZFJBGM-UHFFFAOYSA-N 1 0 294.713 3.677 20 5 CHBDRO C[C@H](CCc1cccnc1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000866243526 1124040339 /nfs/dbraw/zinc/04/03/39/1124040339.db2.gz RSTPATGNTQODLG-ZIAGYGMSSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC2(CCC2)C1 ZINC000866383651 1124060399 /nfs/dbraw/zinc/06/03/99/1124060399.db2.gz AGAZYSCINULLIT-NSHDSACASA-N 1 0 292.354 3.587 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC[C@H]2CCSC2)cccc1[N+](=O)[O-] ZINC000866402522 1124062769 /nfs/dbraw/zinc/06/27/69/1124062769.db2.gz MHMGLEUEUMGZGO-OLZOCXBDSA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@H]1CCCCC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000088512765 1124063787 /nfs/dbraw/zinc/06/37/87/1124063787.db2.gz PMPNHTOSGRVKQH-BBRMVZONSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@H](F)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000440699695 1124078312 /nfs/dbraw/zinc/07/83/12/1124078312.db2.gz UKZBUYFDHYBMRA-ZDUSSCGKSA-N 1 0 268.332 3.553 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)C(C)(C)C(F)F)cc1[N+](=O)[O-] ZINC000866540477 1124080287 /nfs/dbraw/zinc/08/02/87/1124080287.db2.gz OWSXDIIWUFUDTM-SNVBAGLBSA-N 1 0 286.322 3.673 20 5 CHBDRO CC(C)(C)C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000144578310 1124114563 /nfs/dbraw/zinc/11/45/63/1124114563.db2.gz URSSTKRMNXBNHR-OAHLLOKOSA-N 1 0 276.380 3.995 20 5 CHBDRO CC(C)C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001119253248 1131249570 /nfs/dbraw/zinc/24/95/70/1131249570.db2.gz DMHIHEYKQUBZPZ-UHFFFAOYSA-N 1 0 294.395 3.730 20 5 CHBDRO CC1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000447584786 1124492101 /nfs/dbraw/zinc/49/21/01/1124492101.db2.gz HHQZOKIJBHAWCM-OAHLLOKOSA-N 1 0 274.364 3.752 20 5 CHBDRO CC1(C)C[C@H]1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447578506 1124497520 /nfs/dbraw/zinc/49/75/20/1124497520.db2.gz FWKPSFJQEFCSJP-WFASDCNBSA-N 1 0 274.364 3.608 20 5 CHBDRO CC(C)CSCC[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449209435 1124669511 /nfs/dbraw/zinc/66/95/11/1124669511.db2.gz QQMBTPMIKKKXQB-CYBMUJFWSA-N 1 0 296.436 3.505 20 5 CHBDRO C[C@@H]([NH2+]CCCC(C)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872072845 1124674325 /nfs/dbraw/zinc/67/43/25/1124674325.db2.gz KQSNFVUPWIRVBD-SECBINFHSA-N 1 0 290.285 3.820 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1c(F)cccc1[N+](=O)[O-] ZINC000872080425 1124677476 /nfs/dbraw/zinc/67/74/76/1124677476.db2.gz XGKIERMHCFTWLF-NOHGZBONSA-N 1 0 278.327 3.573 20 5 CHBDRO CCSC1(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872089264 1124680963 /nfs/dbraw/zinc/68/09/63/1124680963.db2.gz WCQUYIUUEHTCGL-SNVBAGLBSA-N 1 0 298.383 3.670 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC[C@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000872128138 1124690697 /nfs/dbraw/zinc/69/06/97/1124690697.db2.gz FTAKRJOYBMSPTR-SRVKXCTJSA-N 1 0 280.393 3.530 20 5 CHBDRO Cc1cc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000449316492 1124691704 /nfs/dbraw/zinc/69/17/04/1124691704.db2.gz ZERYZKQMSHUUGI-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO C[C@H]([NH2+]C1CC(OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000449347455 1124696277 /nfs/dbraw/zinc/69/62/77/1124696277.db2.gz HMVHYEVGZCUNDB-ZOODHJKOSA-N 1 0 292.379 3.592 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])ccc1F ZINC000873183278 1124747525 /nfs/dbraw/zinc/74/75/25/1124747525.db2.gz BJQQQMKWCGQOGY-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CC=CCC1 ZINC000532208850 1125240949 /nfs/dbraw/zinc/24/09/49/1125240949.db2.gz AOBQAWQQGDAKKR-KBPBESRZSA-N 1 0 274.364 3.910 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CC=CCC1 ZINC000532208853 1125241245 /nfs/dbraw/zinc/24/12/45/1125241245.db2.gz AOBQAWQQGDAKKR-ZIAGYGMSSA-N 1 0 274.364 3.910 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532293469 1125248445 /nfs/dbraw/zinc/24/84/45/1125248445.db2.gz GOQRZDXNCSQTPX-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C1CC1)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000324663206 1125293214 /nfs/dbraw/zinc/29/32/14/1125293214.db2.gz ISQXOQOAXYQDJG-BDJLRTHQSA-N 1 0 274.364 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C2(C3CCC3)CC2)c1 ZINC000697402839 1125316354 /nfs/dbraw/zinc/31/63/54/1125316354.db2.gz WPMZUEBYRRPJLA-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccccc1 ZINC000532442404 1125386742 /nfs/dbraw/zinc/38/67/42/1125386742.db2.gz HEHHKPLASLQFKH-OAHLLOKOSA-N 1 0 298.386 3.748 20 5 CHBDRO C[C@@H](C[NH2+][C@@H]1CCCC12CC2)c1ccccc1[N+](=O)[O-] ZINC000897461110 1125424049 /nfs/dbraw/zinc/42/40/49/1125424049.db2.gz LKIQYQLBBLZMBN-SWLSCSKDSA-N 1 0 274.364 3.621 20 5 CHBDRO C[C@@H](C[NH2+][C@@H]1CCC12CCC2)c1ccccc1[N+](=O)[O-] ZINC000897465033 1125425097 /nfs/dbraw/zinc/42/50/97/1125425097.db2.gz QZOMXYSXDSUYFJ-SWLSCSKDSA-N 1 0 274.364 3.621 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCCCCC1 ZINC000094774338 1129451637 /nfs/dbraw/zinc/45/16/37/1129451637.db2.gz YPIKYIHRUMRELS-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000094772894 1129451879 /nfs/dbraw/zinc/45/18/79/1129451879.db2.gz HPGYRVLPBJKSRT-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO CC(C)C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000743851507 1129540238 /nfs/dbraw/zinc/54/02/38/1129540238.db2.gz IZXNDCMMBFRZFP-UHFFFAOYSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1C ZINC000252216494 1129559237 /nfs/dbraw/zinc/55/92/37/1129559237.db2.gz XVKOUWJXNCMXHX-QWRGUYRKSA-N 1 0 282.771 3.869 20 5 CHBDRO CC(C)[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001168985293 1129686825 /nfs/dbraw/zinc/68/68/25/1129686825.db2.gz SRQLPSZNDQFZQZ-RCBQFDQVSA-N 1 0 294.370 3.558 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168984959 1129687033 /nfs/dbraw/zinc/68/70/33/1129687033.db2.gz BODDXPOGGWBKOQ-TUKIKUTGSA-N 1 0 296.798 3.826 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccs1 ZINC001168968186 1129687914 /nfs/dbraw/zinc/68/79/14/1129687914.db2.gz XHCZKHUQSFWXLX-AVGNSLFASA-N 1 0 282.409 3.624 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C)cc1 ZINC001169006283 1129689057 /nfs/dbraw/zinc/68/90/57/1129689057.db2.gz XEHWNLJIZFVRSL-DJIMGWMZSA-N 1 0 290.407 3.871 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168987180 1129689815 /nfs/dbraw/zinc/68/98/15/1129689815.db2.gz HGUAUMWNWMHEMD-DAXOMENPSA-N 1 0 294.370 3.558 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1Cl ZINC001168988577 1129690086 /nfs/dbraw/zinc/69/00/86/1129690086.db2.gz SNQBJMSURXUFQV-SGMGOOAPSA-N 1 0 296.798 3.744 20 5 CHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2CCCC[C@H]2c2ccccc2)C1 ZINC001169051998 1129692481 /nfs/dbraw/zinc/69/24/81/1129692481.db2.gz FIPBYULVNOJYAP-XIRDDKMYSA-N 1 0 288.391 3.659 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001169724912 1129750961 /nfs/dbraw/zinc/75/09/61/1129750961.db2.gz YWACNECHSJFQGB-CQSZACIVSA-N 1 0 276.380 3.853 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801527278 1129924131 /nfs/dbraw/zinc/92/41/31/1129924131.db2.gz ISEQIYCLGWXQAX-QWRGUYRKSA-N 1 0 280.343 3.648 20 5 CHBDRO CCO[C@H]1CCC[C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000903086278 1130110648 /nfs/dbraw/zinc/11/06/48/1130110648.db2.gz FRPXFOOLEKAFMI-IHRRRGAJSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000903284169 1130145898 /nfs/dbraw/zinc/14/58/98/1130145898.db2.gz PVMVCAOZIORNFV-WCQYABFASA-N 1 0 294.420 3.920 20 5 CHBDRO CCCCC[C@@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788499900 1130191398 /nfs/dbraw/zinc/19/13/98/1130191398.db2.gz WZPOHLYVVWNOPY-VXGBXAGGSA-N 1 0 279.384 3.796 20 5 CHBDRO CCCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788499888 1130191453 /nfs/dbraw/zinc/19/14/53/1130191453.db2.gz WZPOHLYVVWNOPY-NEPJUHHUSA-N 1 0 279.384 3.796 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc[nH]1 ZINC000788593577 1130196208 /nfs/dbraw/zinc/19/62/08/1130196208.db2.gz VAINCIXLCHWPHX-MEDUHNTESA-N 1 0 299.374 3.996 20 5 CHBDRO CSc1c(Cl)cccc1O[C@@H](C)C[N+](C)(C)C ZINC001234246802 1130623448 /nfs/dbraw/zinc/62/34/48/1130623448.db2.gz CSVGELDGFKSKNV-JTQLQIEISA-N 1 0 274.837 3.535 20 5 CHBDRO CSc1c(Cl)cccc1O[C@H](C)C[N+](C)(C)C ZINC001234246803 1130623989 /nfs/dbraw/zinc/62/39/89/1130623989.db2.gz CSVGELDGFKSKNV-SNVBAGLBSA-N 1 0 274.837 3.535 20 5 CHBDRO C[NH2+][C@@H]1CCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC001235832214 1130785457 /nfs/dbraw/zinc/78/54/57/1130785457.db2.gz UVKHYAWHHGVUJR-QGZVFWFLSA-N 1 0 290.410 3.787 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783534587 1130835695 /nfs/dbraw/zinc/83/56/95/1130835695.db2.gz XDNFDMPENFPNFA-SNVBAGLBSA-N 1 0 270.760 3.726 20 5 CHBDRO CCC(C)(C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783566039 1130837366 /nfs/dbraw/zinc/83/73/66/1130837366.db2.gz HADNQOYIHITUQS-UHFFFAOYSA-N 1 0 270.760 3.869 20 5 CHBDRO CCC1(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCC1 ZINC000783639612 1130844281 /nfs/dbraw/zinc/84/42/81/1130844281.db2.gz WFJQSVIMJBCVIM-UHFFFAOYSA-N 1 0 282.771 3.918 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C23CCC(CC2)C3)cc1Cl ZINC000783666488 1130845226 /nfs/dbraw/zinc/84/52/26/1130845226.db2.gz GFCZIKDLXRJTMX-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO C[C@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783675806 1130847566 /nfs/dbraw/zinc/84/75/66/1130847566.db2.gz DYPZLGKWAUTUOQ-SSDOTTSWSA-N 1 0 296.676 3.679 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C23CCC(CC2)C3)c(Cl)c1 ZINC000784644309 1130914952 /nfs/dbraw/zinc/91/49/52/1130914952.db2.gz WBAKCAFGKOLCEM-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799196887 1131075290 /nfs/dbraw/zinc/07/52/90/1131075290.db2.gz ZDHHDDIRPLAPKS-DZGCQCFKSA-N 1 0 297.358 3.540 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1C ZINC000816648933 1131120916 /nfs/dbraw/zinc/12/09/16/1131120916.db2.gz QWSOHKLWVIDRFC-VXGBXAGGSA-N 1 0 286.331 3.695 20 5 CHBDRO CC1(C)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1(C)C ZINC001116444158 1131146331 /nfs/dbraw/zinc/14/63/31/1131146331.db2.gz SWURKPVAFWNFSV-CLFYSBASSA-N 1 0 274.364 3.728 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CC1CCCCCC1)C2 ZINC001116592945 1131155869 /nfs/dbraw/zinc/15/58/69/1131155869.db2.gz PSYWTKWUTYIQMV-UHFFFAOYSA-N 1 0 274.364 3.881 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCC[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC001202813092 1131436400 /nfs/dbraw/zinc/43/64/00/1131436400.db2.gz QSILICVUPSCNBS-HOTGVXAUSA-N 1 0 288.391 3.819 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1CC2(CCC2)C1 ZINC001203011471 1131675947 /nfs/dbraw/zinc/67/59/47/1131675947.db2.gz KTSQPGLAQYFALK-UHFFFAOYSA-N 1 0 274.364 3.634 20 5 CHBDRO Cc1nc(-c2ccccc2O[C@@H](C)C[N+](C)(C)C)cs1 ZINC001228463115 1131887694 /nfs/dbraw/zinc/88/76/94/1131887694.db2.gz VIHPBANKXWCOPK-LBPRGKRZSA-N 1 0 291.440 3.592 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC1CCC1 ZINC000773036479 1131925620 /nfs/dbraw/zinc/92/56/20/1131925620.db2.gz OEEGSLYGQKSQHS-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036790525 1131974543 /nfs/dbraw/zinc/97/45/43/1131974543.db2.gz KVOCMIHSZWOMDX-JTQLQIEISA-N 1 0 270.760 3.869 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000036993660 1131985634 /nfs/dbraw/zinc/98/56/34/1131985634.db2.gz JKPUBLQUWCANGR-BLLLJJGKSA-N 1 0 288.347 3.860 20 5 CHBDRO C[C@@H]([NH2+]CC[C@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000715755831 1131990652 /nfs/dbraw/zinc/99/06/52/1131990652.db2.gz RKUSHXHOBJKRHO-BXUZGUMPSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)CC(C)C)cc1[N+](=O)[O-] ZINC000037260592 1132025074 /nfs/dbraw/zinc/02/50/74/1132025074.db2.gz ZBVMBQVEPCZPLF-OLZOCXBDSA-N 1 0 264.369 3.988 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1nccc2c3ccccc3ccc21 ZINC001230202696 1132160054 /nfs/dbraw/zinc/16/00/54/1132160054.db2.gz BEPVTWUUNXYHHD-AWEZNQCLSA-N 1 0 295.406 3.862 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)cc1Cl ZINC000839189665 1132190154 /nfs/dbraw/zinc/19/01/54/1132190154.db2.gz BHPDENKOAKIVDB-NTZNESFSSA-N 1 0 280.755 3.526 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914560 1132360217 /nfs/dbraw/zinc/36/02/17/1132360217.db2.gz HSOCFMNMDUJHPA-HZPDHXFCSA-N 1 0 288.391 3.717 20 5 CHBDRO Cc1ccc(CC[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173216793 1132411329 /nfs/dbraw/zinc/41/13/29/1132411329.db2.gz MZOCMNNVUWNEPG-HNNXBMFYSA-N 1 0 298.386 3.667 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173219221 1132411337 /nfs/dbraw/zinc/41/13/37/1132411337.db2.gz ZFGLZXMSHULSNM-STQMWFEESA-N 1 0 264.369 3.550 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1C[C@@H]1c1ccccc1 ZINC001173219240 1132411398 /nfs/dbraw/zinc/41/13/98/1132411398.db2.gz ZSWQWTNTKWSNAQ-VHSSKADRSA-N 1 0 296.370 3.672 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCc1ccccc1 ZINC001173217640 1132411530 /nfs/dbraw/zinc/41/15/30/1132411530.db2.gz YDKSREDJZJHEJY-HNNXBMFYSA-N 1 0 298.386 3.748 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1C[C@H]1c1ccccc1 ZINC001173219239 1132411873 /nfs/dbraw/zinc/41/18/73/1132411873.db2.gz ZSWQWTNTKWSNAQ-KKXDTOCCSA-N 1 0 296.370 3.672 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H](C)C1 ZINC001173226056 1132412330 /nfs/dbraw/zinc/41/23/30/1132412330.db2.gz KXAXSWUDWPDTLK-UONOGXRCSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001173223104 1132412692 /nfs/dbraw/zinc/41/26/92/1132412692.db2.gz XRQXYDQSGOXQRC-VNQPRFMTSA-N 1 0 288.391 3.648 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233457 1132413648 /nfs/dbraw/zinc/41/36/48/1132413648.db2.gz WSAJJNBAMKFIAF-ZFWWWQNUSA-N 1 0 276.380 3.790 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@@H]1CC1(C)C ZINC001173231263 1132413811 /nfs/dbraw/zinc/41/38/11/1132413811.db2.gz AGJJWIOABFKCSH-JSGCOSHPSA-N 1 0 276.380 3.504 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@H]1CC1(C)C ZINC001173231265 1132414045 /nfs/dbraw/zinc/41/40/45/1132414045.db2.gz AGJJWIOABFKCSH-TZMCWYRMSA-N 1 0 276.380 3.504 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001173233753 1132414111 /nfs/dbraw/zinc/41/41/11/1132414111.db2.gz NETIMAOYHQFIIN-KBXCAEBGSA-N 1 0 296.370 3.973 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC2(C1)CCCCC2 ZINC001173232406 1132414176 /nfs/dbraw/zinc/41/41/76/1132414176.db2.gz FUZGEQBMGBKMEY-CQSZACIVSA-N 1 0 288.391 3.792 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC12CC2 ZINC001173235749 1132415731 /nfs/dbraw/zinc/41/57/31/1132415731.db2.gz ZAZNJTCGPJPMPK-ZDUSSCGKSA-N 1 0 274.364 3.544 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC[C@@H](C)C1 ZINC001173210717 1132416446 /nfs/dbraw/zinc/41/64/46/1132416446.db2.gz MPBMJGPVIMTWBZ-NFAWXSAZSA-N 1 0 276.380 3.694 20 5 CHBDRO C[N@@H+](Cc1ccc2ccc3cccnc3c2n1)CC1CC1 ZINC001232219936 1132439318 /nfs/dbraw/zinc/43/93/18/1132439318.db2.gz YAXRSQIQMOHNPJ-UHFFFAOYSA-N 1 0 277.371 3.625 20 5 CHBDRO F[C@@H]1CCCN(Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232221571 1132439591 /nfs/dbraw/zinc/43/95/91/1132439591.db2.gz IUDCQMPESBMDJS-OAHLLOKOSA-N 1 0 295.361 3.717 20 5 CHBDRO CC(C)(C[NH3+])c1ccc(Nc2cccc([N+](=O)[O-])c2)cc1 ZINC001159580712 1132866636 /nfs/dbraw/zinc/86/66/36/1132866636.db2.gz WTHIECUAZMNUSK-UHFFFAOYSA-N 1 0 285.347 3.575 20 5 CHBDRO Cc1c[nH+]ccc1Nc1cccc2nc3ccccc3nc21 ZINC001174539692 1132900097 /nfs/dbraw/zinc/90/00/97/1132900097.db2.gz MXIOOKSYNVIZLN-UHFFFAOYSA-N 1 0 286.338 3.652 20 5 CHBDRO CC[NH2+]Cc1cccc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)c1 ZINC001159955968 1132928721 /nfs/dbraw/zinc/92/87/21/1132928721.db2.gz BKUFWMLTCFPZPT-ZHACJKMWSA-N 1 0 297.358 3.787 20 5 CHBDRO Cc1ccc(Nc2c[nH+]c3cccc(C)n23)cc1[N+](=O)[O-] ZINC001213666009 1134476120 /nfs/dbraw/zinc/47/61/20/1134476120.db2.gz WZPQOGPTRUGTOQ-UHFFFAOYSA-N 1 0 282.303 3.603 20 5 CHBDRO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccc([N+](=O)[O-])cc1 ZINC000403635474 1134821308 /nfs/dbraw/zinc/82/13/08/1134821308.db2.gz NABWLGBFKKXHRE-UFBLJUAHSA-N 1 0 292.404 3.672 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@@H]3CCC34C[NH2+]C4)cc2c1 ZINC001218241365 1135072800 /nfs/dbraw/zinc/07/28/00/1135072800.db2.gz SWDQQKPRBBPZFZ-QGZVFWFLSA-N 1 0 290.366 3.519 20 5 CHBDRO C[C@@H]1C[NH2+]CC[C@@H]1Oc1cccc2cc3ccccc3nc21 ZINC001218415751 1135101381 /nfs/dbraw/zinc/10/13/81/1135101381.db2.gz QAUFDPFOTLKTCH-DYVFJYSZSA-N 1 0 292.382 3.765 20 5 CHBDRO C/C=C/[C@H](OCCC[N+](C)(C)C)C1CCCCC1 ZINC001224623998 1135462501 /nfs/dbraw/zinc/46/25/01/1135462501.db2.gz SCSBIUNJYRGOHL-YKXBDCQTSA-N 1 0 254.438 3.624 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCCCCCCOc1ccccc1 ZINC001224938155 1135495099 /nfs/dbraw/zinc/49/50/99/1135495099.db2.gz FMIQWSGXJAQUEX-QGZVFWFLSA-N 1 0 294.459 3.737 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000070101811 260152225 /nfs/dbraw/zinc/15/22/25/260152225.db2.gz SJLPQEYFDDQFNH-XHDPSFHLSA-N 1 0 262.353 3.824 20 5 CHBDRO CCc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000352755600 529656961 /nfs/dbraw/zinc/65/69/61/529656961.db2.gz MRNUVXMNTWDNQP-CYBMUJFWSA-N 1 0 299.374 3.711 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCC(C)(C)C1 ZINC000344471402 529995709 /nfs/dbraw/zinc/99/57/09/529995709.db2.gz XNTBRYIJFFJLBQ-AWEZNQCLSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000090217455 260339208 /nfs/dbraw/zinc/33/92/08/260339208.db2.gz GGOMYABLVDLPCO-UWVGGRQHSA-N 1 0 290.285 3.895 20 5 CHBDRO CC(C)[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000017281374 170731240 /nfs/dbraw/zinc/73/12/40/170731240.db2.gz ZETCXNKOMJYEDX-UHFFFAOYSA-N 1 0 297.786 3.533 20 5 CHBDRO CC(C)CC[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000020122974 171003806 /nfs/dbraw/zinc/00/38/06/171003806.db2.gz RNAPNFKZVZOVET-GFCCVEGCSA-N 1 0 250.342 3.509 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000020130152 171018915 /nfs/dbraw/zinc/01/89/15/171018915.db2.gz DSTRSRNUSFCSNX-PXAZEXFGSA-N 1 0 282.343 3.933 20 5 CHBDRO C[C@H](CCc1ccco1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000020526227 171239398 /nfs/dbraw/zinc/23/93/98/171239398.db2.gz JKQIVBLLOXOEFH-OLZOCXBDSA-N 1 0 288.347 3.860 20 5 CHBDRO C[C@@H]([NH2+]CCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000021015298 171289648 /nfs/dbraw/zinc/28/96/48/171289648.db2.gz UASPEQOEHAVVGQ-CQSZACIVSA-N 1 0 284.359 3.878 20 5 CHBDRO CCCCC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035368071 172159542 /nfs/dbraw/zinc/15/95/42/172159542.db2.gz YWZYTGOMXPVTKV-UHFFFAOYSA-N 1 0 256.733 3.528 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000035732859 172383792 /nfs/dbraw/zinc/38/37/92/172383792.db2.gz QJOBKCIXKCLJFN-NHYWBVRUSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)cs1 ZINC000344343170 225036624 /nfs/dbraw/zinc/03/66/24/225036624.db2.gz FOOGTPLRCYBBSJ-JHJVBQTASA-N 1 0 280.393 3.715 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)cs1 ZINC000344343171 225037574 /nfs/dbraw/zinc/03/75/74/225037574.db2.gz FOOGTPLRCYBBSJ-RWMBFGLXSA-N 1 0 280.393 3.715 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000348338231 226455771 /nfs/dbraw/zinc/45/57/71/226455771.db2.gz VBNILXJEGBPOLA-UHTWSYAYSA-N 1 0 296.342 3.535 20 5 CHBDRO CCC[C@H]([NH2+]CC(O)(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000087014746 260211052 /nfs/dbraw/zinc/21/10/52/260211052.db2.gz GRTTUFRCMPRIJI-HNNXBMFYSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000090217513 260339480 /nfs/dbraw/zinc/33/94/80/260339480.db2.gz PABXHQSJWYANCN-JKOKRWQUSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000449058651 261137860 /nfs/dbraw/zinc/13/78/60/261137860.db2.gz LAEPCUOFTIRLRV-DGCLKSJQSA-N 1 0 288.347 3.778 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1cccnc1 ZINC000158517544 261166360 /nfs/dbraw/zinc/16/63/60/261166360.db2.gz FLZIHZHMYFWMOH-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000158526169 261166364 /nfs/dbraw/zinc/16/63/64/261166364.db2.gz XRCHQHOJSOFDSB-INIZCTEOSA-N 1 0 287.363 3.564 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1cccnc1 ZINC000158517393 261166542 /nfs/dbraw/zinc/16/65/42/261166542.db2.gz FLZIHZHMYFWMOH-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1cncc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000184305495 262015672 /nfs/dbraw/zinc/01/56/72/262015672.db2.gz PBCBGUAXVVCABY-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000390157148 262143302 /nfs/dbraw/zinc/14/33/02/262143302.db2.gz MXCLUFSDDHGEAJ-FZKQIMNGSA-N 1 0 296.370 3.975 20 5 CHBDRO Cc1cc(NCC2(C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000228557257 262342435 /nfs/dbraw/zinc/34/24/35/262342435.db2.gz YEGZXZPVSXXDDG-UHFFFAOYSA-N 1 0 271.320 3.663 20 5 CHBDRO Cc1occc1C[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000414362692 262849558 /nfs/dbraw/zinc/84/95/58/262849558.db2.gz JXKIVXUKWBCMQI-UHFFFAOYSA-N 1 0 274.320 3.521 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000289751785 263111870 /nfs/dbraw/zinc/11/18/70/263111870.db2.gz JECKEZZDGHNIJH-KRWDZBQOSA-N 1 0 297.358 3.635 20 5 CHBDRO COC1(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CCC1 ZINC000293864222 263151049 /nfs/dbraw/zinc/15/10/49/263151049.db2.gz ZDWGJXMYMNYUQP-CYBMUJFWSA-N 1 0 292.379 3.513 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000514095299 263273752 /nfs/dbraw/zinc/27/37/52/263273752.db2.gz QNKRIMVWEPTIOA-CQSZACIVSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1COCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000417407320 264224679 /nfs/dbraw/zinc/22/46/79/264224679.db2.gz SIIMDTXZRCDQDQ-SJKOYZFVSA-N 1 0 298.342 3.517 20 5 CHBDRO CCOC[C@@H]([NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000189357893 264293857 /nfs/dbraw/zinc/29/38/57/264293857.db2.gz MHEAANUMRMUEAL-HZPDHXFCSA-N 1 0 294.395 3.697 20 5 CHBDRO CC(C)CCC[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000525863655 264565104 /nfs/dbraw/zinc/56/51/04/264565104.db2.gz NFUULAHCOKJCJN-UHFFFAOYSA-N 1 0 284.787 3.817 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)c1cncc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000359224514 266552701 /nfs/dbraw/zinc/55/27/01/266552701.db2.gz DYDJSFLCUHZVJE-GHMZBOCLSA-N 1 0 289.310 3.541 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000020526066 327885134 /nfs/dbraw/zinc/88/51/34/327885134.db2.gz LZTMFHSPDBMLPH-SGMGOOAPSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC2CC(F)(F)C2)cc1[N+](=O)[O-] ZINC000394813811 328011192 /nfs/dbraw/zinc/01/11/92/328011192.db2.gz QAXHCHJYTYITON-JTQLQIEISA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000048335036 328053135 /nfs/dbraw/zinc/05/31/35/328053135.db2.gz CLKNPCVUUNWEJG-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1c(C[NH2+]Cc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000048348215 328130551 /nfs/dbraw/zinc/13/05/51/328130551.db2.gz WNHFVCSSZKXVRB-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000049127207 328341541 /nfs/dbraw/zinc/34/15/41/328341541.db2.gz FTHMRHNOXBBTCG-GXTWGEPZSA-N 1 0 264.369 3.988 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCOCCC(C)C ZINC000531963044 328348218 /nfs/dbraw/zinc/34/82/18/328348218.db2.gz XUTQSGDWOMAZML-CQSZACIVSA-N 1 0 294.395 3.617 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000303586664 328354167 /nfs/dbraw/zinc/35/41/67/328354167.db2.gz GLASITINEIHMBB-OAHLLOKOSA-N 1 0 276.380 3.853 20 5 CHBDRO C[C@@H](Cc1ccsc1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000049155827 328350682 /nfs/dbraw/zinc/35/06/82/328350682.db2.gz GBVWLPGCZCIUCJ-RYUDHWBXSA-N 1 0 290.388 3.938 20 5 CHBDRO C[C@@]1(c2ccccc2)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532038422 328398574 /nfs/dbraw/zinc/39/85/74/328398574.db2.gz ASPZKMDTEVBEAR-GOSISDBHSA-N 1 0 296.370 3.758 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000050225447 328393682 /nfs/dbraw/zinc/39/36/82/328393682.db2.gz LPQWGXXGWAGZDF-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000070305860 328593428 /nfs/dbraw/zinc/59/34/28/328593428.db2.gz PHVALFVUPBCNMO-VXGBXAGGSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccccc1[C@H](C)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000537951189 326870065 /nfs/dbraw/zinc/87/00/65/326870065.db2.gz CBUNJSGNLKVQMS-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC(C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000088455633 327026102 /nfs/dbraw/zinc/02/61/02/327026102.db2.gz ZHSVLYZBBJUKAJ-LBPRGKRZSA-N 1 0 288.391 3.990 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000558972849 327135472 /nfs/dbraw/zinc/13/54/72/327135472.db2.gz ZDAMJTBVYQYLEI-BVGQSLNGSA-N 1 0 296.370 3.877 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000533821140 327203594 /nfs/dbraw/zinc/20/35/94/327203594.db2.gz XLCHQPJRQYIOMJ-QGZVFWFLSA-N 1 0 297.358 3.502 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCC2(F)CCC2)cccc1[N+](=O)[O-] ZINC000554372324 327215848 /nfs/dbraw/zinc/21/58/48/327215848.db2.gz LCMSSAPLMATXLS-LBPRGKRZSA-N 1 0 280.343 3.836 20 5 CHBDRO Cc1cc(C)c(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1C ZINC000048068879 327277265 /nfs/dbraw/zinc/27/72/65/327277265.db2.gz PRSHXVKHLFXSEZ-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCCOCC(C)C)cccc1[N+](=O)[O-] ZINC000163295448 327553242 /nfs/dbraw/zinc/55/32/42/327553242.db2.gz DMNVZMJMPOTIIK-CQSZACIVSA-N 1 0 294.395 3.617 20 5 CHBDRO Cc1cccc(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000051669113 328627020 /nfs/dbraw/zinc/62/70/20/328627020.db2.gz ARTBSBOBMZGNDS-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1cccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000051668991 328627106 /nfs/dbraw/zinc/62/71/06/328627106.db2.gz XNIIQGPCNSOITG-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000042857660 328771402 /nfs/dbraw/zinc/77/14/02/328771402.db2.gz SUOAJIIYZYGFSE-QWHCGFSZSA-N 1 0 262.353 3.511 20 5 CHBDRO Cc1c(C[NH+](C(C)C)C(C)C)cccc1[N+](=O)[O-] ZINC000180455716 329217416 /nfs/dbraw/zinc/21/74/16/329217416.db2.gz GFXFOMDHBXORED-UHFFFAOYSA-N 1 0 250.342 3.522 20 5 CHBDRO CC(C)(CC[NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000392834958 329388602 /nfs/dbraw/zinc/38/86/02/329388602.db2.gz HVXVGSKTCBXNJB-UHFFFAOYSA-N 1 0 262.353 3.511 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000037177106 329549392 /nfs/dbraw/zinc/54/93/92/329549392.db2.gz OBAHSIGNVXUPIA-SNVBAGLBSA-N 1 0 262.334 3.507 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCCC[C@H]1F ZINC000419821143 329745774 /nfs/dbraw/zinc/74/57/74/329745774.db2.gz PCPUUTDTNBNWKV-IEWAYXNBSA-N 1 0 292.354 3.868 20 5 CHBDRO C[NH+](C)C1CCC(Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000420624063 329779726 /nfs/dbraw/zinc/77/97/26/329779726.db2.gz ISAGUHIZUOOVNR-UHFFFAOYSA-N 1 0 297.786 3.533 20 5 CHBDRO Cc1c(C[NH2+]Cc2ccccc2Cl)cccc1[N+](=O)[O-] ZINC000035648684 330248239 /nfs/dbraw/zinc/24/82/39/330248239.db2.gz IUIOTNVENCFCST-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000035648904 330248450 /nfs/dbraw/zinc/24/84/50/330248450.db2.gz RVMFIRVDLFDEDV-RISCZKNCSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000045628954 330347216 /nfs/dbraw/zinc/34/72/16/330347216.db2.gz UHJFSPXINQJODJ-KGLIPLIRSA-N 1 0 274.364 3.910 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](C)CC1 ZINC000533247089 330355098 /nfs/dbraw/zinc/35/50/98/330355098.db2.gz LMQZXEYFOYAJKK-QWHCGFSZSA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@@H](CC[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000060394183 330415372 /nfs/dbraw/zinc/41/53/72/330415372.db2.gz BCRODNJLRGCIIJ-LBPRGKRZSA-N 1 0 290.388 3.940 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000123163734 330448691 /nfs/dbraw/zinc/44/86/91/330448691.db2.gz CXFGSGZTGXVRAI-HUUCEWRRSA-N 1 0 298.386 3.919 20 5 CHBDRO CSCCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433254914 330621394 /nfs/dbraw/zinc/62/13/94/330621394.db2.gz DIOWURYRAWOJFG-AWEZNQCLSA-N 1 0 294.420 3.660 20 5 CHBDRO CC1CC([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433291506 330622669 /nfs/dbraw/zinc/62/26/69/330622669.db2.gz ZMUBDOOECUIXCZ-NWHVRFAMSA-N 1 0 274.364 3.705 20 5 CHBDRO CC(C)(C)C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447544185 330869394 /nfs/dbraw/zinc/86/93/94/330869394.db2.gz UQSHPOJSGQPLFU-AWEZNQCLSA-N 1 0 262.353 3.608 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC=CCC1)CCC2 ZINC000447562760 330870207 /nfs/dbraw/zinc/87/02/07/330870207.db2.gz MWGKNFNGUUWVGS-GUYCJALGSA-N 1 0 286.375 3.918 20 5 CHBDRO CCC[C@H](CC)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449130248 330900943 /nfs/dbraw/zinc/90/09/43/330900943.db2.gz GEQXFXUVBWUNFM-JSGCOSHPSA-N 1 0 264.369 3.694 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000449165655 330902931 /nfs/dbraw/zinc/90/29/31/330902931.db2.gz WVORAADRIUPJCY-CZUORRHYSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000449299009 330912956 /nfs/dbraw/zinc/91/29/56/330912956.db2.gz JYTZPEQTCINCFA-RYUDHWBXSA-N 1 0 298.333 3.551 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000449445719 330926213 /nfs/dbraw/zinc/92/62/13/330926213.db2.gz LLSXTNBKCLJKGO-DUVNUKRYSA-N 1 0 288.391 3.694 20 5 CHBDRO CCC1([NH2+]Cc2c(F)cccc2[N+](=O)[O-])CCCC1 ZINC000451276990 331022820 /nfs/dbraw/zinc/02/28/20/331022820.db2.gz RBVAXNRETAAUHR-UHFFFAOYSA-N 1 0 266.316 3.546 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2CCCC2(F)F)cccc1[N+](=O)[O-] ZINC000453326683 331117143 /nfs/dbraw/zinc/11/71/43/331117143.db2.gz YNUPGCPAFOSPBI-NWDGAFQWSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CCCC2(F)F)cccc1[N+](=O)[O-] ZINC000453326685 331117240 /nfs/dbraw/zinc/11/72/40/331117240.db2.gz YNUPGCPAFOSPBI-RYUDHWBXSA-N 1 0 298.333 3.989 20 5 CHBDRO CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000453339576 331118992 /nfs/dbraw/zinc/11/89/92/331118992.db2.gz HCBOWLYDOHDVIO-WHOFXGATSA-N 1 0 262.353 3.538 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000453366746 331123385 /nfs/dbraw/zinc/12/33/85/331123385.db2.gz ODQYBPSQBHCBCI-CWRNSKLLSA-N 1 0 274.364 3.682 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000164056988 331157389 /nfs/dbraw/zinc/15/73/89/331157389.db2.gz XHLBQDMOXCDDNN-TZMCWYRMSA-N 1 0 282.409 3.777 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000164090921 331161264 /nfs/dbraw/zinc/16/12/64/331161264.db2.gz NQEQKODHDWNNEK-AAEUAGOBSA-N 1 0 282.409 3.695 20 5 CHBDRO C[C@]1([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC=CCC1 ZINC000459753290 331298610 /nfs/dbraw/zinc/29/86/10/331298610.db2.gz LXSLCQGRPOPVFL-GQSKFBFOSA-N 1 0 272.348 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459797147 331301494 /nfs/dbraw/zinc/30/14/94/331301494.db2.gz ZXBRGIAJEGPZQF-VZAMPYOESA-N 1 0 274.364 3.742 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCCCF ZINC000462812920 331330574 /nfs/dbraw/zinc/33/05/74/331330574.db2.gz PCHDRBJOYOIPLI-ZFWWWQNUSA-N 1 0 294.370 3.645 20 5 CHBDRO C[C@@H](C[NH2+]CCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000468009123 331426657 /nfs/dbraw/zinc/42/66/57/331426657.db2.gz IULGAQLRJMDMEM-OAHLLOKOSA-N 1 0 298.386 3.606 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC(F)(F)F ZINC000468622158 331437610 /nfs/dbraw/zinc/43/76/10/331437610.db2.gz PURLBCWCYOCRJA-JXMROGBWSA-N 1 0 288.269 3.540 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccs1 ZINC000468648351 331438275 /nfs/dbraw/zinc/43/82/75/331438275.db2.gz OYLWHOVOUHPSNG-XYOKQWHBSA-N 1 0 288.372 3.849 20 5 CHBDRO CC[C@@H]([NH2+]CCC(O)(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000471788318 331520181 /nfs/dbraw/zinc/52/01/81/331520181.db2.gz PILAAEJUSSUYIO-OAHLLOKOSA-N 1 0 294.395 3.577 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]C[C@@H]1CC=CCC1 ZINC000478226779 331701033 /nfs/dbraw/zinc/70/10/33/331701033.db2.gz JBXJICTURLCTLU-GFCCVEGCSA-N 1 0 294.782 3.737 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000481165843 331799421 /nfs/dbraw/zinc/79/94/21/331799421.db2.gz ATGWJMBTPNOKDT-UONOGXRCSA-N 1 0 292.379 3.532 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482686849 331843214 /nfs/dbraw/zinc/84/32/14/331843214.db2.gz AGLNMYQXGHRNOR-UHFFFAOYSA-N 1 0 290.367 3.530 20 5 CHBDRO CCCC[C@H](COC)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000483207315 331863069 /nfs/dbraw/zinc/86/30/69/331863069.db2.gz FCZLUZZVTGVSHD-ZBFHGGJFSA-N 1 0 294.395 3.841 20 5 CHBDRO CC[C@@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000402479109 331908865 /nfs/dbraw/zinc/90/88/65/331908865.db2.gz ITVDPBKWKPPTBU-SNVBAGLBSA-N 1 0 290.285 3.663 20 5 CHBDRO CC[C@H](C)C[N@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489228745 332043782 /nfs/dbraw/zinc/04/37/82/332043782.db2.gz XAWCAEGLPCFWAU-WCQYABFASA-N 1 0 264.369 3.942 20 5 CHBDRO CCOc1cc(C[NH2+][C@@H]2CCCC2(C)C)ccc1[N+](=O)[O-] ZINC000492911585 332418334 /nfs/dbraw/zinc/41/83/34/332418334.db2.gz JITJIQIOOUTOOE-OAHLLOKOSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])oc1C ZINC000502424926 332658497 /nfs/dbraw/zinc/65/84/97/332658497.db2.gz AXUBLPFJTYDMCT-GFCCVEGCSA-N 1 0 288.347 3.698 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)C ZINC000504911192 332724475 /nfs/dbraw/zinc/72/44/75/332724475.db2.gz BVPFOPWWOXRIQT-LBPRGKRZSA-N 1 0 282.409 3.711 20 5 CHBDRO C[C@@H]1CC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000513070000 333002723 /nfs/dbraw/zinc/00/27/23/333002723.db2.gz QMIVFCBBIFDHAH-IAQYHMDHSA-N 1 0 286.331 3.743 20 5 CHBDRO CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000513655109 333029520 /nfs/dbraw/zinc/02/95/20/333029520.db2.gz LBEUXFCVPXOIAB-TUKIKUTGSA-N 1 0 262.353 3.680 20 5 CHBDRO CC(C)SCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513881121 333046185 /nfs/dbraw/zinc/04/61/85/333046185.db2.gz KHWDPHHYLAWSCA-UHFFFAOYSA-N 1 0 296.436 3.947 20 5 CHBDRO CCSCCC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000311478595 333069061 /nfs/dbraw/zinc/06/90/61/333069061.db2.gz KGFXZXLXTFJASC-GFCCVEGCSA-N 1 0 282.409 3.697 20 5 CHBDRO CCSCCC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000311478596 333069163 /nfs/dbraw/zinc/06/91/63/333069163.db2.gz KGFXZXLXTFJASC-LBPRGKRZSA-N 1 0 282.409 3.697 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1COCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000336862413 335121892 /nfs/dbraw/zinc/12/18/92/335121892.db2.gz IWZKCLRGTPLMIB-SJKOYZFVSA-N 1 0 298.342 3.517 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000186279711 333157813 /nfs/dbraw/zinc/15/78/13/333157813.db2.gz XXQRPZCEKZCFFX-NEPJUHHUSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC2(C)CCC2)cc1[N+](=O)[O-] ZINC000222211430 333177091 /nfs/dbraw/zinc/17/70/91/333177091.db2.gz RVHNNRWJICKKRN-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO CC[C@H]([NH2+]CC1(CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000222209830 333177157 /nfs/dbraw/zinc/17/71/57/333177157.db2.gz RBFAZDNOIJLDJD-AWEZNQCLSA-N 1 0 262.353 3.826 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1cccc([N+](=O)[O-])c1 ZINC000222451840 333193790 /nfs/dbraw/zinc/19/37/90/333193790.db2.gz GJEACAIXRGJABG-XHDPSFHLSA-N 1 0 288.351 3.510 20 5 CHBDRO CCC[C@H]([NH2+][C@H](C)c1cn[nH]c1)c1cccc([N+](=O)[O-])c1 ZINC000222452019 333194042 /nfs/dbraw/zinc/19/40/42/333194042.db2.gz GJEACAIXRGJABG-ABAIWWIYSA-N 1 0 288.351 3.510 20 5 CHBDRO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CCCCCC1 ZINC000195718802 333261516 /nfs/dbraw/zinc/26/15/16/333261516.db2.gz OFDGRMTWUUNKLS-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000522300614 333280791 /nfs/dbraw/zinc/28/07/91/333280791.db2.gz AITYZPZOORCPHZ-CYBMUJFWSA-N 1 0 282.409 3.914 20 5 CHBDRO CC1(C[NH2+]Cc2csc([N+](=O)[O-])c2)CCCCC1 ZINC000229588126 333306609 /nfs/dbraw/zinc/30/66/09/333306609.db2.gz DVAKNCQSSYYTEM-UHFFFAOYSA-N 1 0 268.382 3.716 20 5 CHBDRO CCCC1(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000230157715 333315379 /nfs/dbraw/zinc/31/53/79/333315379.db2.gz GWLHZZAQBFSUCY-UHFFFAOYSA-N 1 0 262.353 3.573 20 5 CHBDRO CC(C)C1CC([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000232538749 333338405 /nfs/dbraw/zinc/33/84/05/333338405.db2.gz IBKONBQFHWLXBM-XGNXJENSSA-N 1 0 262.353 3.680 20 5 CHBDRO CCC(CC)[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000523701869 333340139 /nfs/dbraw/zinc/34/01/39/333340139.db2.gz YOSINDLOLUEYOH-UHFFFAOYSA-N 1 0 276.380 3.790 20 5 CHBDRO CCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC1CC1 ZINC000523841067 333347605 /nfs/dbraw/zinc/34/76/05/333347605.db2.gz HSHLMHRDKCUHSM-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000235295066 333367255 /nfs/dbraw/zinc/36/72/55/333367255.db2.gz AETRCJZLBPWIMM-DOMZBBRYSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccccc1C1CC([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000237699903 333380739 /nfs/dbraw/zinc/38/07/39/333380739.db2.gz BDMBYNPCHTYNQN-UHFFFAOYSA-N 1 0 296.370 3.939 20 5 CHBDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000524811129 333389123 /nfs/dbraw/zinc/38/91/23/333389123.db2.gz AHTCGYFVQFODLB-CJNGLKHVSA-N 1 0 276.380 3.995 20 5 CHBDRO CCC1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000539123353 333659586 /nfs/dbraw/zinc/65/95/86/333659586.db2.gz HABMTSNSKHZXOL-OAHLLOKOSA-N 1 0 288.391 3.696 20 5 CHBDRO CC1C[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000576115807 335156527 /nfs/dbraw/zinc/15/65/27/335156527.db2.gz FUZGGEWTCXYHSI-UHFFFAOYSA-N 1 0 288.372 3.775 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000070211843 333801984 /nfs/dbraw/zinc/80/19/84/333801984.db2.gz SAOOTHOMORDINQ-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO C[C@@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])C1CCCC1 ZINC000070306628 333806772 /nfs/dbraw/zinc/80/67/72/333806772.db2.gz LBPWHYUWHHINEE-SNVBAGLBSA-N 1 0 282.771 3.917 20 5 CHBDRO CC[C@H]([NH2+]CCCCSC)c1cccc([N+](=O)[O-])c1 ZINC000131514395 333945648 /nfs/dbraw/zinc/94/56/48/333945648.db2.gz XNBILHQSTXDRFN-AWEZNQCLSA-N 1 0 282.409 3.779 20 5 CHBDRO Cc1ncsc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000132423707 333979937 /nfs/dbraw/zinc/97/99/37/333979937.db2.gz PWJPBZVFISHLHH-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCOC(C)(C)C1 ZINC000546650152 334043581 /nfs/dbraw/zinc/04/35/81/334043581.db2.gz FAXWGAHRKUAHBN-OLZOCXBDSA-N 1 0 292.379 3.511 20 5 CHBDRO CC1(c2ccccc2)CC([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000547374322 334084538 /nfs/dbraw/zinc/08/45/38/334084538.db2.gz PTCPTYRWUAISGC-UHFFFAOYSA-N 1 0 296.370 3.805 20 5 CHBDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000564324905 334101110 /nfs/dbraw/zinc/10/11/10/334101110.db2.gz JIVDRTIKERMZED-OCCSQVGLSA-N 1 0 262.353 3.666 20 5 CHBDRO CCC(CC)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000135461081 334130542 /nfs/dbraw/zinc/13/05/42/334130542.db2.gz CNRUNNWGNSMSQF-NSHDSACASA-N 1 0 250.342 3.682 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCC(C)(C)O1 ZINC000547980613 334133239 /nfs/dbraw/zinc/13/32/39/334133239.db2.gz AUFKRYWJJHATJZ-JSGCOSHPSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCC[C@H](C3CC3)C2)cc1 ZINC000081635449 334201225 /nfs/dbraw/zinc/20/12/25/334201225.db2.gz MINATVPSTSFKKV-GJZGRUSLSA-N 1 0 274.364 3.653 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCC[C@H](C3CC3)C2)cc1 ZINC000081637093 334201388 /nfs/dbraw/zinc/20/13/88/334201388.db2.gz QZCVCWNNVLODHL-HOTGVXAUSA-N 1 0 288.391 3.696 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCC[C@@H](C2CC2)C1 ZINC000081638251 334201527 /nfs/dbraw/zinc/20/15/27/334201527.db2.gz BDBXVWQFIOGXBO-HIFRSBDPSA-N 1 0 274.364 3.653 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000247333965 334279327 /nfs/dbraw/zinc/27/93/27/334279327.db2.gz PZPARNVOTDXTTD-QGZVFWFLSA-N 1 0 296.370 3.802 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1CC2CCC1CC2 ZINC000552083808 334287020 /nfs/dbraw/zinc/28/70/20/334287020.db2.gz YZIUKKGGDOCMQN-GEVLFHQSSA-N 1 0 286.375 3.776 20 5 CHBDRO CS[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000248153262 334295929 /nfs/dbraw/zinc/29/59/29/334295929.db2.gz RAVNQYCWZBZNPY-OSAQELSMSA-N 1 0 294.420 3.920 20 5 CHBDRO CCC[C@@H]([NH2+][C@H](COC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000086695569 334315068 /nfs/dbraw/zinc/31/50/68/334315068.db2.gz OMCBUVRUDJFGHL-HZPDHXFCSA-N 1 0 294.395 3.697 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000552323677 334317003 /nfs/dbraw/zinc/31/70/03/334317003.db2.gz OQOPALRJXUZZDF-ONERCXAPSA-N 1 0 274.364 3.705 20 5 CHBDRO C[C@H]([NH2+]CC1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000552898766 334350126 /nfs/dbraw/zinc/35/01/26/334350126.db2.gz CPTPHBBVKPJCEQ-ZDUSSCGKSA-N 1 0 296.370 3.660 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000555702937 334487446 /nfs/dbraw/zinc/48/74/46/334487446.db2.gz NEDCAPWVRNZHQG-VXGBXAGGSA-N 1 0 298.333 3.989 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000576392593 335197582 /nfs/dbraw/zinc/19/75/82/335197582.db2.gz SCUTUDVEYGPBDG-ZVVFDCPKSA-N 1 0 298.386 3.873 20 5 CHBDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)(C)C ZINC000580673506 335320492 /nfs/dbraw/zinc/32/04/92/335320492.db2.gz WXCSDABNEVCBMU-LLVKDONJSA-N 1 0 289.379 3.643 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CC3CCC2CC3)cccc1[N+](=O)[O-] ZINC000380718501 336020016 /nfs/dbraw/zinc/02/00/16/336020016.db2.gz JBJWWDJXIQOWFA-PIMMBPRGSA-N 1 0 274.364 3.572 20 5 CHBDRO C[C@H](CC(C)(C)C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000384485939 336124874 /nfs/dbraw/zinc/12/48/74/336124874.db2.gz IJTIBIDTZVSFCQ-GFCCVEGCSA-N 1 0 264.369 3.552 20 5 CHBDRO Cc1cccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000385749602 336155526 /nfs/dbraw/zinc/15/55/26/336155526.db2.gz OBRFIWZYCIDGMM-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@H](CCC(C)(C)C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000386061100 336165524 /nfs/dbraw/zinc/16/55/24/336165524.db2.gz XHPLLQSTJWXAHF-CYBMUJFWSA-N 1 0 278.396 3.942 20 5 CHBDRO Cc1ccccc1C[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000386399259 336172437 /nfs/dbraw/zinc/17/24/37/336172437.db2.gz VLYRKAXVUDKJAG-HNNXBMFYSA-N 1 0 298.386 3.932 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000387189699 336187646 /nfs/dbraw/zinc/18/76/46/336187646.db2.gz WFFZHIIMXKJSHC-RISCZKNCSA-N 1 0 260.337 3.578 20 5 CHBDRO CC(C)C1([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000340478370 519556986 /nfs/dbraw/zinc/55/69/86/519556986.db2.gz JQGKGMPXPCOTEK-OAHLLOKOSA-N 1 0 274.364 3.750 20 5 CHBDRO CCC[C@@H]([NH2+]CCCCOCC)c1cccc([N+](=O)[O-])c1 ZINC000268871237 520774056 /nfs/dbraw/zinc/77/40/56/520774056.db2.gz OYKARVZDNRORDY-MRXNPFEDSA-N 1 0 294.395 3.842 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000222760617 521173897 /nfs/dbraw/zinc/17/38/97/521173897.db2.gz HQONWEZNRXQCCG-BJJXKVORSA-N 1 0 292.379 3.593 20 5 CHBDRO COC1(C[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000277104427 522641752 /nfs/dbraw/zinc/64/17/52/522641752.db2.gz LXDUAHXAFLMXEK-QWHCGFSZSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000094773649 522653253 /nfs/dbraw/zinc/65/32/53/522653253.db2.gz ZLGDGRKPJXSDIE-HNNXBMFYSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000094773650 522876841 /nfs/dbraw/zinc/87/68/41/522876841.db2.gz ZLGDGRKPJXSDIE-OAHLLOKOSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000130115993 523122505 /nfs/dbraw/zinc/12/25/05/523122505.db2.gz RBZOTPQSRGRLCQ-INIZCTEOSA-N 1 0 285.347 3.573 20 5 CHBDRO Cc1ccnc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000285975217 525712032 /nfs/dbraw/zinc/71/20/32/525712032.db2.gz HJGHYRXNSFKUJA-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO CS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000219208419 525832609 /nfs/dbraw/zinc/83/26/09/525832609.db2.gz YRMWAIWOEKDXGC-NJZAAPMLSA-N 1 0 294.420 3.920 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@]2(C)CCCS2)cccc1[N+](=O)[O-] ZINC000120443954 525896095 /nfs/dbraw/zinc/89/60/95/525896095.db2.gz RKPIEPPSTSTOHP-IUODEOHRSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000281139709 525897066 /nfs/dbraw/zinc/89/70/66/525897066.db2.gz ODTOAALLHPGQIV-NEPJUHHUSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000124309008 525900614 /nfs/dbraw/zinc/90/06/14/525900614.db2.gz IDXDYSLSIJXRDP-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000156728806 525934416 /nfs/dbraw/zinc/93/44/16/525934416.db2.gz FEHVGBPRKHXJJV-YDHLFZDLSA-N 1 0 292.379 3.511 20 5 CHBDRO CC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000344711870 527981524 /nfs/dbraw/zinc/98/15/24/527981524.db2.gz UFOOUWLUYVBBMN-UHFFFAOYSA-N 1 0 286.331 3.745 20 5 CHBDRO CCC(CC)[C@@H](CC[NH2+]Cc1ccc([N+](=O)[O-])cc1)OC ZINC000344852978 528817804 /nfs/dbraw/zinc/81/78/04/528817804.db2.gz LNDUYNRHRPEKRS-MRXNPFEDSA-N 1 0 294.395 3.526 20 5 CHBDRO CCC(CC)[C@H](CC[NH2+]Cc1ccccc1[N+](=O)[O-])OC ZINC000344834813 528851949 /nfs/dbraw/zinc/85/19/49/528851949.db2.gz ZXHUMYJIHDTWLR-INIZCTEOSA-N 1 0 294.395 3.526 20 5 CHBDRO CC(C)[N@H+](Cc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000068449060 1118988843 /nfs/dbraw/zinc/98/88/43/1118988843.db2.gz UPWGIVIFZDZUDF-UHFFFAOYSA-N 1 0 262.353 3.748 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cccs2)c1 ZINC000035081387 1123495319 /nfs/dbraw/zinc/49/53/19/1123495319.db2.gz ZAKKZIMUHHAOEW-UHFFFAOYSA-N 1 0 282.752 3.600 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000129899767 1125353191 /nfs/dbraw/zinc/35/31/91/1125353191.db2.gz XYTQUJPSKNBSPV-RYUDHWBXSA-N 1 0 262.353 3.600 20 5 CHBDRO Cc1ccc2cc(O[C@@H](C)C[N+](C)(C)C)ccc2c1 ZINC001228738947 1131946110 /nfs/dbraw/zinc/94/61/10/1131946110.db2.gz UJURALRKSNMSGK-AWEZNQCLSA-N 1 0 258.385 3.622 20 5 CHBDRO Cc1cc(OC(C)C)cc(C)c1COCCC[N+](C)(C)C ZINC001224621275 1135462513 /nfs/dbraw/zinc/46/25/13/1135462513.db2.gz PZJCDROTXMCYKJ-UHFFFAOYSA-N 1 0 294.459 3.704 20 5 CHBDRO CCC[C@@H]([NH2+][C@H](C)CC(C)(C)O)c1cccc([N+](=O)[O-])c1 ZINC000296325546 1125511162 /nfs/dbraw/zinc/51/11/62/1125511162.db2.gz GZNGHEDQVRBNCA-IUODEOHRSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1ccccc1[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C1CC1 ZINC000886114318 1125651678 /nfs/dbraw/zinc/65/16/78/1125651678.db2.gz MOSRIXJPQYWNQA-INIZCTEOSA-N 1 0 297.358 3.539 20 5 CHBDRO Cc1cccc([C@H]([NH2+]Cc2cccnc2[N+](=O)[O-])C(C)C)c1 ZINC000886300960 1125667582 /nfs/dbraw/zinc/66/75/82/1125667582.db2.gz SMRZTOYRNWFSKP-MRXNPFEDSA-N 1 0 299.374 3.785 20 5 CHBDRO C[C@H]([NH2+]C1(C2CC2)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000886825589 1125721205 /nfs/dbraw/zinc/72/12/05/1125721205.db2.gz XWBAHSFEFJKQCH-NSHDSACASA-N 1 0 260.337 3.578 20 5 CHBDRO COc1cc(C[N@H+](C)[C@H]2CCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000483095375 1126767786 /nfs/dbraw/zinc/76/77/86/1126767786.db2.gz AKFLKSJGNANRIT-ZDUSSCGKSA-N 1 0 292.379 3.614 20 5 CHBDRO CC1=C(C)C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000483366362 1126783481 /nfs/dbraw/zinc/78/34/81/1126783481.db2.gz IZAMHMAILJEVKE-CYBMUJFWSA-N 1 0 260.337 3.698 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(F)F)CC1 ZINC000483513119 1126790492 /nfs/dbraw/zinc/79/04/92/1126790492.db2.gz BIXZVWWSOMUJNP-JTQLQIEISA-N 1 0 284.306 3.633 20 5 CHBDRO CC[C@H]([NH2+]CCCc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000181497545 1126856941 /nfs/dbraw/zinc/85/69/41/1126856941.db2.gz SFBVEZTXUVAAHT-KRWDZBQOSA-N 1 0 299.374 3.663 20 5 CHBDRO CCCC[N@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485709494 1126944023 /nfs/dbraw/zinc/94/40/23/1126944023.db2.gz PPVARWBKSHRHFC-LBPRGKRZSA-N 1 0 250.342 3.696 20 5 CHBDRO CCCC[N@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485709493 1126944302 /nfs/dbraw/zinc/94/43/02/1126944302.db2.gz PPVARWBKSHRHFC-GFCCVEGCSA-N 1 0 250.342 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H](C)C1 ZINC000485765823 1126951102 /nfs/dbraw/zinc/95/11/02/1126951102.db2.gz MCBOCMFUXDBOEA-YPMHNXCESA-N 1 0 262.353 3.696 20 5 CHBDRO CC(C)CCC[C@H](C)CCO[C@@H](C)C[N+](C)(C)C ZINC001224771809 1126984675 /nfs/dbraw/zinc/98/46/75/1126984675.db2.gz SABMXUYFAZFFEB-HOTGVXAUSA-N 1 0 258.470 3.950 20 5 CHBDRO CCCC[C@@H](OCC[N+](C)(C)C)C1CCCCC1 ZINC001224776013 1126993015 /nfs/dbraw/zinc/99/30/15/1126993015.db2.gz RGBNKVDFPFWXIZ-MRXNPFEDSA-N 1 0 256.454 3.848 20 5 CHBDRO CC[C@H]([NH2+]C/C=C\c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000487266152 1127027443 /nfs/dbraw/zinc/02/74/43/1127027443.db2.gz IMKNGVQUXUGKPX-CHYADLBTSA-N 1 0 297.358 3.744 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2sccc2Cl)c1 ZINC000487570925 1127036846 /nfs/dbraw/zinc/03/68/46/1127036846.db2.gz IWBNESNPYOKFSC-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000323742414 1127049345 /nfs/dbraw/zinc/04/93/45/1127049345.db2.gz QKJGUEUALINPTA-GFCCVEGCSA-N 1 0 268.744 3.526 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000042814588 1127076781 /nfs/dbraw/zinc/07/67/81/1127076781.db2.gz FTTYANXRPQTOMD-HOTGVXAUSA-N 1 0 292.379 3.595 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CC[C@H]2C2CC2)c1 ZINC000797905813 1131014552 /nfs/dbraw/zinc/01/45/52/1131014552.db2.gz PTSQKPPOHHVLLL-JSGCOSHPSA-N 1 0 280.755 3.526 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2c3ccccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000111410773 1127126402 /nfs/dbraw/zinc/12/64/02/1127126402.db2.gz JQAZSFGBUJZAKC-SCLBCKFNSA-N 1 0 296.370 3.926 20 5 CHBDRO CCC[C@@H](N[C@H](C)c1ccon1)c1cccc([N+](=O)[O-])c1 ZINC000349832914 1127164098 /nfs/dbraw/zinc/16/40/98/1127164098.db2.gz KDNURFWQJZHECT-IAQYHMDHSA-N 1 0 289.335 3.775 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000572780344 1127226387 /nfs/dbraw/zinc/22/63/87/1127226387.db2.gz HUENQAGAWRSYEL-MFKMUULPSA-N 1 0 296.317 3.607 20 5 CHBDRO CC1(C)C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000590204419 1127251290 /nfs/dbraw/zinc/25/12/90/1127251290.db2.gz IEXOXACGTIRLIE-SWLSCSKDSA-N 1 0 292.354 3.744 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000224276775 1127256189 /nfs/dbraw/zinc/25/61/89/1127256189.db2.gz CKTSNSINEHMNDS-FPMFFAJLSA-N 1 0 294.420 3.838 20 5 CHBDRO CC/C=C\CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000466813191 1127269702 /nfs/dbraw/zinc/26/97/02/1127269702.db2.gz OXZMPPLQIZKADO-ARJAWSKDSA-N 1 0 274.364 3.916 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)C2CCSCC2)cccc1[N+](=O)[O-] ZINC000355182525 1127323070 /nfs/dbraw/zinc/32/30/70/1127323070.db2.gz VFYVNBMXVSJFMV-LBPRGKRZSA-N 1 0 294.420 3.525 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C(C)C)C1CC1 ZINC000355257496 1127329160 /nfs/dbraw/zinc/32/91/60/1127329160.db2.gz VPVHJDHQQUKQAE-UHFFFAOYSA-N 1 0 292.379 3.755 20 5 CHBDRO CC[C@@H]([NH2+]CC1=CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000592099876 1127333121 /nfs/dbraw/zinc/33/31/21/1127333121.db2.gz VYOAZSDYGVVDGH-OAHLLOKOSA-N 1 0 260.337 3.746 20 5 CHBDRO CC(C)O[C@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000593055945 1127369715 /nfs/dbraw/zinc/36/97/15/1127369715.db2.gz VJEZYAFWMFJDEL-CJNGLKHVSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H]([NH2+][C@H]1C[C@@H](OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000592398753 1127372695 /nfs/dbraw/zinc/37/26/95/1127372695.db2.gz SQVMXNDGRYLBFK-CORIIIEPSA-N 1 0 292.379 3.592 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCCCC3)o2)cc1 ZINC000226274498 1127388252 /nfs/dbraw/zinc/38/82/52/1127388252.db2.gz BLKPUVMRRQRKDF-UHFFFAOYSA-N 1 0 286.331 3.841 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccsc1 ZINC000594504374 1127418823 /nfs/dbraw/zinc/41/88/23/1127418823.db2.gz OAPQENSOCVNNGI-YGRLFVJLSA-N 1 0 288.372 3.994 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CC1CCC(F)CC1 ZINC000594507756 1127418862 /nfs/dbraw/zinc/41/88/62/1127418862.db2.gz QWMOUUSUTKLEKQ-KOHJWAIASA-N 1 0 292.354 3.700 20 5 CHBDRO CCC1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000226783942 1127425521 /nfs/dbraw/zinc/42/55/21/1127425521.db2.gz VBYFSNVYQAWJBX-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCSCC1)c1ccccc1[N+](=O)[O-] ZINC000595024824 1127443328 /nfs/dbraw/zinc/44/33/28/1127443328.db2.gz CCXAXFIHXLQUBV-NEPJUHHUSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C1CC1)C1CC1 ZINC000594992632 1127444287 /nfs/dbraw/zinc/44/42/87/1127444287.db2.gz HWZZVXYDKXFJRH-UHFFFAOYSA-N 1 0 274.364 3.572 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1=CCCC1 ZINC000594988649 1127444320 /nfs/dbraw/zinc/44/43/20/1127444320.db2.gz AOXGYDOBCLRUCU-LCYFTJDESA-N 1 0 272.348 3.698 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000595005184 1127444898 /nfs/dbraw/zinc/44/48/98/1127444898.db2.gz DSFGGWPPATXPTO-YPMHNXCESA-N 1 0 280.393 3.531 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H](C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000595049828 1127451187 /nfs/dbraw/zinc/45/11/87/1127451187.db2.gz PHDRIJIBWVIFFE-CJNGLKHVSA-N 1 0 299.374 3.834 20 5 CHBDRO C[C@@]1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1(F)F ZINC000595082757 1127453648 /nfs/dbraw/zinc/45/36/48/1127453648.db2.gz XCGNVGWCIMPEQC-KGLIPLIRSA-N 1 0 296.317 3.607 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000595079103 1127453769 /nfs/dbraw/zinc/45/37/69/1127453769.db2.gz CVWHLXXWLMHQOH-RISCZKNCSA-N 1 0 298.333 3.989 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000595093887 1127454558 /nfs/dbraw/zinc/45/45/58/1127454558.db2.gz PTFQHGBLAGMESF-JOYOIKCWSA-N 1 0 284.306 3.537 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+](C1CC1)C1CCCC1 ZINC000595311998 1127459794 /nfs/dbraw/zinc/45/97/94/1127459794.db2.gz KFMFSKRMQALXCX-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000595411054 1127461501 /nfs/dbraw/zinc/46/15/01/1127461501.db2.gz NFUXUQFOMLJWNK-OAHLLOKOSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000595411052 1127461588 /nfs/dbraw/zinc/46/15/88/1127461588.db2.gz NFUXUQFOMLJWNK-HNNXBMFYSA-N 1 0 288.322 3.975 20 5 CHBDRO C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000595425138 1127462352 /nfs/dbraw/zinc/46/23/52/1127462352.db2.gz JYSAOMNXDQXOOK-GFCCVEGCSA-N 1 0 278.327 3.522 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC(F)(F)C1 ZINC000293668626 1127511937 /nfs/dbraw/zinc/51/19/37/1127511937.db2.gz MKDJFQQPFPMAFO-LLVKDONJSA-N 1 0 298.333 3.551 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000596650703 1127514991 /nfs/dbraw/zinc/51/49/91/1127514991.db2.gz KEFNRRGBCXFKBF-GTNSWQLSSA-N 1 0 297.358 3.515 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccoc2)cc1[N+](=O)[O-] ZINC000361918857 1127598660 /nfs/dbraw/zinc/59/86/60/1127598660.db2.gz LZFIUMRLZMAALL-CHWSQXEVSA-N 1 0 288.347 3.778 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1C[C@H]1C1CC1 ZINC000598954694 1127647977 /nfs/dbraw/zinc/64/79/77/1127647977.db2.gz FCKFHYGUVLMAAL-OJXGSEEGSA-N 1 0 274.364 3.680 20 5 CHBDRO CC(C)C[C@@H](CNc1ccc(Cl)cc1[N+](=O)[O-])[NH+](C)C ZINC000603465702 1127652329 /nfs/dbraw/zinc/65/23/29/1127652329.db2.gz KDTNALANYJBLEO-LBPRGKRZSA-N 1 0 299.802 3.636 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1CC=CC1)CCC2 ZINC000599063607 1127654752 /nfs/dbraw/zinc/65/47/52/1127654752.db2.gz DTVILQYAFXVXOV-INIZCTEOSA-N 1 0 272.348 3.528 20 5 CHBDRO Cc1c(C[N@@H+]2CCCC(F)(F)CC2)cccc1[N+](=O)[O-] ZINC000599551260 1127679421 /nfs/dbraw/zinc/67/94/21/1127679421.db2.gz KBYWINSNFVQVBF-UHFFFAOYSA-N 1 0 284.306 3.524 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC(F)(F)CC1 ZINC000599552064 1127679734 /nfs/dbraw/zinc/67/97/34/1127679734.db2.gz UTXQJNCUNWKCDB-LLVKDONJSA-N 1 0 284.306 3.777 20 5 CHBDRO C[C@H]1CCC[C@@H]([N@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000603873873 1127679882 /nfs/dbraw/zinc/67/98/82/1127679882.db2.gz JAXMJRSVWSNIIP-XJKSGUPXSA-N 1 0 276.380 3.648 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC3(CC3)CC2)c(F)c1 ZINC000599673849 1127686786 /nfs/dbraw/zinc/68/67/86/1127686786.db2.gz ZUNYNPOWPXEVGA-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO Cc1noc(C[N@@H+](C)C[C@H](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000599633289 1127684270 /nfs/dbraw/zinc/68/42/70/1127684270.db2.gz PLTXSQLBNIMWRC-NSHDSACASA-N 1 0 295.383 3.539 20 5 CHBDRO CC(F)(F)CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000297220034 1127691529 /nfs/dbraw/zinc/69/15/29/1127691529.db2.gz HENCQVKJHSGVNY-ZDUSSCGKSA-N 1 0 298.333 3.551 20 5 CHBDRO CC[N@H+](Cc1csc([N+](=O)[O-])c1)C1CC(C)(C)C1 ZINC000412038452 1127893548 /nfs/dbraw/zinc/89/35/48/1127893548.db2.gz OTZCVKPTDXSFBI-UHFFFAOYSA-N 1 0 268.382 3.667 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2(c3cccc(F)c3)CC2)c1 ZINC000152866704 1127934755 /nfs/dbraw/zinc/93/47/55/1127934755.db2.gz DRLFWERLMGSJBV-UHFFFAOYSA-N 1 0 286.306 3.513 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC1CC1 ZINC000540174723 1127965504 /nfs/dbraw/zinc/96/55/04/1127965504.db2.gz WBVIARFTKNIIID-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO C[C@H](C[NH2+]CCc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000468009122 1127987263 /nfs/dbraw/zinc/98/72/63/1127987263.db2.gz IULGAQLRJMDMEM-HNNXBMFYSA-N 1 0 298.386 3.606 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540917839 1128001934 /nfs/dbraw/zinc/00/19/34/1128001934.db2.gz GWLNLROWSHKZHT-RISCZKNCSA-N 1 0 296.798 3.959 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCC(C)(C)C1 ZINC000468392200 1128005314 /nfs/dbraw/zinc/00/53/14/1128005314.db2.gz JVDDAVFURBTCHA-AWEZNQCLSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@H](CC1CCCC1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000468443923 1128008305 /nfs/dbraw/zinc/00/83/05/1128008305.db2.gz HOJRJCATZLVKDZ-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@H]2CCCC[C@H]12 ZINC000541108999 1128008969 /nfs/dbraw/zinc/00/89/69/1128008969.db2.gz FUAOUBMWBDYHRF-XFJVYGCCSA-N 1 0 292.354 3.744 20 5 CHBDRO Cc1c(C[N@H+](C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000541318383 1128018416 /nfs/dbraw/zinc/01/84/16/1128018416.db2.gz JPNFNGINYHWYJC-AWEZNQCLSA-N 1 0 274.364 3.691 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000541553683 1128027852 /nfs/dbraw/zinc/02/78/52/1128027852.db2.gz SRLLOJUMYOZPDA-QARUFBMTSA-N 1 0 286.375 3.896 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C)[C@@H]1C ZINC000541770472 1128038582 /nfs/dbraw/zinc/03/85/82/1128038582.db2.gz FDVKOJSTSDDTCB-YPMHNXCESA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000542049194 1128049607 /nfs/dbraw/zinc/04/96/07/1128049607.db2.gz VXCOUYCRGUQXOD-INWMFGNUSA-N 1 0 274.364 3.605 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC000542049195 1128049345 /nfs/dbraw/zinc/04/93/45/1128049345.db2.gz VXCOUYCRGUQXOD-IVMMDQJWSA-N 1 0 274.364 3.605 20 5 CHBDRO Cc1c(C[NH+]2[C@H](C)CCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000609157437 1128099023 /nfs/dbraw/zinc/09/90/23/1128099023.db2.gz OVSNFMIKUPJWHI-VXGBXAGGSA-N 1 0 262.353 3.666 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC=C(C)CC1 ZINC000492784151 1128112846 /nfs/dbraw/zinc/11/28/46/1128112846.db2.gz OMBNNKYGOQDDMY-ZDUSSCGKSA-N 1 0 260.337 3.616 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(CF)cc1)c1cccc([N+](=O)[O-])c1 ZINC000777724036 1128254672 /nfs/dbraw/zinc/25/46/72/1128254672.db2.gz LOFAGOARBHAZRY-GFCCVEGCSA-N 1 0 288.322 3.915 20 5 CHBDRO CC[C@@H](C[C@@](C)(O)CC)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000926893193 1128200492 /nfs/dbraw/zinc/20/04/92/1128200492.db2.gz QTZPEUOMVSHDPM-INWMFGNUSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1cccc([N+](=O)[O-])c1NC1CC[NH+](C(C)(C)C)CC1 ZINC000301180204 1128446169 /nfs/dbraw/zinc/44/61/69/1128446169.db2.gz MVPOGOKFSPKSGS-UHFFFAOYSA-N 1 0 291.395 3.578 20 5 CHBDRO Cc1c(C[N@H+](C)CCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000917053786 1128470154 /nfs/dbraw/zinc/47/01/54/1128470154.db2.gz HCRRBVJSIQRYAT-UHFFFAOYSA-N 1 0 298.386 3.968 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000564081516 1128492098 /nfs/dbraw/zinc/49/20/98/1128492098.db2.gz WOFLUAGZGPDZFJ-DZGCQCFKSA-N 1 0 297.358 3.540 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000564081517 1128492231 /nfs/dbraw/zinc/49/22/31/1128492231.db2.gz WOFLUAGZGPDZFJ-HIFRSBDPSA-N 1 0 297.358 3.540 20 5 CHBDRO CCC(CC)[N@H+](CC)CCc1ccc([N+](=O)[O-])cc1 ZINC000564608206 1128512829 /nfs/dbraw/zinc/51/28/29/1128512829.db2.gz DUQUETOYQUMQLW-UHFFFAOYSA-N 1 0 264.369 3.648 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1ccc([N+](=O)[O-])cc1OC ZINC000569965303 1128612922 /nfs/dbraw/zinc/61/29/22/1128612922.db2.gz RNEBKLPOQAKHOF-UHFFFAOYSA-N 1 0 280.368 3.614 20 5 CHBDRO CCC(C)(C)[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000570917155 1128634522 /nfs/dbraw/zinc/63/45/22/1128634522.db2.gz ZHAOOLSUJVVDAS-NSHDSACASA-N 1 0 250.342 3.509 20 5 CHBDRO CC(C)[NH+](Cc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000778958250 1128671452 /nfs/dbraw/zinc/67/14/52/1128671452.db2.gz KQUZJBOCKRFLCU-UHFFFAOYSA-N 1 0 270.760 3.867 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(C)ccn1 ZINC000601268438 1128707185 /nfs/dbraw/zinc/70/71/85/1128707185.db2.gz QESZBUCMKGWZQJ-MRXNPFEDSA-N 1 0 299.374 3.929 20 5 CHBDRO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC(C)(C)C ZINC000609705051 1128722718 /nfs/dbraw/zinc/72/27/18/1128722718.db2.gz LJYGTLJVOCBZLC-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609766747 1128725725 /nfs/dbraw/zinc/72/57/25/1128725725.db2.gz MSMSSJXQGAEQKW-ZDUSSCGKSA-N 1 0 262.353 3.607 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609846146 1128728174 /nfs/dbraw/zinc/72/81/74/1128728174.db2.gz HSTXBMTUANMIFS-JMSVASOKSA-N 1 0 292.354 3.887 20 5 CHBDRO Cc1ccc(C[C@H](C)[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000610003513 1128734052 /nfs/dbraw/zinc/73/40/52/1128734052.db2.gz GFXRRMUSQIGOIN-HNNXBMFYSA-N 1 0 298.386 3.966 20 5 CHBDRO CC(C)CC[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000072579058 1117769493 /nfs/dbraw/zinc/76/94/93/1117769493.db2.gz YWGMHBHCPDOTAA-LBPRGKRZSA-N 1 0 250.342 3.634 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610080168 1128738072 /nfs/dbraw/zinc/73/80/72/1128738072.db2.gz LDHCNPBHPNEJJF-CQSZACIVSA-N 1 0 292.379 3.628 20 5 CHBDRO Cc1ccc([C@H](C)C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000237556216 1128741295 /nfs/dbraw/zinc/74/12/95/1128741295.db2.gz FNAIVBHNXCPQJD-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610215376 1117881762 /nfs/dbraw/zinc/88/17/62/1117881762.db2.gz JIPDYLPUUDZLAQ-QWHCGFSZSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215365 1117882641 /nfs/dbraw/zinc/88/26/41/1117882641.db2.gz HJLWBGMZXAOIMM-ZIAGYGMSSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000359877458 1118008009 /nfs/dbraw/zinc/00/80/09/1118008009.db2.gz PWTGDFWOYHFRJA-DYVFJYSZSA-N 1 0 297.358 3.573 20 5 CHBDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000599001971 1118174394 /nfs/dbraw/zinc/17/43/94/1118174394.db2.gz ZVEQIIGTYGYQRA-UHFFFAOYSA-N 1 0 292.351 3.817 20 5 CHBDRO Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000084439790 1118356176 /nfs/dbraw/zinc/35/61/76/1118356176.db2.gz OHZUVWCZIGJDEL-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO CC[C@H](C)C[N@H+](CC)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083243352 1118368310 /nfs/dbraw/zinc/36/83/10/1118368310.db2.gz OCANCBWFLPELBC-NSHDSACASA-N 1 0 291.351 3.604 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602651884 1118553034 /nfs/dbraw/zinc/55/30/34/1118553034.db2.gz AEVDWYOWZAOVHF-KCJUWKMLSA-N 1 0 288.269 3.502 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCCCOC(C)C)cccc1[N+](=O)[O-] ZINC000180452868 1128793702 /nfs/dbraw/zinc/79/37/02/1128793702.db2.gz LOWSGFYOSCQNNQ-CQSZACIVSA-N 1 0 294.395 3.759 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1ccc([N+](=O)[O-])s1 ZINC000610908680 1118725959 /nfs/dbraw/zinc/72/59/59/1118725959.db2.gz QEGXXSCPXQLIJA-NSHDSACASA-N 1 0 285.413 3.579 20 5 CHBDRO CC[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000178345047 1118790052 /nfs/dbraw/zinc/79/00/52/1118790052.db2.gz JNKZPJQKKMUROW-JTQLQIEISA-N 1 0 276.361 3.994 20 5 CHBDRO CCCCC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000610796479 1118872206 /nfs/dbraw/zinc/87/22/06/1118872206.db2.gz YQVFOGZWFGECEI-GFCCVEGCSA-N 1 0 250.342 3.744 20 5 CHBDRO Cc1occc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000610805241 1118894200 /nfs/dbraw/zinc/89/42/00/1118894200.db2.gz HIPUABZMDMYGOF-LLVKDONJSA-N 1 0 274.320 3.655 20 5 CHBDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000610811053 1118894699 /nfs/dbraw/zinc/89/46/99/1118894699.db2.gz BBQKWVSSDUJHKV-SFHVURJKSA-N 1 0 296.370 3.723 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)c1ccncc1 ZINC000610830962 1118898625 /nfs/dbraw/zinc/89/86/25/1118898625.db2.gz PBYZFOIYDOBOCA-KGLIPLIRSA-N 1 0 299.374 3.753 20 5 CHBDRO CC(C)[C@H](C)[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000071969848 1118990506 /nfs/dbraw/zinc/99/05/06/1118990506.db2.gz TXVVDROYSJPCIP-ZDUSSCGKSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000084988313 1119016043 /nfs/dbraw/zinc/01/60/43/1119016043.db2.gz YOEAELYWXYIKPF-DYEKYZERSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000050343586 1119115663 /nfs/dbraw/zinc/11/56/63/1119115663.db2.gz CCLMRBXEGULJML-SNVBAGLBSA-N 1 0 262.334 3.507 20 5 CHBDRO Cc1cc(F)ccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000050576856 1119139869 /nfs/dbraw/zinc/13/98/69/1119139869.db2.gz QWSOGFLQPOJSGY-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000611802036 1119196048 /nfs/dbraw/zinc/19/60/48/1119196048.db2.gz GDUASRAUCDUJMM-XUJVJEKNSA-N 1 0 292.354 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccco3)o2)cc1 ZINC000033553688 1119207732 /nfs/dbraw/zinc/20/77/32/1119207732.db2.gz OFVRVZKXWFZMPE-UHFFFAOYSA-N 1 0 298.298 3.738 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCCC1(C)C ZINC000094325755 1128840237 /nfs/dbraw/zinc/84/02/37/1128840237.db2.gz UQAVGJVKDMTDJK-OAHLLOKOSA-N 1 0 292.379 3.662 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000583588048 1119381272 /nfs/dbraw/zinc/38/12/72/1119381272.db2.gz NATHSXPZTCOEQS-UHFFFAOYSA-N 1 0 280.368 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC(C)=C[C@H](C)C1 ZINC000430265392 1119384334 /nfs/dbraw/zinc/38/43/34/1119384334.db2.gz DSFAAZINVCMNGW-SMDDNHRTSA-N 1 0 274.364 3.862 20 5 CHBDRO CC1(C)CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000168138698 1119420411 /nfs/dbraw/zinc/42/04/11/1119420411.db2.gz SBQPAXVDYMMLRM-LLVKDONJSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccco1)C(C)C ZINC000350021406 1119494266 /nfs/dbraw/zinc/49/42/66/1119494266.db2.gz WSHJILOUVZRCBE-UHFFFAOYSA-N 1 0 288.347 3.907 20 5 CHBDRO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000179136769 1119597645 /nfs/dbraw/zinc/59/76/45/1119597645.db2.gz MGKXVVGQVSFTGD-NXEZZACHSA-N 1 0 291.376 3.772 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](C1CC1)[C@H]1C=CCCC1 ZINC000179242466 1119624403 /nfs/dbraw/zinc/62/44/03/1119624403.db2.gz DRNKSTSMMWDOGR-AWEZNQCLSA-N 1 0 272.348 3.668 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CC=C(C)C)cc1[N+](=O)[O-] ZINC000188450655 1119749503 /nfs/dbraw/zinc/74/95/03/1119749503.db2.gz ZSADVHAPZIWAJG-LBPRGKRZSA-N 1 0 278.352 3.610 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2F)cc1[N+](=O)[O-] ZINC000414296443 1119970599 /nfs/dbraw/zinc/97/05/99/1119970599.db2.gz XVUOTQFUMFLHIM-IACUBPJLSA-N 1 0 280.343 3.835 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000181261797 1120032341 /nfs/dbraw/zinc/03/23/41/1120032341.db2.gz HFTHKJWRDQXXQV-FZMZJTMJSA-N 1 0 292.379 3.592 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]C2CC(C(F)F)C2)cc1 ZINC000613559540 1120055732 /nfs/dbraw/zinc/05/57/32/1120055732.db2.gz XVIZIFDSYHYXLO-UHFFFAOYSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(NC2CC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC000301565273 1120102161 /nfs/dbraw/zinc/10/21/61/1120102161.db2.gz LZQOVEHMBMEGRL-UHFFFAOYSA-N 1 0 291.395 3.624 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CC(C)C)C1CC1 ZINC000542702476 1120123160 /nfs/dbraw/zinc/12/31/60/1120123160.db2.gz HSTZKMWCHZIBPA-UHFFFAOYSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)C(C)(C)C ZINC000542703551 1120124101 /nfs/dbraw/zinc/12/41/01/1120124101.db2.gz QKAUCBLUZSTWCQ-LBPRGKRZSA-N 1 0 264.369 3.770 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCC2(C)C)cccc1[N+](=O)[O-] ZINC000554375028 1120158702 /nfs/dbraw/zinc/15/87/02/1120158702.db2.gz GDWRJUAMAONILJ-RISCZKNCSA-N 1 0 262.353 3.742 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CCC3)CC2)c(F)c1 ZINC000308736074 1120197479 /nfs/dbraw/zinc/19/74/79/1120197479.db2.gz JAMAGPHHHXJWIJ-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCC(F)(F)C1 ZINC000312058093 1120280142 /nfs/dbraw/zinc/28/01/42/1120280142.db2.gz BEZCPTBDFVKPRY-JTQLQIEISA-N 1 0 290.697 3.526 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(C)c(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000313944118 1120418182 /nfs/dbraw/zinc/41/81/82/1120418182.db2.gz OWSLLDRPINNPMC-QGZVFWFLSA-N 1 0 299.374 3.848 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000692682393 1120437349 /nfs/dbraw/zinc/43/73/49/1120437349.db2.gz YBBBTAWZGOKHIZ-SNVBAGLBSA-N 1 0 294.351 3.955 20 5 CHBDRO CC[C@H](N[C@@H](C)c1nccs1)c1cccc([N+](=O)[O-])c1 ZINC000080268459 1120464240 /nfs/dbraw/zinc/46/42/40/1120464240.db2.gz PMWMZRKVSVFBIH-GWCFXTLKSA-N 1 0 291.376 3.853 20 5 CHBDRO CCC(C)(CC)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000116359525 1120468309 /nfs/dbraw/zinc/46/83/09/1120468309.db2.gz QQNNKRFZQRFQDD-UHFFFAOYSA-N 1 0 250.342 3.572 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2CCC=CO2)cc1[N+](=O)[O-] ZINC000780566086 1120475845 /nfs/dbraw/zinc/47/58/45/1120475845.db2.gz JNSMOWWEGSGUMH-CQSZACIVSA-N 1 0 290.363 3.501 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000068581141 1120479336 /nfs/dbraw/zinc/47/93/36/1120479336.db2.gz MQIPGLOGXFOXFG-MBNYWOFBSA-N 1 0 292.379 3.518 20 5 CHBDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000068590650 1120479537 /nfs/dbraw/zinc/47/95/37/1120479537.db2.gz UJKQIGRMTFUKSK-HIFRSBDPSA-N 1 0 276.380 3.962 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2F)cc1[N+](=O)[O-] ZINC000020091213 1120493771 /nfs/dbraw/zinc/49/37/71/1120493771.db2.gz ZOYYYMJCKJMFAV-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000123138026 1120522102 /nfs/dbraw/zinc/52/21/02/1120522102.db2.gz FMTDOJASACFNIR-KCXAZCMYSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000070305650 1120530645 /nfs/dbraw/zinc/53/06/45/1120530645.db2.gz OIPPLYXMWAXAJR-NWDGAFQWSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1c(C[NH2+][C@@H](c2ccccn2)C2CC2)cccc1[N+](=O)[O-] ZINC000922582765 1120556181 /nfs/dbraw/zinc/55/61/81/1120556181.db2.gz RRSCCPNAKBVZQY-QGZVFWFLSA-N 1 0 297.358 3.539 20 5 CHBDRO CC(C)[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCC1 ZINC000093608269 1120563407 /nfs/dbraw/zinc/56/34/07/1120563407.db2.gz SWLWBPKGRGHPDW-SOFGYWHQSA-N 1 0 274.364 3.871 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCCCC2(C)C)cc1[N+](=O)[O-] ZINC000094325325 1120576727 /nfs/dbraw/zinc/57/67/27/1120576727.db2.gz GFYJRSLTWFUOFY-OAHLLOKOSA-N 1 0 292.379 3.662 20 5 CHBDRO COCC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000508992807 1120577982 /nfs/dbraw/zinc/57/79/82/1120577982.db2.gz BSKZILMATMIKQE-WFASDCNBSA-N 1 0 294.395 3.697 20 5 CHBDRO CC(C)[NH+](CCNc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000020019648 1120580354 /nfs/dbraw/zinc/58/03/54/1120580354.db2.gz LQWRSUNBUNBIRT-UHFFFAOYSA-N 1 0 299.802 3.779 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCc2cccs2)cccc1[N+](=O)[O-] ZINC000155586721 1120591824 /nfs/dbraw/zinc/59/18/24/1120591824.db2.gz SLCDVHMJLAGLFY-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@H](c1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000302742631 1120656824 /nfs/dbraw/zinc/65/68/24/1120656824.db2.gz ROCITELVAIHXII-CYBMUJFWSA-N 1 0 270.332 3.788 20 5 CHBDRO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000466934916 1120662308 /nfs/dbraw/zinc/66/23/08/1120662308.db2.gz GRNQDRVIWPZKIE-GWCFXTLKSA-N 1 0 282.771 3.869 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](C)CSC)c1cccc([N+](=O)[O-])c1 ZINC000131566509 1120663552 /nfs/dbraw/zinc/66/35/52/1120663552.db2.gz BGDMMKJTYVYWTJ-FZMZJTMJSA-N 1 0 282.409 3.777 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)ccc1Cl ZINC000313496503 1120740645 /nfs/dbraw/zinc/74/06/45/1120740645.db2.gz IKPHGIINTBPAEB-BETUJISGSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000313811723 1120791632 /nfs/dbraw/zinc/79/16/32/1120791632.db2.gz ISZZKWNVMXGLPY-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000112017770 1120812171 /nfs/dbraw/zinc/81/21/71/1120812171.db2.gz UFZJSFORYVHRIV-HNNXBMFYSA-N 1 0 286.306 3.511 20 5 CHBDRO CCSCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072900528 1120950208 /nfs/dbraw/zinc/95/02/08/1120950208.db2.gz WSMNYURVZPAYQK-GFCCVEGCSA-N 1 0 282.409 3.558 20 5 CHBDRO COc1ccc(C[NH2+]CCC2=CCCCC2)cc1[N+](=O)[O-] ZINC000051756324 1120983035 /nfs/dbraw/zinc/98/30/35/1120983035.db2.gz GFEIQWDJJSSQTD-UHFFFAOYSA-N 1 0 290.363 3.584 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541999808 1121012678 /nfs/dbraw/zinc/01/26/78/1121012678.db2.gz ATYAABMWIOZASY-SNVBAGLBSA-N 1 0 270.760 3.725 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CSC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000354019484 1121019162 /nfs/dbraw/zinc/01/91/62/1121019162.db2.gz YVWJWEDDEIXNOT-UGFHNGPFSA-N 1 0 294.420 3.777 20 5 CHBDRO Cc1cc(NCCC2CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000228485614 1121029343 /nfs/dbraw/zinc/02/93/43/1121029343.db2.gz POJGVFRGAIIEJT-UHFFFAOYSA-N 1 0 271.320 3.663 20 5 CHBDRO Cc1c(C[NH2+]Cc2cc3ccccc3[nH]2)cccc1[N+](=O)[O-] ZINC000618967209 1128957693 /nfs/dbraw/zinc/95/76/93/1128957693.db2.gz OGMAJJZWAZXUIE-UHFFFAOYSA-N 1 0 295.342 3.674 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001174760439 1121041875 /nfs/dbraw/zinc/04/18/75/1121041875.db2.gz OWMZZBMZSJZLIB-WFASDCNBSA-N 1 0 292.354 3.889 20 5 CHBDRO C[C@@H]([NH2+]C[C@]1(C)CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000134110558 1121056363 /nfs/dbraw/zinc/05/63/63/1121056363.db2.gz DHRFDHZLAJZAJW-RISCZKNCSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCC1 ZINC000070306163 1128966529 /nfs/dbraw/zinc/96/65/29/1128966529.db2.gz LURAPIOZMOAMSF-JTQLQIEISA-N 1 0 282.771 3.917 20 5 CHBDRO CC(C)([NH2+]CCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000429252050 1121296337 /nfs/dbraw/zinc/29/63/37/1121296337.db2.gz CZCBIFKGVJSIQQ-UHFFFAOYSA-N 1 0 284.359 3.662 20 5 CHBDRO C[NH+](C)Cc1cccc(Nc2cc([N+](=O)[O-])ccc2F)c1 ZINC001175735105 1121441983 /nfs/dbraw/zinc/44/19/83/1121441983.db2.gz IOTAXVNESRGWLB-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO C[NH+](C)Cc1ccc(Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC001175736630 1121443073 /nfs/dbraw/zinc/44/30/73/1121443073.db2.gz DWLPOCJOKUYKCF-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO C[C@@H](CC1CCC1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000710251897 1121474567 /nfs/dbraw/zinc/47/45/67/1121474567.db2.gz YUBPAQKKABQNBL-JTQLQIEISA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CC[C@H](C)C1 ZINC000433038368 1121528374 /nfs/dbraw/zinc/52/83/74/1121528374.db2.gz JRPPGAYJAUCADH-FZMZJTMJSA-N 1 0 262.353 3.524 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC(C(C)C)C1 ZINC000619431103 1128991711 /nfs/dbraw/zinc/99/17/11/1128991711.db2.gz CLABOEUMMSUNNH-QPEQYQDCSA-N 1 0 274.364 3.586 20 5 CHBDRO CCC(C)(C)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000429412904 1121570909 /nfs/dbraw/zinc/57/09/09/1121570909.db2.gz QQPPPBKMPXMEOH-ZDUSSCGKSA-N 1 0 278.396 3.942 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccsc1 ZINC000611253016 1121632098 /nfs/dbraw/zinc/63/20/98/1121632098.db2.gz VTFPOTMVDXNZCL-XQRVVYSFSA-N 1 0 288.372 3.802 20 5 CHBDRO CC1(C)CC([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000433289956 1121638836 /nfs/dbraw/zinc/63/88/36/1121638836.db2.gz QDRMBPDNOSJEJQ-UHFFFAOYSA-N 1 0 276.380 3.696 20 5 CHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCc2ccccc21 ZINC000611549613 1121655594 /nfs/dbraw/zinc/65/55/94/1121655594.db2.gz BYMJVLDICCYQOB-MRXNPFEDSA-N 1 0 296.370 3.757 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H]1CC[C@@H](C)O1)c1cccc([N+](=O)[O-])c1 ZINC000398103849 1121707661 /nfs/dbraw/zinc/70/76/61/1121707661.db2.gz YMTGNGUBTZSOTD-WQVCFCJDSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H]1CCCCS1 ZINC001178290315 1121778204 /nfs/dbraw/zinc/77/82/04/1121778204.db2.gz BHSCDUCEIGFIAV-CYBMUJFWSA-N 1 0 294.420 3.587 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCC[C@H]2C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000619753697 1129010401 /nfs/dbraw/zinc/01/04/01/1129010401.db2.gz MANZMERTQLFBRT-SRMUXQRQSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000501792212 1122010993 /nfs/dbraw/zinc/01/09/93/1122010993.db2.gz CWLNPQCGLYWFAN-UPJWGTAASA-N 1 0 262.353 3.634 20 5 CHBDRO Cc1ccc(C)c(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000501823852 1122011727 /nfs/dbraw/zinc/01/17/27/1122011727.db2.gz GZPJKOAXOXJBJM-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO C[N@H+](CCCCNc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000413347205 1122013336 /nfs/dbraw/zinc/01/33/36/1122013336.db2.gz KNDRQTRYNCMVBX-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001307450520 1122075205 /nfs/dbraw/zinc/07/52/05/1122075205.db2.gz NNHILEBXVIYHBT-OAHLLOKOSA-N 1 0 276.380 3.914 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]C[C@H]1C[C@@H]1c1ccccc1 ZINC000503036162 1122163236 /nfs/dbraw/zinc/16/32/36/1122163236.db2.gz QGZDHAMZWDPDOD-IAGOWNOFSA-N 1 0 296.370 3.531 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C(C1CC1)C1CC1 ZINC000183309591 1129044155 /nfs/dbraw/zinc/04/41/55/1129044155.db2.gz ZAIDQQWZWXMHJR-UHFFFAOYSA-N 1 0 274.364 3.524 20 5 CHBDRO CC[NH+](CC)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000505248646 1122352126 /nfs/dbraw/zinc/35/21/26/1122352126.db2.gz DHQZWTNMLODMKL-UHFFFAOYSA-N 1 0 250.342 3.560 20 5 CHBDRO Cc1ccc(C[N@@H+]([C@H](C)C(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000505256303 1122352300 /nfs/dbraw/zinc/35/23/00/1122352300.db2.gz ZHURRNIXHTUBAI-CYBMUJFWSA-N 1 0 276.380 3.912 20 5 CHBDRO CC(C)C[C@@H](C[NH+]1CCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC001186586001 1122398582 /nfs/dbraw/zinc/39/85/82/1122398582.db2.gz YBBWRDDWUROOIW-HNNXBMFYSA-N 1 0 291.395 3.517 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000434774854 1122411034 /nfs/dbraw/zinc/41/10/34/1122411034.db2.gz IOMXWKHOYRRFJN-IUODEOHRSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000505617440 1122438257 /nfs/dbraw/zinc/43/82/57/1122438257.db2.gz YWQYBDOJSVCPDH-NWDGAFQWSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000505617441 1122438766 /nfs/dbraw/zinc/43/87/66/1122438766.db2.gz YWQYBDOJSVCPDH-RYUDHWBXSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001191521340 1122604318 /nfs/dbraw/zinc/60/43/18/1122604318.db2.gz PTNYHDIHEHTMDF-UKRRQHHQSA-N 1 0 288.391 3.779 20 5 CHBDRO Cc1ncc([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000601298377 1122623562 /nfs/dbraw/zinc/62/35/62/1122623562.db2.gz NONYPILWYBUWQD-ZJUUUORDSA-N 1 0 291.376 3.772 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC001192198578 1122632389 /nfs/dbraw/zinc/63/23/89/1122632389.db2.gz LFDKOCBJIKHOHQ-ZDUSSCGKSA-N 1 0 294.370 3.992 20 5 CHBDRO Cc1c(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC001192481528 1122650230 /nfs/dbraw/zinc/65/02/30/1122650230.db2.gz NCVPHPDEZOWGAS-YLQAJVPDSA-N 1 0 288.391 3.914 20 5 CHBDRO CC(C)CC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C(C)(C)C ZINC001192603882 1122652601 /nfs/dbraw/zinc/65/26/01/1122652601.db2.gz ICHDMLDCHIPAJE-CQSZACIVSA-N 1 0 293.411 3.930 20 5 CHBDRO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCCCCC1 ZINC000518460319 1122758573 /nfs/dbraw/zinc/75/85/73/1122758573.db2.gz QWDFTFGLOGOZKB-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO C=C/C=C\CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194478310 1122779280 /nfs/dbraw/zinc/77/92/80/1122779280.db2.gz SOJLVIKKRRBIBZ-QGZUEGPWSA-N 1 0 286.375 3.907 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC001195147163 1122849168 /nfs/dbraw/zinc/84/91/68/1122849168.db2.gz KJTSRZBNKABHBE-OAHLLOKOSA-N 1 0 274.364 3.525 20 5 CHBDRO CC(C)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000159441081 1122860999 /nfs/dbraw/zinc/86/09/99/1122860999.db2.gz AQXNQONGWCCFET-LLVKDONJSA-N 1 0 282.771 3.726 20 5 CHBDRO Cc1cc(C)cc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000507157302 1122930579 /nfs/dbraw/zinc/93/05/79/1122930579.db2.gz WRUAYAJDBOREBX-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO CCC1(C)CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000507165305 1122932550 /nfs/dbraw/zinc/93/25/50/1122932550.db2.gz PDXDEKNTXWUHLI-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO CC(C)[C@H](C)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507227182 1122941398 /nfs/dbraw/zinc/94/13/98/1122941398.db2.gz DNXCDEOHKKKZBO-JWJUJFCLSA-N 1 0 262.353 3.584 20 5 CHBDRO C[C@@H]([NH2+]C1CC(OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC001197646588 1122963110 /nfs/dbraw/zinc/96/31/10/1122963110.db2.gz HMVHYEVGZCUNDB-NUYPLMSZSA-N 1 0 292.379 3.592 20 5 CHBDRO CCCC[N@H+](CC)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037403788 1123027545 /nfs/dbraw/zinc/02/75/45/1123027545.db2.gz MSEFKDQVZPGIQU-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO CC[C@@H]([NH2+]CCC(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000294097011 1123061606 /nfs/dbraw/zinc/06/16/06/1123061606.db2.gz BOWPHNGONVOVPB-GFCCVEGCSA-N 1 0 272.295 3.681 20 5 CHBDRO C[C@H]1CCC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)CC1 ZINC001201823225 1123153265 /nfs/dbraw/zinc/15/32/65/1123153265.db2.gz XJWRVPUSVISHLX-DZGCQCFKSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@H](C)[C@@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520590531 1123181130 /nfs/dbraw/zinc/18/11/30/1123181130.db2.gz LIGHQTXNIJNEPO-QWHCGFSZSA-N 1 0 276.380 3.994 20 5 CHBDRO CC(C)[N@H+](C/C=C/Cl)Cc1ccc([N+](=O)[O-])cc1 ZINC000067458428 1123252010 /nfs/dbraw/zinc/25/20/10/1123252010.db2.gz BDEBYOSSUZLCMG-FPYGCLRLSA-N 1 0 268.744 3.558 20 5 CHBDRO CC(C)C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000507999222 1123253725 /nfs/dbraw/zinc/25/37/25/1123253725.db2.gz NLAFSGBSZYOYPB-FNORWQNLSA-N 1 0 274.364 3.728 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3C=CCC3)o2)cc1 ZINC000850358805 1123256555 /nfs/dbraw/zinc/25/65/55/1123256555.db2.gz LSOCHWCUXSSHOD-ZDUSSCGKSA-N 1 0 284.315 3.663 20 5 CHBDRO CC1([NH3+])CN(Cc2c3ccccc3cc3ccccc32)C1 ZINC001204979775 1123269613 /nfs/dbraw/zinc/26/96/13/1123269613.db2.gz OTTMUZUFOICWEX-UHFFFAOYSA-N 1 0 276.383 3.526 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1C=CCC1)CCCC2 ZINC000850505965 1123276088 /nfs/dbraw/zinc/27/60/88/1123276088.db2.gz ACTSBSMRVVIJKT-BBRMVZONSA-N 1 0 272.348 3.671 20 5 CHBDRO Cc1c(C[NH2+][C@@H](c2cccnc2)C(C)C)cccc1[N+](=O)[O-] ZINC000358343862 1123441835 /nfs/dbraw/zinc/44/18/35/1123441835.db2.gz YULGZFLXBYUHMI-QGZVFWFLSA-N 1 0 299.374 3.785 20 5 CHBDRO Cc1ccc(CCC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000896511516 1123590497 /nfs/dbraw/zinc/59/04/97/1123590497.db2.gz FOHUIOIYVSWHQU-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CCC1 ZINC000119610786 1123895989 /nfs/dbraw/zinc/89/59/89/1123895989.db2.gz ZAJWXYBCKUWIMM-VIFPVBQESA-N 1 0 268.744 3.526 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000088512092 1124064398 /nfs/dbraw/zinc/06/43/98/1124064398.db2.gz QXGXMPHOCSVBGH-GXTWGEPZSA-N 1 0 292.379 3.662 20 5 CHBDRO CCc1cccnc1[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866540918 1124080588 /nfs/dbraw/zinc/08/05/88/1124080588.db2.gz SZBXLQMHKYWRHN-CYBMUJFWSA-N 1 0 299.374 3.711 20 5 CHBDRO CC(C)(C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(F)F ZINC000866546961 1124081869 /nfs/dbraw/zinc/08/18/69/1124081869.db2.gz QWZXPSNCCAIRAJ-LBPRGKRZSA-N 1 0 298.333 3.853 20 5 CHBDRO CC(C)[C@H]1CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000446737378 1124121576 /nfs/dbraw/zinc/12/15/76/1124121576.db2.gz VCQVMJXFHTURLP-NSHDSACASA-N 1 0 282.771 3.726 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC(F)F ZINC001119540098 1131257931 /nfs/dbraw/zinc/25/79/31/1131257931.db2.gz FIMACSLDRKPEHG-JTQLQIEISA-N 1 0 272.295 3.599 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC3(C2)CCCCC3)cc1 ZINC000525636414 1124451304 /nfs/dbraw/zinc/45/13/04/1124451304.db2.gz VOGRNSXQUCCUFH-UHFFFAOYSA-N 1 0 288.391 3.794 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1C ZINC000525636063 1124451861 /nfs/dbraw/zinc/45/18/61/1124451861.db2.gz DBJLNJRZWIYSKV-MNOVXSKESA-N 1 0 282.771 3.869 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CCCCC1)CCC2 ZINC000447518476 1124479940 /nfs/dbraw/zinc/47/99/40/1124479940.db2.gz WHLUWYYWYKAXPK-INIZCTEOSA-N 1 0 274.364 3.895 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1(C3CC3)CC1)CCC2 ZINC000447576329 1124495685 /nfs/dbraw/zinc/49/56/85/1124495685.db2.gz XXEKEGBHDWIZMA-INIZCTEOSA-N 1 0 286.375 3.752 20 5 CHBDRO CC(C)CCC[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000526115909 1124510214 /nfs/dbraw/zinc/51/02/14/1124510214.db2.gz GIHMJRVGBIZQFA-UHFFFAOYSA-N 1 0 264.369 3.856 20 5 CHBDRO C[C@H]([NH2+]C[C@@H](C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000122769618 1124532929 /nfs/dbraw/zinc/53/29/29/1124532929.db2.gz IBRNHKAFLKKMCC-NEPJUHHUSA-N 1 0 264.369 3.928 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC=CC1 ZINC000872044626 1124665196 /nfs/dbraw/zinc/66/51/96/1124665196.db2.gz VKHNMUPFAPIRIQ-JTQLQIEISA-N 1 0 278.377 3.686 20 5 CHBDRO CC(C)SCC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872070677 1124674025 /nfs/dbraw/zinc/67/40/25/1124674025.db2.gz GRVDUNPSSFMZQC-JTQLQIEISA-N 1 0 286.372 3.526 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@H](C)F ZINC000872074036 1124675304 /nfs/dbraw/zinc/67/53/04/1124675304.db2.gz VAJKNNFYKAUTRW-VHSXEESVSA-N 1 0 286.372 3.715 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])C1CC1 ZINC000872084076 1124678313 /nfs/dbraw/zinc/67/83/13/1124678313.db2.gz DJQZGFYNQVBNLU-SKDRFNHKSA-N 1 0 266.316 3.573 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])C1CC1 ZINC000872084057 1124678579 /nfs/dbraw/zinc/67/85/79/1124678579.db2.gz DJQZGFYNQVBNLU-BXKDBHETSA-N 1 0 266.316 3.573 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC12CC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872091235 1124681212 /nfs/dbraw/zinc/68/12/12/1124681212.db2.gz HGMUTYOGWXZOOB-ZWNOBZJWSA-N 1 0 278.327 3.717 20 5 CHBDRO COCC(C)(C)CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000872105205 1124683863 /nfs/dbraw/zinc/68/38/63/1124683863.db2.gz DCBKHNUWMUPZGV-CYBMUJFWSA-N 1 0 294.395 3.617 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000449299008 1124685673 /nfs/dbraw/zinc/68/56/73/1124685673.db2.gz JYTZPEQTCINCFA-NWDGAFQWSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1CCC(F)(F)CC1 ZINC000873096998 1124738278 /nfs/dbraw/zinc/73/82/78/1124738278.db2.gz CWHQOMOKEMZFDX-UHFFFAOYSA-N 1 0 298.333 3.879 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2c3ccccc3O[C@@H]2C)cccc1[N+](=O)[O-] ZINC000873127972 1124739287 /nfs/dbraw/zinc/73/92/87/1124739287.db2.gz YOZQXCRWDSGNDU-PXAZEXFGSA-N 1 0 298.342 3.515 20 5 CHBDRO Cc1c(C[NH2+]CC(C)(C)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000873121388 1124739399 /nfs/dbraw/zinc/73/93/99/1124739399.db2.gz HHFHCLTZDHEISH-UHFFFAOYSA-N 1 0 290.285 3.581 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000449440609 1124749155 /nfs/dbraw/zinc/74/91/55/1124749155.db2.gz LLSXTNBKCLJKGO-IVMMDQJWSA-N 1 0 288.391 3.694 20 5 CHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ccco3)C2)cc1 ZINC000449498383 1124774150 /nfs/dbraw/zinc/77/41/50/1124774150.db2.gz KJOYGSVTQJJDDX-AWEZNQCLSA-N 1 0 286.331 3.567 20 5 CHBDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000531202529 1125200748 /nfs/dbraw/zinc/20/07/48/1125200748.db2.gz QSGLMCHWFXHFGL-KBXCAEBGSA-N 1 0 296.370 3.973 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)cc1 ZINC000532127588 1125235449 /nfs/dbraw/zinc/23/54/49/1125235449.db2.gz GBEKVNOSLGMOHX-FUHWJXTLSA-N 1 0 296.370 3.531 20 5 CHBDRO C=C/C=C/CC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000883269148 1125389510 /nfs/dbraw/zinc/38/95/10/1125389510.db2.gz AFHQUVNLDVVSDX-SGUJLRQBSA-N 1 0 264.300 3.517 20 5 CHBDRO CSCC[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000131623659 1125402356 /nfs/dbraw/zinc/40/23/56/1125402356.db2.gz RAWJQJSYCBMRJD-RYUDHWBXSA-N 1 0 282.409 3.695 20 5 CHBDRO C[C@@H](C[NH2+]C1CCC(F)(F)CC1)c1ccccc1[N+](=O)[O-] ZINC000897459805 1125422230 /nfs/dbraw/zinc/42/22/30/1125422230.db2.gz BZIGMUITGMYYDX-NSHDSACASA-N 1 0 298.333 3.866 20 5 CHBDRO C[C@H](C[NH2+][C@H]1CCCC12CC2)c1ccccc1[N+](=O)[O-] ZINC000897461108 1125423949 /nfs/dbraw/zinc/42/39/49/1125423949.db2.gz LKIQYQLBBLZMBN-DOMZBBRYSA-N 1 0 274.364 3.621 20 5 CHBDRO Cc1ccccc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000037871738 1129279878 /nfs/dbraw/zinc/27/98/78/1129279878.db2.gz DTGDBGKGVMSHKC-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO Cc1cc(Cl)c(NCC(C)(C)C[NH+](C)C)c([N+](=O)[O-])c1 ZINC001168769039 1129293445 /nfs/dbraw/zinc/29/34/45/1129293445.db2.gz LAEAYIYAGMCIDL-UHFFFAOYSA-N 1 0 299.802 3.556 20 5 CHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000741795665 1129453769 /nfs/dbraw/zinc/45/37/69/1129453769.db2.gz QKBHONMNCFYQCU-RYUDHWBXSA-N 1 0 280.343 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[NH+]1C2CCCC1CCC2 ZINC000743851430 1129540342 /nfs/dbraw/zinc/54/03/42/1129540342.db2.gz HFEONPBYEJODCM-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc2ccccc2c1 ZINC001168978244 1129686117 /nfs/dbraw/zinc/68/61/17/1129686117.db2.gz QENDDRUNGZJTCV-QWQRMKEZSA-N 1 0 298.386 3.936 20 5 CHBDRO CC(C)[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001168985294 1129686856 /nfs/dbraw/zinc/68/68/56/1129686856.db2.gz SRQLPSZNDQFZQZ-WQVCFCJDSA-N 1 0 294.370 3.558 20 5 CHBDRO CC(C)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(Cl)c1 ZINC001168981222 1129686931 /nfs/dbraw/zinc/68/69/31/1129686931.db2.gz GUOMMXJGYUODBL-RISCZKNCSA-N 1 0 296.798 3.610 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168984953 1129687135 /nfs/dbraw/zinc/68/71/35/1129687135.db2.gz BODDXPOGGWBKOQ-KCPJHIHWSA-N 1 0 296.798 3.826 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168965644 1129687859 /nfs/dbraw/zinc/68/78/59/1129687859.db2.gz BODDXPOGGWBKOQ-UGFHNGPFSA-N 1 0 296.798 3.826 20 5 CHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001169006250 1129689340 /nfs/dbraw/zinc/68/93/40/1129689340.db2.gz 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C[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000903428001 1130175762 /nfs/dbraw/zinc/17/57/62/1130175762.db2.gz LOQJJMUHNQNJDW-PXAZEXFGSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903427767 1130175891 /nfs/dbraw/zinc/17/58/91/1130175891.db2.gz JUWFZSMXHFILGS-SJCJKPOMSA-N 1 0 297.358 3.792 20 5 CHBDRO CC[C@H]1CC[N@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)[C@@H]1C ZINC001462127885 1130204139 /nfs/dbraw/zinc/20/41/39/1130204139.db2.gz SYWQBVABMFILMF-KGLIPLIRSA-N 1 0 276.380 3.832 20 5 CHBDRO CCC(CC)C[NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170298293 1130476407 /nfs/dbraw/zinc/47/64/07/1130476407.db2.gz IOAJATNINVFAGL-GFCCVEGCSA-N 1 0 294.395 3.560 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC000827319121 1130556486 /nfs/dbraw/zinc/55/64/86/1130556486.db2.gz ABBQQOQMMRGCHJ-GFCCVEGCSA-N 1 0 268.744 3.526 20 5 CHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCC1CC1 ZINC000811482828 1130612330 /nfs/dbraw/zinc/61/23/30/1130612330.db2.gz UDFZVZNYIUUYFR-UHFFFAOYSA-N 1 0 289.162 3.791 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cc(Cl)ccc1C(F)(F)F ZINC001234193284 1130614911 /nfs/dbraw/zinc/61/49/11/1130614911.db2.gz JVGXBISCHLZNPM-SECBINFHSA-N 1 0 296.740 3.832 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000782502358 1130780231 /nfs/dbraw/zinc/78/02/31/1130780231.db2.gz FQYSQQLOPCQYIP-WPGHFRTFSA-N 1 0 292.354 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C23CCC(CC2)C3)c1 ZINC000784644275 1130914500 /nfs/dbraw/zinc/91/45/00/1130914500.db2.gz ULPFXIWFJCPHNI-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(C)c1 ZINC000815561324 1130999672 /nfs/dbraw/zinc/99/96/72/1130999672.db2.gz DMCSCSLCWUAVFX-ZDUSSCGKSA-N 1 0 299.374 3.645 20 5 CHBDRO CC[C@H](C)C[C@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815595218 1131005817 /nfs/dbraw/zinc/00/58/17/1131005817.db2.gz KXKJPNQNJARBCU-SDDRHHMPSA-N 1 0 279.384 3.652 20 5 CHBDRO CC1=CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000816556486 1131109296 /nfs/dbraw/zinc/10/92/96/1131109296.db2.gz KMPLJVOGXAGKLS-LBPRGKRZSA-N 1 0 280.755 3.837 20 5 CHBDRO [NH3+]CCCCCCCOc1ccc([N+](=O)[O-])cc1Cl ZINC000818617724 1131219238 /nfs/dbraw/zinc/21/92/38/1131219238.db2.gz HUYIATHULNAUJW-UHFFFAOYSA-N 1 0 286.759 3.536 20 5 CHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C/C=C\Cl)C2)cc1 ZINC000831534531 1131489341 /nfs/dbraw/zinc/48/93/41/1131489341.db2.gz PCRWKCZFSMNRGS-YFBARTHOSA-N 1 0 280.755 3.527 20 5 CHBDRO CC1(C2([NH2+]Cc3ccc([N+](=O)[O-])c(Cl)c3)CC2)CC1 ZINC000825124641 1131499773 /nfs/dbraw/zinc/49/97/73/1131499773.db2.gz VGTCHXQSYOSXMJ-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO Cc1cc(C(C)(C)C)ccc1O[C@@H](C)C[N+](C)(C)C ZINC001227674055 1131722096 /nfs/dbraw/zinc/72/20/96/1131722096.db2.gz TUIRFLHFKNOTRS-AWEZNQCLSA-N 1 0 264.433 3.766 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc2ccc3cccnc3c21 ZINC001227763550 1131739209 /nfs/dbraw/zinc/73/92/09/1131739209.db2.gz DWPKNMKJPLJQRA-CQSZACIVSA-N 1 0 295.406 3.862 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(C(F)(F)F)c(Cl)c1 ZINC001227831932 1131747518 /nfs/dbraw/zinc/74/75/18/1131747518.db2.gz MBWZEKJWTMYIQU-VIFPVBQESA-N 1 0 296.740 3.832 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccccc1-c1ccccc1O ZINC001228046039 1131795359 /nfs/dbraw/zinc/79/53/59/1131795359.db2.gz GPFOENANTZIXIP-AWEZNQCLSA-O 1 0 286.395 3.533 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000036993415 1131985611 /nfs/dbraw/zinc/98/56/11/1131985611.db2.gz WETKAWACLRXDNV-OLZOCXBDSA-N 1 0 288.347 3.778 20 5 CHBDRO C[NH+](C)C1CCC(Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000715572320 1131989406 /nfs/dbraw/zinc/98/94/06/1131989406.db2.gz RNLWPWZUEDNANP-UHFFFAOYSA-N 1 0 297.786 3.533 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccns2)cc1[N+](=O)[O-] ZINC000716055105 1132004115 /nfs/dbraw/zinc/00/41/15/1132004115.db2.gz NNJGBOPHYLFIBB-GHMZBOCLSA-N 1 0 291.376 3.772 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cc(O)ccc1-c1ccccc1 ZINC001229833994 1132122505 /nfs/dbraw/zinc/12/25/05/1132122505.db2.gz SISDHAMHOMBWSH-AWEZNQCLSA-O 1 0 286.395 3.533 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900808 1132348312 /nfs/dbraw/zinc/34/83/12/1132348312.db2.gz FXJYSRUOBZFIJH-CZUORRHYSA-N 1 0 290.407 3.866 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1CCCC1)CC2 ZINC001172896020 1132360384 /nfs/dbraw/zinc/36/03/84/1132360384.db2.gz KZFHJOIPZAXFFO-INIZCTEOSA-N 1 0 288.391 3.622 20 5 CHBDRO CC(C)CC[C@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173217741 1132411341 /nfs/dbraw/zinc/41/13/41/1132411341.db2.gz LSRDZYIMXHQPQV-KBPBESRZSA-N 1 0 278.396 3.940 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC(C)(C)C ZINC001173217604 1132411670 /nfs/dbraw/zinc/41/16/70/1132411670.db2.gz XEQWXRZBEOMSDT-GFCCVEGCSA-N 1 0 264.369 3.552 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(C)CC(F)(F)C1 ZINC001173219187 1132411905 /nfs/dbraw/zinc/41/19/05/1132411905.db2.gz YORQLTRBRDBAQA-NSHDSACASA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173227271 1132412435 /nfs/dbraw/zinc/41/24/35/1132412435.db2.gz PCMQEMFNLUJDPH-HNNXBMFYSA-N 1 0 298.386 3.966 20 5 CHBDRO CCCCC[N@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225897 1132412574 /nfs/dbraw/zinc/41/25/74/1132412574.db2.gz KEJQYBMZUPBNKX-CYBMUJFWSA-N 1 0 264.369 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[C@@H]2CCC[C@@H]21 ZINC001173234971 1132413620 /nfs/dbraw/zinc/41/36/20/1132413620.db2.gz RIWIRYYDJIUTFS-QCPWZWHMSA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)nc1 ZINC001173235270 1132414076 /nfs/dbraw/zinc/41/40/76/1132414076.db2.gz RYSQDDUREJVSHP-UONOGXRCSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCCCCC1 ZINC001173233317 1132414227 /nfs/dbraw/zinc/41/42/27/1132414227.db2.gz KSMFMWVYZXBVNF-CQSZACIVSA-N 1 0 276.380 3.792 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCC[C@H]1C ZINC001173213726 1132416363 /nfs/dbraw/zinc/41/63/63/1132416363.db2.gz HINYDLZUIBCMOD-IOASZLSFSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(C)CC1 ZINC001173213519 1132416913 /nfs/dbraw/zinc/41/69/13/1132416913.db2.gz FYXUJCJVPFZYHP-JVWICGRDSA-N 1 0 276.380 3.694 20 5 CHBDRO CC[NH+](CC)Cc1ccc2ccc3cccnc3c2n1 ZINC001232218714 1132439400 /nfs/dbraw/zinc/43/94/00/1132439400.db2.gz FRJCGSNXMQIUJX-UHFFFAOYSA-N 1 0 265.360 3.625 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1c(F)cccc1C(C)(C)C ZINC001233826642 1132685512 /nfs/dbraw/zinc/68/55/12/1132685512.db2.gz FWVPBXRGYUSHEK-GFCCVEGCSA-N 1 0 268.396 3.597 20 5 CHBDRO O=[N+]([O-])c1ccccc1Nc1ccc(C2CC[NH2+]CC2)cc1 ZINC001159598156 1132871555 /nfs/dbraw/zinc/87/15/55/1132871555.db2.gz IHGCEJIYAKXCNU-UHFFFAOYSA-N 1 0 297.358 3.805 20 5 CHBDRO CC[NH2+]Cc1cccc(Nc2ccc(C)cc2[N+](=O)[O-])c1 ZINC001159962870 1132929447 /nfs/dbraw/zinc/92/94/47/1132929447.db2.gz SKAQAZYVQLJEAY-UHFFFAOYSA-N 1 0 285.347 3.756 20 5 CHBDRO CC[NH2+]Cc1cccc(Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC001159956777 1132930015 /nfs/dbraw/zinc/93/00/15/1132930015.db2.gz PKUJRXWFHJKUMX-UHFFFAOYSA-N 1 0 285.347 3.756 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NC1Cc2ccccc2C1 ZINC001161758271 1133025626 /nfs/dbraw/zinc/02/56/26/1133025626.db2.gz OYHGZOGZVYOCNG-UHFFFAOYSA-N 1 0 295.450 3.862 20 5 CHBDRO O=[N+]([O-])c1ccccc1Nc1ccccc1C[NH+]1CCCC1 ZINC001206164094 1133666397 /nfs/dbraw/zinc/66/63/97/1133666397.db2.gz CHBHCTSVHVDLNJ-UHFFFAOYSA-N 1 0 297.358 3.934 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC001207152183 1133771322 /nfs/dbraw/zinc/77/13/22/1133771322.db2.gz ZGFXPUGATCOLRR-HOTGVXAUSA-N 1 0 288.391 3.962 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1cc[nH+]c(C2CC2)c1 ZINC001211288212 1134403962 /nfs/dbraw/zinc/40/39/62/1134403962.db2.gz KRFUIBZHDJJFFT-UHFFFAOYSA-N 1 0 269.304 3.919 20 5 CHBDRO Cc1ccc(Nc2cc[nH+]c(N3CCCC3)c2)c([N+](=O)[O-])c1 ZINC001214169487 1134515315 /nfs/dbraw/zinc/51/53/15/1134515315.db2.gz PBPGAGHXRHJHGA-UHFFFAOYSA-N 1 0 298.346 3.642 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@@H]1CCC[NH2+]CC1 ZINC001217997375 1135039406 /nfs/dbraw/zinc/03/94/06/1135039406.db2.gz UVJJDNYYQVXWCR-OAHLLOKOSA-N 1 0 292.382 3.909 20 5 CHBDRO C[C@@H]1C[NH2+]C[C@H]1Oc1ccc2cc3ccccc3cc2c1 ZINC001218034986 1135047346 /nfs/dbraw/zinc/04/73/46/1135047346.db2.gz ZQNFSWKMBZURQK-BFUOFWGJSA-N 1 0 277.367 3.980 20 5 CHBDRO C[C@@H]1C[NH2+]C[C@H]1Oc1c2ccccc2cc2ccccc21 ZINC001218036809 1135047993 /nfs/dbraw/zinc/04/79/93/1135047993.db2.gz YENKRPCZSMJUJK-FZKQIMNGSA-N 1 0 277.367 3.980 20 5 CHBDRO C[C@@H]1C[C@H](Oc2cccc3ccc4cccnc4c32)CC[NH2+]1 ZINC001218058004 1135051291 /nfs/dbraw/zinc/05/12/91/1135051291.db2.gz VJDVLLIJOKJNOD-CZUORRHYSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H]1C[C@H](Oc2cccc3cc4ccccc4nc32)CC[NH2+]1 ZINC001218058416 1135052126 /nfs/dbraw/zinc/05/21/26/1135052126.db2.gz WYLFGFUZJQQHQO-XJKSGUPXSA-N 1 0 292.382 3.907 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2O[C@@H]1C[C@@H]2C[NH2+]C[C@@H]12 ZINC001218329303 1135088273 /nfs/dbraw/zinc/08/82/73/1135088273.db2.gz BENSNRHFCDKCJV-ATZDWAIDSA-N 1 0 289.378 3.980 20 5 CHBDRO C[C@H]1[NH2+]C[C@@H]1Oc1c2ccccc2cc2ccccc21 ZINC001218385560 1135097088 /nfs/dbraw/zinc/09/70/88/1135097088.db2.gz HPTUBWQMTCPCLC-PXAZEXFGSA-N 1 0 263.340 3.732 20 5 CHBDRO C[C@@H]1CC[C@H](Oc2cccc3cc4ccccc4nc32)C[NH2+]1 ZINC001218401077 1135099178 /nfs/dbraw/zinc/09/91/78/1135099178.db2.gz XZFPCBYTZPAQJQ-CJNGLKHVSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H]1CC[C@H](Oc2cccc3cc4ccccc4nc32)C[NH2+]1 ZINC001218401076 1135099626 /nfs/dbraw/zinc/09/96/26/1135099626.db2.gz XZFPCBYTZPAQJQ-BBRMVZONSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H]1C[NH2+]CC[C@@H]1Oc1cccc2cc3ccccc3nc21 ZINC001218415752 1135101150 /nfs/dbraw/zinc/10/11/50/1135101150.db2.gz QAUFDPFOTLKTCH-GUYCJALGSA-N 1 0 292.382 3.765 20 5 CHBDRO CC(C)[NH+]1CCC(O[C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC001223426911 1135345142 /nfs/dbraw/zinc/34/51/42/1135345142.db2.gz BHLDGMWVQGNJKK-CYBMUJFWSA-N 1 0 292.379 3.545 20 5 CHBDRO Cc1cc(C)c(C)c(CO[C@@H](C)C[N+](C)(C)C)c1C ZINC001223597565 1135363281 /nfs/dbraw/zinc/36/32/81/1135363281.db2.gz WHOKYDYRCBQROV-AWEZNQCLSA-N 1 0 264.433 3.532 20 5 CHBDRO CC(C)[NH+]1CCC(O[C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC001224024690 1135411716 /nfs/dbraw/zinc/41/17/16/1135411716.db2.gz KKIRBBARZXJNCZ-ZDUSSCGKSA-N 1 0 292.379 3.545 20 5 CHBDRO CCC[C@H](OCCC[N+](C)(C)C)c1ccc(OC)cc1 ZINC001224621429 1135462223 /nfs/dbraw/zinc/46/22/23/1135462223.db2.gz UXPFOPKVMABENB-KRWDZBQOSA-N 1 0 280.432 3.649 20 5 CHBDRO C[N+](C)(C)CCCOC1CC(c2ccccc2Cl)C1 ZINC001224624799 1135463277 /nfs/dbraw/zinc/46/32/77/1135463277.db2.gz ZIXZORNPIUSFIT-UHFFFAOYSA-N 1 0 282.835 3.699 20 5 CHBDRO C[C@@H](OCC[N+](C)(C)C)c1cc2ccccc2s1 ZINC001224771583 1135480711 /nfs/dbraw/zinc/48/07/11/1135480711.db2.gz OTJWUZQENNDDDE-GFCCVEGCSA-N 1 0 264.414 3.685 20 5 CHBDRO Cc1cccc([N+](=O)[O-])c1OC1CC[NH+](C(C)(C)C)CC1 ZINC001226971434 1135768919 /nfs/dbraw/zinc/76/89/19/1135768919.db2.gz MREHRINIUMZFOZ-UHFFFAOYSA-N 1 0 292.379 3.545 20 5 CHBDRO C[NH+]1C(C)(C)CC(Oc2ccccc2[N+](=O)[O-])CC1(C)C ZINC001227481759 1135839528 /nfs/dbraw/zinc/83/95/28/1135839528.db2.gz ZAFTZFBDIHERQL-UHFFFAOYSA-N 1 0 292.379 3.625 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CC[C@@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000574662215 335037853 /nfs/dbraw/zinc/03/78/53/335037853.db2.gz GKTAPTWOQKMOMQ-KBPBESRZSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000020123923 171005535 /nfs/dbraw/zinc/00/55/35/171005535.db2.gz YBTGRIZLUOSPLI-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000020128015 171014746 /nfs/dbraw/zinc/01/47/46/171014746.db2.gz WSWYVZMKQGLVSP-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000020130150 171019081 /nfs/dbraw/zinc/01/90/81/171019081.db2.gz DSTRSRNUSFCSNX-YVEFUNNKSA-N 1 0 282.343 3.933 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000035732860 172384189 /nfs/dbraw/zinc/38/41/89/172384189.db2.gz QJOBKCIXKCLJFN-XHDPSFHLSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]1CCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000071206250 176080141 /nfs/dbraw/zinc/08/01/41/176080141.db2.gz CWMUWGJMBNBQNS-RNCFNFMXSA-N 1 0 268.744 3.526 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C(C1CC1)C1CC1)CCC2 ZINC000192744800 227279262 /nfs/dbraw/zinc/27/92/62/227279262.db2.gz FYYDBPVZYSFOCL-MRXNPFEDSA-N 1 0 286.375 3.750 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000037668353 260115489 /nfs/dbraw/zinc/11/54/89/260115489.db2.gz XTPFYXSBCNHGHC-NSHDSACASA-N 1 0 274.320 3.655 20 5 CHBDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C1 ZINC000085064654 260370461 /nfs/dbraw/zinc/37/04/61/260370461.db2.gz KJUKOJUBVQURJW-ZYHUDNBSSA-N 1 0 268.382 3.715 20 5 CHBDRO CC[N@@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1Cl ZINC000518400972 260399481 /nfs/dbraw/zinc/39/94/81/260399481.db2.gz VHHLMCWOQIJNPB-GFCCVEGCSA-N 1 0 297.786 3.535 20 5 CHBDRO O=[N+]([O-])c1ccc(CNc2cc[nH+]c3ccccc23)cc1 ZINC000041720770 260609315 /nfs/dbraw/zinc/60/93/15/260609315.db2.gz DLALEEQJLIJEJS-UHFFFAOYSA-N 1 0 279.299 3.755 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccccc2F)cccc1[N+](=O)[O-] ZINC000153933251 261085507 /nfs/dbraw/zinc/08/55/07/261085507.db2.gz RIPZOXQOMBVPSU-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[N@H+](Cc1ccccn1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000161123187 261237769 /nfs/dbraw/zinc/23/77/69/261237769.db2.gz FMTMYCHAYMPHFI-ZDUSSCGKSA-N 1 0 285.347 3.573 20 5 CHBDRO C[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000186003955 262074789 /nfs/dbraw/zinc/07/47/89/262074789.db2.gz YPKVXZLWJRXWCJ-BBRMVZONSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@H]([NH2+]CC(C)(C)CCOC)c1cccc([N+](=O)[O-])c1 ZINC000183934138 262255538 /nfs/dbraw/zinc/25/55/38/262255538.db2.gz WWWAPUHYZIFRHL-HNNXBMFYSA-N 1 0 294.395 3.698 20 5 CHBDRO CCC[C@@H]([NH2+]CCCCF)c1cccc([N+](=O)[O-])c1 ZINC000311719690 262339863 /nfs/dbraw/zinc/33/98/63/262339863.db2.gz PESSBQPOZVVEAX-CQSZACIVSA-N 1 0 268.332 3.775 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000525795588 262347952 /nfs/dbraw/zinc/34/79/52/262347952.db2.gz JJAJWCGIPFFOJN-INIZCTEOSA-N 1 0 292.379 3.616 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCCC1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000390918389 262363967 /nfs/dbraw/zinc/36/39/67/262363967.db2.gz VNHHESCJCPAVEP-CMPLNLGQSA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)cccc1[N+](=O)[O-] ZINC000414211985 262825842 /nfs/dbraw/zinc/82/58/42/262825842.db2.gz PJIPWFBKRCOSFT-UXOAXIEHSA-N 1 0 274.364 3.742 20 5 CHBDRO CC[NH2+]Cc1ccccc1NCc1ccc([N+](=O)[O-])cc1C ZINC000414862549 263076282 /nfs/dbraw/zinc/07/62/82/263076282.db2.gz HOEQDAUIOALVHK-UHFFFAOYSA-N 1 0 299.374 3.625 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)cc1[N+](=O)[O-] ZINC000187861088 263280109 /nfs/dbraw/zinc/28/01/09/263280109.db2.gz HLCYRONMGPJBHR-JSGCOSHPSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H](F)CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417346902 263797450 /nfs/dbraw/zinc/79/74/50/263797450.db2.gz GALWASQGRUCXBE-NHYWBVRUSA-N 1 0 280.343 3.700 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000094307446 265234920 /nfs/dbraw/zinc/23/49/20/265234920.db2.gz KYYWSCBIUZGXBQ-RISCZKNCSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000094321448 265237021 /nfs/dbraw/zinc/23/70/21/265237021.db2.gz BSNHDCKWOLLJQD-SMDDNHRTSA-N 1 0 262.353 3.824 20 5 CHBDRO CCCNc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000193154405 266160945 /nfs/dbraw/zinc/16/09/45/266160945.db2.gz PSTGASDXVFAVTM-UHFFFAOYSA-N 1 0 299.374 3.707 20 5 CHBDRO Cc1cc(N2CCC=C(F)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000362650137 267029567 /nfs/dbraw/zinc/02/95/67/267029567.db2.gz TZGKBDMQZSDHPO-UHFFFAOYSA-N 1 0 287.294 3.515 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccncc1C)c1cccc([N+](=O)[O-])c1 ZINC000228661607 267258474 /nfs/dbraw/zinc/25/84/74/267258474.db2.gz IITDLXYNYDIEJA-MRXNPFEDSA-N 1 0 285.347 3.539 20 5 CHBDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000483720193 267301664 /nfs/dbraw/zinc/30/16/64/267301664.db2.gz FMTDOJASACFNIR-VBNZEHGJSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCCC[C@@H]1OC)c1cccc([N+](=O)[O-])c1 ZINC000123173649 268004443 /nfs/dbraw/zinc/00/44/43/268004443.db2.gz QTCZFIJGEMDGEB-XHSDSOJGSA-N 1 0 292.379 3.593 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000571038896 327979334 /nfs/dbraw/zinc/97/93/34/327979334.db2.gz OOCHJGBCOBFKSU-BUWBCJGYSA-N 1 0 286.375 3.705 20 5 CHBDRO CCCC(O)(CCC)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000152045826 328007288 /nfs/dbraw/zinc/00/72/88/328007288.db2.gz VXHPPDVPAUWANJ-ZDUSSCGKSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@@H]1CCCCO1 ZINC000540952860 328013590 /nfs/dbraw/zinc/01/35/90/328013590.db2.gz ARBYCDKGEUUAAP-HIFRSBDPSA-N 1 0 292.379 3.513 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC(C)(C)C1 ZINC000040675901 328015537 /nfs/dbraw/zinc/01/55/37/328015537.db2.gz FAZOZBXEJQEJMT-UKRRQHHQSA-N 1 0 290.407 3.942 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CCSCC1 ZINC000531717826 328028215 /nfs/dbraw/zinc/02/82/15/328028215.db2.gz BDLQMZDYCZICPV-GFCCVEGCSA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@H]12 ZINC000541111793 328050443 /nfs/dbraw/zinc/05/04/43/328050443.db2.gz SLLAIUKFRXSVJR-WQVCFCJDSA-N 1 0 274.364 3.605 20 5 CHBDRO Cc1ncc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000123698434 328305628 /nfs/dbraw/zinc/30/56/28/328305628.db2.gz QEWRSCYJCGHETG-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO C[NH+](C)C1(CNc2ccc([N+](=O)[O-])cc2Cl)CCCC1 ZINC000048558973 328315043 /nfs/dbraw/zinc/31/50/43/328315043.db2.gz VXUPDEXANGWCIC-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000049127213 328341525 /nfs/dbraw/zinc/34/15/25/328341525.db2.gz FTHMRHNOXBBTCG-TZMCWYRMSA-N 1 0 264.369 3.988 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCOC2CCCC2)cc1[N+](=O)[O-] ZINC000111634453 328369723 /nfs/dbraw/zinc/36/97/23/328369723.db2.gz ZCGXNLSCNFNMBV-ZDUSSCGKSA-N 1 0 292.379 3.513 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1cccs1)C1CC1 ZINC000049956815 328379630 /nfs/dbraw/zinc/37/96/30/328379630.db2.gz KDCDHGFXKWYRAT-HNNXBMFYSA-N 1 0 288.372 3.897 20 5 CHBDRO Cc1cc(C)c(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000050166182 328387896 /nfs/dbraw/zinc/38/78/96/328387896.db2.gz XOAPXQYZRFSUOJ-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000050443200 328439761 /nfs/dbraw/zinc/43/97/61/328439761.db2.gz KFVSEKAVZDWXKS-ZWNOBZJWSA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000070305652 328591391 /nfs/dbraw/zinc/59/13/91/328591391.db2.gz OIPPLYXMWAXAJR-VXGBXAGGSA-N 1 0 262.353 3.824 20 5 CHBDRO CCOC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000530491326 326818104 /nfs/dbraw/zinc/81/81/04/326818104.db2.gz WWSSQOMRUJNYOV-BBRMVZONSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC2CCC1CC2)c1cccc([N+](=O)[O-])c1 ZINC000312781662 326968451 /nfs/dbraw/zinc/96/84/51/326968451.db2.gz HTGWHZFUCRAMKF-PIISCBOPSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000231751162 327010575 /nfs/dbraw/zinc/01/05/75/327010575.db2.gz QNPDQYSTWPICQP-ZETCQYMHSA-N 1 0 296.676 3.679 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000558220505 327079227 /nfs/dbraw/zinc/07/92/27/327079227.db2.gz QFVMBGKRWUPKSZ-STQMWFEESA-N 1 0 262.353 3.509 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000558222023 327079397 /nfs/dbraw/zinc/07/93/97/327079397.db2.gz KRNDPUXAIMKAOV-ZIAGYGMSSA-N 1 0 262.353 3.509 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000558222021 327079449 /nfs/dbraw/zinc/07/94/49/327079449.db2.gz KRNDPUXAIMKAOV-KGLIPLIRSA-N 1 0 262.353 3.509 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CC[C@H]2C2CC2)cc1 ZINC000558268927 327084217 /nfs/dbraw/zinc/08/42/17/327084217.db2.gz MYHYJWUYLFSWID-DLBZAZTESA-N 1 0 288.391 3.696 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CCC[C@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000559917622 327271215 /nfs/dbraw/zinc/27/12/15/327271215.db2.gz ARSKLKJTAZNXCQ-KFWWJZLASA-N 1 0 280.343 3.916 20 5 CHBDRO Cc1cc(C)c(C[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000048068906 327277262 /nfs/dbraw/zinc/27/72/62/327277262.db2.gz WWBWVTZKGPNLLN-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO CC[C@H](C)[C@@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)OC ZINC000560348528 327301796 /nfs/dbraw/zinc/30/17/96/327301796.db2.gz OECVJIAIGODADN-DETPVDSQSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)C[C@H]1CCCO1 ZINC000532220158 328706190 /nfs/dbraw/zinc/70/61/90/328706190.db2.gz JVUCJRMLDHBAOE-VNHYZAJKSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC3(CCC3)C2)c(Cl)c1 ZINC000182230193 329241097 /nfs/dbraw/zinc/24/10/97/329241097.db2.gz QXSXLDLOMWPSJA-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO C[C@H]1CCC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000227309571 329271990 /nfs/dbraw/zinc/27/19/90/329271990.db2.gz OOEQGYJVOSITPQ-CMPLNLGQSA-N 1 0 268.382 3.715 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCC2(CC2)C1 ZINC000186998992 329352906 /nfs/dbraw/zinc/35/29/06/329352906.db2.gz NHTGYGPHTPCXJD-CYBMUJFWSA-N 1 0 274.364 3.840 20 5 CHBDRO CCC[C@@H](NCC([NH3+])(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000423287413 330185989 /nfs/dbraw/zinc/18/59/89/330185989.db2.gz MCSKJYSYYTUELB-OAHLLOKOSA-N 1 0 293.411 3.543 20 5 CHBDRO CC1(C)CC(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000527113690 330222126 /nfs/dbraw/zinc/22/21/26/330222126.db2.gz RKNGBNBLTQZALE-FNORWQNLSA-N 1 0 274.364 3.634 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000036854547 330304738 /nfs/dbraw/zinc/30/47/38/330304738.db2.gz AWJMTCQNOKHAIF-OUCADQQQSA-N 1 0 292.379 3.518 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC2(CCC2)C1 ZINC000119331989 330373182 /nfs/dbraw/zinc/37/31/82/330373182.db2.gz ADEOYWMUEOOBNN-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO CC[C@H](C)C[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000088293583 330375644 /nfs/dbraw/zinc/37/56/44/330375644.db2.gz OBYYGJNDDQYANA-UWVGGRQHSA-N 1 0 256.371 3.571 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](C2CC2)C2CCCC2)c1 ZINC000057619665 330377032 /nfs/dbraw/zinc/37/70/32/330377032.db2.gz QRKWXYHVGRKWMH-UHFFFAOYSA-N 1 0 260.337 3.502 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCOCCC(C)C)cccc1[N+](=O)[O-] ZINC000119542238 330377596 /nfs/dbraw/zinc/37/75/96/330377596.db2.gz YZWQFHYXTDWPHN-AWEZNQCLSA-N 1 0 294.395 3.617 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@]1(C)CCCS1 ZINC000120442937 330387897 /nfs/dbraw/zinc/38/78/97/330387897.db2.gz QAYBZCAKNUKLSQ-WFASDCNBSA-N 1 0 294.420 3.840 20 5 CHBDRO CC(C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433137171 330617960 /nfs/dbraw/zinc/61/79/60/330617960.db2.gz SDCVAYGLZQFKQO-AWEZNQCLSA-N 1 0 262.353 3.563 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCCS2)cc1[N+](=O)[O-] ZINC000156355983 330730388 /nfs/dbraw/zinc/73/03/88/330730388.db2.gz VFXGPUTXBYHDBR-OCCSQVGLSA-N 1 0 294.420 3.840 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000157910395 330809963 /nfs/dbraw/zinc/80/99/63/330809963.db2.gz KBKUAFKMCWRWPZ-MWLCHTKSSA-N 1 0 268.744 3.526 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC=CCC1)CCC2 ZINC000447562759 330870109 /nfs/dbraw/zinc/87/01/09/330870109.db2.gz MWGKNFNGUUWVGS-DYVFJYSZSA-N 1 0 286.375 3.918 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC(F)(F)F)CCC2 ZINC000447587904 330871919 /nfs/dbraw/zinc/87/19/19/330871919.db2.gz SJQREPTZKBNSMJ-GFCCVEGCSA-N 1 0 288.269 3.514 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(C2CC2)CCC1 ZINC000449185672 330904590 /nfs/dbraw/zinc/90/45/90/330904590.db2.gz ICUONZBXJGXNAC-CYBMUJFWSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000449445721 330926260 /nfs/dbraw/zinc/92/62/60/330926260.db2.gz LLSXTNBKCLJKGO-NOLJZWGESA-N 1 0 288.391 3.694 20 5 CHBDRO CCC1([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000453273962 331109789 /nfs/dbraw/zinc/10/97/89/331109789.db2.gz ALAAVHOCQICSME-DZGCQCFKSA-N 1 0 288.391 3.838 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000166565731 331307462 /nfs/dbraw/zinc/30/74/62/331307462.db2.gz QBAAKKLDBBGGQJ-HNNXBMFYSA-N 1 0 288.322 3.975 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2C[C@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000462768152 331328071 /nfs/dbraw/zinc/32/80/71/331328071.db2.gz XMSSKBYSJWCHQV-HOTGVXAUSA-N 1 0 288.391 3.962 20 5 CHBDRO COc1cc(C[N@@H+]2CCCCC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000464676493 331364481 /nfs/dbraw/zinc/36/44/81/331364481.db2.gz HQTTYMWQFSYHGG-LLVKDONJSA-N 1 0 296.342 3.507 20 5 CHBDRO O=[N+]([O-])c1ccc(CSCCC[NH+]2CCCCC2)cc1 ZINC000466466025 331397753 /nfs/dbraw/zinc/39/77/53/331397753.db2.gz YGRLYKNTHCEWJF-UHFFFAOYSA-N 1 0 294.420 3.704 20 5 CHBDRO CC1=CCC[C@H](C)[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000479548404 331736807 /nfs/dbraw/zinc/73/68/07/331736807.db2.gz ZGFPLSGEVSTTRX-BBRMVZONSA-N 1 0 274.364 3.677 20 5 CHBDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CS1 ZINC000488531279 332015986 /nfs/dbraw/zinc/01/59/86/332015986.db2.gz LOTIGXQWBDBPPR-TZMCWYRMSA-N 1 0 294.420 3.605 20 5 CHBDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CS1 ZINC000488531277 332015991 /nfs/dbraw/zinc/01/59/91/332015991.db2.gz LOTIGXQWBDBPPR-OCCSQVGLSA-N 1 0 294.420 3.605 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490043089 332078069 /nfs/dbraw/zinc/07/80/69/332078069.db2.gz XSXMLYSVEGGBSF-INIZCTEOSA-N 1 0 292.379 3.616 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@H]1CCCCC(F)(F)C1 ZINC000491586696 332241526 /nfs/dbraw/zinc/24/15/26/332241526.db2.gz QBPDRRCROBSJKW-LBPRGKRZSA-N 1 0 298.333 3.900 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCCC[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492374544 332394722 /nfs/dbraw/zinc/39/47/22/332394722.db2.gz HFMPRIHVKSIHSY-CQSZACIVSA-N 1 0 292.379 3.758 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCC1 ZINC000495421932 332518458 /nfs/dbraw/zinc/51/84/58/332518458.db2.gz WPHLWEQLQITMRB-SNVBAGLBSA-N 1 0 282.771 3.569 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@H]1C ZINC000504899489 332724010 /nfs/dbraw/zinc/72/40/10/332724010.db2.gz HRPICUJFLLPNNO-JHJVBQTASA-N 1 0 294.420 3.711 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000513117801 333005257 /nfs/dbraw/zinc/00/52/57/333005257.db2.gz VIBWVHVJJGFEEQ-SMDDNHRTSA-N 1 0 262.353 3.606 20 5 CHBDRO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000513702799 333033710 /nfs/dbraw/zinc/03/37/10/333033710.db2.gz NDFFTRFWYDFIAK-CYBMUJFWSA-N 1 0 282.343 3.714 20 5 CHBDRO COC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000184673615 333131248 /nfs/dbraw/zinc/13/12/48/333131248.db2.gz UMADIHZCGDWCKL-ZDUSSCGKSA-N 1 0 292.379 3.595 20 5 CHBDRO CCCc1cccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000187128763 333168089 /nfs/dbraw/zinc/16/80/89/333168089.db2.gz CFSMITCQWUVWJU-UHFFFAOYSA-N 1 0 284.359 3.837 20 5 CHBDRO CCOC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C(C)C ZINC000189360372 333190917 /nfs/dbraw/zinc/19/09/17/333190917.db2.gz DMDGBNPBCQNELJ-UKRRQHHQSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1F ZINC000225781288 333240483 /nfs/dbraw/zinc/24/04/83/333240483.db2.gz TWDHIWHJRAEYKK-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO CCc1ccc(C[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000524426331 333362024 /nfs/dbraw/zinc/36/20/24/333362024.db2.gz AYFCFBAURGSNIQ-UHFFFAOYSA-N 1 0 298.386 3.832 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC000524607957 333368484 /nfs/dbraw/zinc/36/84/84/333368484.db2.gz CCAXXZPISCGOGV-CQSZACIVSA-N 1 0 292.379 3.758 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000037260421 333525942 /nfs/dbraw/zinc/52/59/42/333525942.db2.gz DOLRANKKZGZLRZ-RYUDHWBXSA-N 1 0 250.342 3.680 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1ccc(C)cc1[N+](=O)[O-] ZINC000037401063 333532832 /nfs/dbraw/zinc/53/28/32/333532832.db2.gz RILBWPBMNGEWEC-AWEZNQCLSA-N 1 0 293.411 3.826 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1Cc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000037565823 333535163 /nfs/dbraw/zinc/53/51/63/333535163.db2.gz GXNOQFMEHLDAMP-WFASDCNBSA-N 1 0 282.343 3.585 20 5 CHBDRO CCC[C@@H]([NH2+]C1(C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000538554086 333605893 /nfs/dbraw/zinc/60/58/93/333605893.db2.gz OPHMULHCDQYRGO-OAHLLOKOSA-N 1 0 274.364 3.968 20 5 CHBDRO CC(C)[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000539084752 333656427 /nfs/dbraw/zinc/65/64/27/333656427.db2.gz UHUJSUONMXSDDH-KRWDZBQOSA-N 1 0 290.407 3.942 20 5 CHBDRO Cc1cc(N2C[C@@H]3[C@H](C2)C3(C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000541190139 333764500 /nfs/dbraw/zinc/76/45/00/333764500.db2.gz PBRLDHFNBYSJMD-OKILXGFUSA-N 1 0 297.358 3.544 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2CCCCS2)cccc1[N+](=O)[O-] ZINC000542500337 333828748 /nfs/dbraw/zinc/82/87/48/333828748.db2.gz UGFYRHJXYUPVGB-CHWSQXEVSA-N 1 0 294.420 3.840 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000544830501 333948172 /nfs/dbraw/zinc/94/81/72/333948172.db2.gz BOCUTTXBXUHNFH-GXSJLCMTSA-N 1 0 290.285 3.976 20 5 CHBDRO CCCCOCCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000132026165 333970517 /nfs/dbraw/zinc/97/05/17/333970517.db2.gz VEZKQSGHGGZQGP-CQSZACIVSA-N 1 0 294.395 3.761 20 5 CHBDRO CC1(c2ccccc2)CC([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000545993043 334011168 /nfs/dbraw/zinc/01/11/68/334011168.db2.gz LZVNTGXZNUVPBM-UHFFFAOYSA-N 1 0 296.370 3.805 20 5 CHBDRO Cc1ccc(C[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000076342187 334079439 /nfs/dbraw/zinc/07/94/39/334079439.db2.gz GVSUGJBUDZXTDM-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO CC(C)=CCC[C@@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000547739565 334113588 /nfs/dbraw/zinc/11/35/88/334113588.db2.gz APPSDNQDVIHKOJ-CQSZACIVSA-N 1 0 276.380 3.862 20 5 CHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000135171134 334118706 /nfs/dbraw/zinc/11/87/06/334118706.db2.gz VIIABGWGWKQPBE-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000078003605 334120283 /nfs/dbraw/zinc/12/02/83/334120283.db2.gz FGWKDYUHQXPWAX-LLVKDONJSA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1ccsc1C[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000549195404 334187445 /nfs/dbraw/zinc/18/74/45/334187445.db2.gz ZNWLEELHBPQRQX-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000550079269 334212376 /nfs/dbraw/zinc/21/23/76/334212376.db2.gz LFTFTJIESUGHNM-UKRRQHHQSA-N 1 0 274.364 3.605 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1(C(C)C)CC1 ZINC000550274655 334218554 /nfs/dbraw/zinc/21/85/54/334218554.db2.gz NZOQBZQKOBOXAG-GFCCVEGCSA-N 1 0 262.353 3.742 20 5 CHBDRO CCOc1cc(C[N@H+](CC)C2CCCC2)ccc1[N+](=O)[O-] ZINC000551710784 334258660 /nfs/dbraw/zinc/25/86/60/334258660.db2.gz BHFPVALDLLWNPE-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO C[C@@H]([NH2+]CC(C1CC1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000088455753 334338787 /nfs/dbraw/zinc/33/87/87/334338787.db2.gz LCBZEFBRQVRSSM-LLVKDONJSA-N 1 0 274.364 3.682 20 5 CHBDRO C[C@@H]([NH2+]CC1Cc2ccccc2C1)c1ccccc1[N+](=O)[O-] ZINC000552899285 334350142 /nfs/dbraw/zinc/35/01/42/334350142.db2.gz NZPVAOBSTZCWPI-CYBMUJFWSA-N 1 0 296.370 3.660 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000252202375 334376681 /nfs/dbraw/zinc/37/66/81/334376681.db2.gz WNLDDEKBTUYHEQ-IMRBUKKESA-N 1 0 262.353 3.509 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1C[C@@H]1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000554097016 334412155 /nfs/dbraw/zinc/41/21/55/334412155.db2.gz UQKIQQFMJQFBOM-XQQFMLRXSA-N 1 0 284.306 3.679 20 5 CHBDRO Cc1nsc(C)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000567286423 334701117 /nfs/dbraw/zinc/70/11/17/334701117.db2.gz KNSXCTHPMLGRIV-SECBINFHSA-N 1 0 291.376 3.519 20 5 CHBDRO C[C@@H](CC(C)(C)C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000384485941 336124777 /nfs/dbraw/zinc/12/47/77/336124777.db2.gz IJTIBIDTZVSFCQ-LBPRGKRZSA-N 1 0 264.369 3.552 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000387153590 336186583 /nfs/dbraw/zinc/18/65/83/336186583.db2.gz PTZIRENFOVPIJU-GJZGRUSLSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@@H](Cc1ccoc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000344328614 534259942 /nfs/dbraw/zinc/25/99/42/534259942.db2.gz RADIQKZPMQRTJB-JTQLQIEISA-N 1 0 294.738 3.562 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000149611776 520780494 /nfs/dbraw/zinc/78/04/94/520780494.db2.gz XBCDNIOYTQGDGW-HUUCEWRRSA-N 1 0 294.420 3.921 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000149611517 521160938 /nfs/dbraw/zinc/16/09/38/521160938.db2.gz XBCDNIOYTQGDGW-CABCVRRESA-N 1 0 294.420 3.921 20 5 CHBDRO CCOC1(C)CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000298221686 521635520 /nfs/dbraw/zinc/63/55/20/521635520.db2.gz GDECSRMHAUPQDQ-CYBMUJFWSA-N 1 0 292.379 3.547 20 5 CHBDRO CCOC1(C)CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000298429332 521636079 /nfs/dbraw/zinc/63/60/79/521636079.db2.gz YGLVZWHUBGKWRJ-ZDUSSCGKSA-N 1 0 292.379 3.547 20 5 CHBDRO COC1(C[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000277063438 522642054 /nfs/dbraw/zinc/64/20/54/522642054.db2.gz IEXJAJOYUMDBSU-STQMWFEESA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000130169786 522966370 /nfs/dbraw/zinc/96/63/70/522966370.db2.gz BAFYBSJDYCFYNG-MRXNPFEDSA-N 1 0 285.347 3.573 20 5 CHBDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000290300082 523122476 /nfs/dbraw/zinc/12/24/76/523122476.db2.gz BEBUIMUQFRQEKG-INIZCTEOSA-N 1 0 299.374 3.881 20 5 CHBDRO C[C@H]([NH2+]CCCCC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000127223001 525333044 /nfs/dbraw/zinc/33/30/44/525333044.db2.gz KGCVCDIFPPEBLM-JTQLQIEISA-N 1 0 290.285 3.978 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCSC2)cc1[N+](=O)[O-] ZINC000287138563 525925649 /nfs/dbraw/zinc/92/56/49/525925649.db2.gz SAMOIUMQRFPOCL-QWHCGFSZSA-N 1 0 294.420 3.697 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCCC(F)(F)F ZINC000097988928 527355393 /nfs/dbraw/zinc/35/53/93/527355393.db2.gz LJYMIAANALIOGZ-UHFFFAOYSA-N 1 0 296.676 3.680 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000348325409 528241472 /nfs/dbraw/zinc/24/14/72/528241472.db2.gz LJIQMYJQJGLFOH-YDHLFZDLSA-N 1 0 280.343 3.916 20 5 CHBDRO CC/C=C\CC[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000343590922 528790493 /nfs/dbraw/zinc/79/04/93/528790493.db2.gz HMGCOMLTQXBDGG-YVACAVLKSA-N 1 0 262.353 3.992 20 5 CHBDRO CC(C)SCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000348300296 1125498935 /nfs/dbraw/zinc/49/89/35/1125498935.db2.gz IUZFOZJRTKLDLO-HNNXBMFYSA-N 1 0 294.420 3.703 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000162482938 1120675028 /nfs/dbraw/zinc/67/50/28/1120675028.db2.gz YJNBTYQNAZHMIJ-WCQYABFASA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)CC2CC2)cccc1[N+](=O)[O-] ZINC000164304989 1121282411 /nfs/dbraw/zinc/28/24/11/1121282411.db2.gz YYDAKQGVANBHOD-CMPLNLGQSA-N 1 0 262.353 3.742 20 5 CHBDRO CCC[N@H+](CC(C)C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232433 1132414293 /nfs/dbraw/zinc/41/42/93/1132414293.db2.gz RFTWRTODIBQWAW-CQSZACIVSA-N 1 0 278.396 3.894 20 5 CHBDRO CC[C@H](OCCC[N+](C)(C)C)c1cccc(F)c1C ZINC001224623323 1135462254 /nfs/dbraw/zinc/46/22/54/1135462254.db2.gz MGWLJQCORGIKIQ-INIZCTEOSA-N 1 0 268.396 3.698 20 5 CHBDRO C[N+](C)(C)CCO[C@H]1CCc2cc(Cl)c(Cl)cc21 ZINC001224771805 1135480562 /nfs/dbraw/zinc/48/05/62/1135480562.db2.gz SAAXPYRBJRZRGH-AWEZNQCLSA-N 1 0 289.226 3.704 20 5 CHBDRO CC1(C)CCC[C@@H](C[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001649171968 1125623173 /nfs/dbraw/zinc/62/31/73/1125623173.db2.gz ZBYOAHOTDHZQJM-OAHLLOKOSA-N 1 0 290.407 3.943 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCC2CCCCC2)cc1 ZINC000037501054 1125679445 /nfs/dbraw/zinc/67/94/45/1125679445.db2.gz RFKSJSIUIQHYOW-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO CO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000886562117 1125691190 /nfs/dbraw/zinc/69/11/90/1125691190.db2.gz QRWVRCZBWNDYOC-BFHYXJOUSA-N 1 0 292.379 3.593 20 5 CHBDRO CO[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000886562119 1125691221 /nfs/dbraw/zinc/69/12/21/1125691221.db2.gz QRWVRCZBWNDYOC-MELADBBJSA-N 1 0 292.379 3.593 20 5 CHBDRO CO[C@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000886615464 1125697818 /nfs/dbraw/zinc/69/78/18/1125697818.db2.gz HCHPRUNKFNAXJQ-BJJXKVORSA-N 1 0 292.379 3.593 20 5 CHBDRO CC1=C(c2ccco2)C[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000338340933 1126735940 /nfs/dbraw/zinc/73/59/40/1126735940.db2.gz GKMAEFVPUPFADZ-UHFFFAOYSA-N 1 0 298.342 3.867 20 5 CHBDRO CCSCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000159576929 1126746515 /nfs/dbraw/zinc/74/65/15/1126746515.db2.gz PGAXLFLYHFKNNI-UHFFFAOYSA-N 1 0 282.409 3.558 20 5 CHBDRO CC[C@@H]1[C@H](C)CC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000482515260 1126763081 /nfs/dbraw/zinc/76/30/81/1126763081.db2.gz VYLAIAMRJOYIDC-AQGQNPDFSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](C)C(C)C)cccc1[N+](=O)[O-] ZINC000484183356 1126811952 /nfs/dbraw/zinc/81/19/52/1126811952.db2.gz ZVAPDWYKELRFHE-DGCLKSJQSA-N 1 0 264.369 3.846 20 5 CHBDRO C[N+](C)(C)CCO[C@@H]1CCc2cc(Cl)c(Cl)cc21 ZINC001224771807 1126984334 /nfs/dbraw/zinc/98/43/34/1126984334.db2.gz SAAXPYRBJRZRGH-CQSZACIVSA-N 1 0 289.226 3.704 20 5 CHBDRO CC[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000323745325 1127054670 /nfs/dbraw/zinc/05/46/70/1127054670.db2.gz QZEZZDJCPBUMMP-LBPRGKRZSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccncc1 ZINC000348898598 1127133291 /nfs/dbraw/zinc/13/32/91/1127133291.db2.gz YGBKWXPTPRFBLP-FNORWQNLSA-N 1 0 297.358 3.525 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000588977949 1127208942 /nfs/dbraw/zinc/20/89/42/1127208942.db2.gz DZMAALWBHWEIQM-TZMCWYRMSA-N 1 0 274.364 3.778 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C2CC2)CC1 ZINC000590006372 1127242287 /nfs/dbraw/zinc/24/22/87/1127242287.db2.gz BEYXUAJWCAVUJO-GFCCVEGCSA-N 1 0 274.364 3.778 20 5 CHBDRO CC1(F)CC([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000590778815 1127272310 /nfs/dbraw/zinc/27/23/10/1127272310.db2.gz VTNKPTGKSBNKJQ-XHYCCTMSSA-N 1 0 292.354 3.797 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000591255940 1127290012 /nfs/dbraw/zinc/29/00/12/1127290012.db2.gz KEMDHVQUNGDQMT-NHCYSSNCSA-N 1 0 284.306 3.598 20 5 CHBDRO C[N@H+](CCCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000046087832 1127329855 /nfs/dbraw/zinc/32/98/55/1127329855.db2.gz ONTMKNMYNBXIRH-UHFFFAOYSA-N 1 0 284.359 3.659 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)CC(F)F)cc1[N+](=O)[O-] ZINC000592392236 1127344700 /nfs/dbraw/zinc/34/47/00/1127344700.db2.gz JYZVUIMSPOKIGV-GXSJLCMTSA-N 1 0 286.322 3.845 20 5 CHBDRO CC(C)C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000592387489 1127346218 /nfs/dbraw/zinc/34/62/18/1127346218.db2.gz LOWZMPCRICUAON-QGZVFWFLSA-N 1 0 299.374 3.867 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCS[C@@H]2C)cc1[N+](=O)[O-] ZINC000592379123 1127346478 /nfs/dbraw/zinc/34/64/78/1127346478.db2.gz HIEQVVRNDIEGSE-BXUZGUMPSA-N 1 0 294.420 3.702 20 5 CHBDRO CCc1ccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000058876546 1127397380 /nfs/dbraw/zinc/39/73/80/1127397380.db2.gz VDMYUECWTIKVMX-UHFFFAOYSA-N 1 0 284.359 3.789 20 5 CHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000358196870 1127407875 /nfs/dbraw/zinc/40/78/75/1127407875.db2.gz FKNCDYVWYKFOIK-AWEZNQCLSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000358366238 1127417772 /nfs/dbraw/zinc/41/77/72/1127417772.db2.gz KDWNTMFNGPOUTF-YVEFUNNKSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000358366237 1127417851 /nfs/dbraw/zinc/41/78/51/1127417851.db2.gz KDWNTMFNGPOUTF-SJKOYZFVSA-N 1 0 297.358 3.792 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C)SC2)cc1[N+](=O)[O-] ZINC000594497776 1127417990 /nfs/dbraw/zinc/41/79/90/1127417990.db2.gz GEEXERIIBDTGIS-SGMGOOAPSA-N 1 0 294.420 3.838 20 5 CHBDRO C[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000358373377 1127418600 /nfs/dbraw/zinc/41/86/00/1127418600.db2.gz DGCNGKKPKULYIL-PXAZEXFGSA-N 1 0 297.358 3.792 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594503244 1127419147 /nfs/dbraw/zinc/41/91/47/1127419147.db2.gz SVDNQKJPLHIBON-BLLLJJGKSA-N 1 0 297.358 3.636 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2CCC3(CC3(F)F)CC2)c1 ZINC000594985541 1127443675 /nfs/dbraw/zinc/44/36/75/1127443675.db2.gz XAZUGWLXSSGVSS-UHFFFAOYSA-N 1 0 296.317 3.652 20 5 CHBDRO CC[C@H]([NH2+]CC1(C(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000359004630 1127444393 /nfs/dbraw/zinc/44/43/93/1127444393.db2.gz UOAUYXKRTLLHCL-LBPRGKRZSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@]1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1(F)F ZINC000595082758 1127453470 /nfs/dbraw/zinc/45/34/70/1127453470.db2.gz XCGNVGWCIMPEQC-UONOGXRCSA-N 1 0 296.317 3.607 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[C@H](C)O2)cccc1[N+](=O)[O-] ZINC000595082000 1127453556 /nfs/dbraw/zinc/45/35/56/1127453556.db2.gz VKENFWAXILVDSA-UBHSHLNASA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC000595090373 1127454181 /nfs/dbraw/zinc/45/41/81/1127454181.db2.gz BBJUWTVKFKYANQ-ZWNOBZJWSA-N 1 0 298.333 3.845 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595090736 1127454192 /nfs/dbraw/zinc/45/41/92/1127454192.db2.gz FNVJUUKBNFXVNF-JOYOIKCWSA-N 1 0 284.306 3.537 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cccc([N+](=O)[O-])c1 ZINC000595090780 1127454281 /nfs/dbraw/zinc/45/42/81/1127454281.db2.gz QYLIPNWWCQRPQN-DIFFPNOSSA-N 1 0 298.342 3.639 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCc2ccco2)cc1[N+](=O)[O-] ZINC000595093482 1127454706 /nfs/dbraw/zinc/45/47/06/1127454706.db2.gz KEPAQQUAXMAOEN-CYBMUJFWSA-N 1 0 288.347 3.780 20 5 CHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)C1 ZINC000359302887 1127457506 /nfs/dbraw/zinc/45/75/06/1127457506.db2.gz PDALCEXQNIQGRG-CZUORRHYSA-N 1 0 274.364 3.607 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](CC2CC=CC2)C2CC2)c1 ZINC000595350528 1127460019 /nfs/dbraw/zinc/46/00/19/1127460019.db2.gz BSLHQAWFKFUFMR-UHFFFAOYSA-N 1 0 272.348 3.525 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[C@H]3C[C@H]3C2)cc1[N+](=O)[O-] ZINC000595419270 1127462313 /nfs/dbraw/zinc/46/23/13/1127462313.db2.gz JNCMSZDTJFNWMA-RJZRQDKASA-N 1 0 274.364 3.600 20 5 CHBDRO CCC(CC)CCCN(C)Cc1onc(C)c1[N+](=O)[O-] ZINC000595836998 1127477519 /nfs/dbraw/zinc/47/75/19/1127477519.db2.gz ZREVGRQBNVGTMF-UHFFFAOYSA-N 1 0 283.372 3.539 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1CC(F)(F)C1)CCC2 ZINC000293665277 1127511567 /nfs/dbraw/zinc/51/15/67/1127511567.db2.gz MGOZTALCNWAZKW-AWEZNQCLSA-N 1 0 296.317 3.607 20 5 CHBDRO C[C@H]1CC[C@H]1[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602651883 1127600720 /nfs/dbraw/zinc/60/07/20/1127600720.db2.gz AEVDWYOWZAOVHF-GZMMTYOYSA-N 1 0 288.269 3.502 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccoc2)cc1[N+](=O)[O-] ZINC000361918860 1127599288 /nfs/dbraw/zinc/59/92/88/1127599288.db2.gz LZFIUMRLZMAALL-STQMWFEESA-N 1 0 288.347 3.778 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000598680111 1127630981 /nfs/dbraw/zinc/63/09/81/1127630981.db2.gz UJFWBQGRIPZHQV-PWSUYJOCSA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@H]1CC1(F)F ZINC000598680476 1127631916 /nfs/dbraw/zinc/63/19/16/1127631916.db2.gz YFUGBNZHTFQCGQ-QWRGUYRKSA-N 1 0 284.306 3.599 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC[C@H]1CC1(F)F)CCC2 ZINC000598680352 1127631971 /nfs/dbraw/zinc/63/19/71/1127631971.db2.gz XQAGTHYPLMWPCZ-SMDDNHRTSA-N 1 0 296.317 3.607 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC(C)C1 ZINC000598676287 1127632720 /nfs/dbraw/zinc/63/27/20/1127632720.db2.gz GMUFESUHOZCHJR-MOKVOYLWSA-N 1 0 276.380 3.552 20 5 CHBDRO CC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000061109026 1127650949 /nfs/dbraw/zinc/65/09/49/1127650949.db2.gz SDNXWASUQSIDNI-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1CC2(CCC2)C1 ZINC000593688932 1127660775 /nfs/dbraw/zinc/66/07/75/1127660775.db2.gz YQGRJYYVHNKAOH-ZZXKWVIFSA-N 1 0 272.348 3.530 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C2(C3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000593721351 1127665882 /nfs/dbraw/zinc/66/58/82/1127665882.db2.gz PKOLVSMKOVZFRB-GFCCVEGCSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C2CC3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000593720431 1127665996 /nfs/dbraw/zinc/66/59/96/1127665996.db2.gz KXQBSAJUHQHKNP-LBPRGKRZSA-N 1 0 274.364 3.887 20 5 CHBDRO CCC(CC)C[N@H+](CC)Cc1ccccc1[N+](=O)[O-] ZINC000603849548 1127676230 /nfs/dbraw/zinc/67/62/30/1127676230.db2.gz DQNQJUAQUMGGTE-UHFFFAOYSA-N 1 0 264.369 3.853 20 5 CHBDRO CCC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000603900931 1127681463 /nfs/dbraw/zinc/68/14/63/1127681463.db2.gz IIOAHYGLCVIONB-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000604011974 1127689637 /nfs/dbraw/zinc/68/96/37/1127689637.db2.gz BHOQLRHWDUKMLS-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO CCCC1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000230157438 1127744873 /nfs/dbraw/zinc/74/48/73/1127744873.db2.gz SAGJPVXPZCKYKC-UHFFFAOYSA-N 1 0 282.771 3.918 20 5 CHBDRO CC[C@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000409454256 1127770622 /nfs/dbraw/zinc/77/06/22/1127770622.db2.gz AKTPYPVOUYXTKH-NSHDSACASA-N 1 0 274.320 3.743 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccccc1[N+](=O)[O-] ZINC000429795846 1127904975 /nfs/dbraw/zinc/90/49/75/1127904975.db2.gz ZTOXBWUCNRWPRL-MNOVXSKESA-N 1 0 284.306 3.681 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000539500756 1127925935 /nfs/dbraw/zinc/92/59/35/1127925935.db2.gz OZOFEJZYCHAHQZ-KCQAQPDRSA-N 1 0 274.364 3.653 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1C2CCC1CC2 ZINC000539802751 1127939815 /nfs/dbraw/zinc/93/98/15/1127939815.db2.gz MWGOVJHIBAVIQQ-HIFPTAJRSA-N 1 0 260.337 3.591 20 5 CHBDRO Cc1ccc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000539827069 1127945105 /nfs/dbraw/zinc/94/51/05/1127945105.db2.gz WDLUVIJUQPEHSO-GJZGRUSLSA-N 1 0 274.364 3.525 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000467997647 1127986488 /nfs/dbraw/zinc/98/64/88/1127986488.db2.gz DVZZNIMNSMVOOO-CHWSQXEVSA-N 1 0 276.380 3.552 20 5 CHBDRO CC[C@]1(C)CC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468138131 1127994829 /nfs/dbraw/zinc/99/48/29/1127994829.db2.gz KHUBSAJGCZYWAD-IUODEOHRSA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC[C@@H](C)C1 ZINC000468257578 1127999552 /nfs/dbraw/zinc/99/95/52/1127999552.db2.gz SUNANIUJYJEGTC-CHWSQXEVSA-N 1 0 262.353 3.778 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCCC1 ZINC000468640839 1128014169 /nfs/dbraw/zinc/01/41/69/1128014169.db2.gz IZNVJPCZIAQMID-FMIVXFBMSA-N 1 0 260.337 3.530 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CC=CCC1 ZINC000468640196 1128014799 /nfs/dbraw/zinc/01/47/99/1128014799.db2.gz VRROCMNIAXJZTD-WVUXNXBLSA-N 1 0 272.348 3.696 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C(C)C ZINC000468656645 1128015011 /nfs/dbraw/zinc/01/50/11/1128015011.db2.gz YNQUSVGTUARFFA-CZAWJFPGSA-N 1 0 276.380 3.880 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCCCS1 ZINC000541568350 1128028768 /nfs/dbraw/zinc/02/87/68/1128028768.db2.gz NDMGTCGTOASTIL-GXTWGEPZSA-N 1 0 294.420 3.840 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000469127886 1128035833 /nfs/dbraw/zinc/03/58/33/1128035833.db2.gz YVCSGALHNQZPNH-DIECRNLCSA-N 1 0 274.364 3.776 20 5 CHBDRO CCC(CC)[N@H+](CCOC)Cc1ccc([N+](=O)[O-])cc1C ZINC000541772239 1128038705 /nfs/dbraw/zinc/03/87/05/1128038705.db2.gz XKFZSQSHBKEFJV-UHFFFAOYSA-N 1 0 294.395 3.540 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CC(C)(C)C ZINC000470173571 1128064154 /nfs/dbraw/zinc/06/41/54/1128064154.db2.gz CTXUSSFBJGLCFS-UKTHLTGXSA-N 1 0 276.380 3.976 20 5 CHBDRO CC[C@@H](C)[N@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470179135 1128065168 /nfs/dbraw/zinc/06/51/68/1128065168.db2.gz SSXREKYQKCHKEE-CNELAYHGSA-N 1 0 262.353 3.728 20 5 CHBDRO Cc1c(C[NH+]2[C@@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000609157436 1128099299 /nfs/dbraw/zinc/09/92/99/1128099299.db2.gz OVSNFMIKUPJWHI-RYUDHWBXSA-N 1 0 262.353 3.666 20 5 CHBDRO CCOc1cc(C[N@H+](C)[C@@H](C)C2(C)CC2)ccc1[N+](=O)[O-] ZINC000492793594 1128113718 /nfs/dbraw/zinc/11/37/18/1128113718.db2.gz VSQWVWFOFXTAPR-LBPRGKRZSA-N 1 0 292.379 3.614 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C(C1CC1)C1CC1 ZINC000761506028 1128132656 /nfs/dbraw/zinc/13/26/56/1128132656.db2.gz MJNXINQIRKJRJW-UHFFFAOYSA-N 1 0 294.782 3.869 20 5 CHBDRO CC(C)[C@@H]1CC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493382860 1128140445 /nfs/dbraw/zinc/14/04/45/1128140445.db2.gz IWCDEHJFFGKEHV-LLVKDONJSA-N 1 0 282.771 3.726 20 5 CHBDRO CC[C@H](C)C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000054467484 1128177163 /nfs/dbraw/zinc/17/71/63/1128177163.db2.gz NOYRQVVVZBPFJK-FZMZJTMJSA-N 1 0 250.342 3.682 20 5 CHBDRO Cc1cscc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000094877193 1128245873 /nfs/dbraw/zinc/24/58/73/1128245873.db2.gz VNEACNVXBODKTJ-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO CC(C)c1ccc(C[N@H+](C)[C@@H]2CCSC2)cc1[N+](=O)[O-] ZINC000130566991 1128247085 /nfs/dbraw/zinc/24/70/85/1128247085.db2.gz LDQIBJIFTJAJST-CYBMUJFWSA-N 1 0 294.420 3.656 20 5 CHBDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000494843377 1128207021 /nfs/dbraw/zinc/20/70/21/1128207021.db2.gz AJPIWQOKBCKSAC-MRVPVSSYSA-N 1 0 296.314 3.867 20 5 CHBDRO CSC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000193326309 1128271923 /nfs/dbraw/zinc/27/19/23/1128271923.db2.gz HNRFBKSIZRUTAC-LLVKDONJSA-N 1 0 280.393 3.531 20 5 CHBDRO CC(C)[NH+](CCSCc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000762204242 1128280318 /nfs/dbraw/zinc/28/03/18/1128280318.db2.gz STFDIDCGHHXHFU-UHFFFAOYSA-N 1 0 296.436 3.947 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000495434748 1128283051 /nfs/dbraw/zinc/28/30/51/1128283051.db2.gz TWIDVHSEBXMMIN-ZDUSSCGKSA-N 1 0 282.771 3.569 20 5 CHBDRO C/C(=C\c1ccccc1)C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000609222594 1128327813 /nfs/dbraw/zinc/32/78/13/1128327813.db2.gz SQPXFFAXTDSYKT-FYWRMAATSA-N 1 0 296.370 3.830 20 5 CHBDRO C[C@H](C[N@@H+]1Cc2ccc([N+](=O)[O-])cc2C1)C(C)(C)C ZINC001327187823 1128345088 /nfs/dbraw/zinc/34/50/88/1128345088.db2.gz NGJAEKXTKABHSZ-LLVKDONJSA-N 1 0 262.353 3.593 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1CF)c1ccc([N+](=O)[O-])cc1 ZINC000932176649 1128398531 /nfs/dbraw/zinc/39/85/31/1128398531.db2.gz KVMPYZLZJJCHKK-GFCCVEGCSA-N 1 0 288.322 3.915 20 5 CHBDRO C[C@H]1CCC[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000798962432 1128422584 /nfs/dbraw/zinc/42/25/84/1128422584.db2.gz MGDDNDUWAJNSDO-JQWIXIFHSA-N 1 0 282.771 3.774 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000566678213 1128549045 /nfs/dbraw/zinc/54/90/45/1128549045.db2.gz XEWBOEAFVDDXKF-DRZSPHRISA-N 1 0 266.316 3.526 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000037487229 1128562714 /nfs/dbraw/zinc/56/27/14/1128562714.db2.gz RMNQPXIBHPTOLU-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccco1 ZINC000569848205 1128610731 /nfs/dbraw/zinc/61/07/31/1128610731.db2.gz OQXPNQXJSSZKEU-NSHDSACASA-N 1 0 299.330 3.562 20 5 CHBDRO COC1([C@@H](C)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CCC1 ZINC000570300934 1128620487 /nfs/dbraw/zinc/62/04/87/1128620487.db2.gz MPOHEDZROSHLJG-CHWSQXEVSA-N 1 0 292.379 3.511 20 5 CHBDRO CC1(C)C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@H]2CCC[C@H]21 ZINC000557055457 1128663826 /nfs/dbraw/zinc/66/38/26/1128663826.db2.gz NEUDQBYXNCUSSX-NEPJUHHUSA-N 1 0 280.393 3.667 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@]12C[C@@H]1CCCC2 ZINC000601149854 1128701128 /nfs/dbraw/zinc/70/11/28/1128701128.db2.gz QSMRNRMTXYGZHF-YOFOWSBGSA-N 1 0 272.348 3.530 20 5 CHBDRO O=[N+]([O-])c1sccc1NCCCCC[NH+]1CCCCC1 ZINC000609516994 1128716878 /nfs/dbraw/zinc/71/68/78/1128716878.db2.gz BTZAPNHPVUHXNT-UHFFFAOYSA-N 1 0 297.424 3.724 20 5 CHBDRO CC[C@H](C[NH+]1CCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000609839851 1128729106 /nfs/dbraw/zinc/72/91/06/1128729106.db2.gz CEONDAUPZZLNOL-LLVKDONJSA-N 1 0 297.786 3.535 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000430194005 1117840639 /nfs/dbraw/zinc/84/06/39/1117840639.db2.gz HSARYLYYBFSMDN-TZMCWYRMSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1cc(NC[C@H](C)[N@@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000510096000 1117882720 /nfs/dbraw/zinc/88/27/20/1117882720.db2.gz VQUJWRPEDIFWKW-KGLIPLIRSA-N 1 0 291.395 3.578 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000610215371 1117882731 /nfs/dbraw/zinc/88/27/31/1117882731.db2.gz JETLCCMMILJNBH-OLZOCXBDSA-N 1 0 262.353 3.605 20 5 CHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@@H]3CCCC34CC4)c2c1 ZINC000579252844 1128742804 /nfs/dbraw/zinc/74/28/04/1128742804.db2.gz GCXFOMHKINWDSY-MRXNPFEDSA-N 1 0 299.374 3.541 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCCC23CCC3)ccc1[N+](=O)[O-] ZINC000444776752 1117930479 /nfs/dbraw/zinc/93/04/79/1117930479.db2.gz DBQXHUDGLHQRGQ-UHFFFAOYSA-N 1 0 290.363 3.512 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000336812841 1117938162 /nfs/dbraw/zinc/93/81/62/1117938162.db2.gz SILHQICNXJTRQQ-UONOGXRCSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CCc3ccccc3CC2)cc1 ZINC001648882491 1118269863 /nfs/dbraw/zinc/26/98/63/1118269863.db2.gz QXIRONNORXJMPC-UHFFFAOYSA-N 1 0 296.370 3.632 20 5 CHBDRO CCC[C@@H](C)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000579458369 1118379904 /nfs/dbraw/zinc/37/99/04/1118379904.db2.gz FLQMKMZSNOGHIO-CYBMUJFWSA-N 1 0 264.369 3.505 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc2ccccc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000610420466 1118421437 /nfs/dbraw/zinc/42/14/37/1118421437.db2.gz PZTICJQHAAITOC-GFCCVEGCSA-N 1 0 295.342 3.927 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000086642631 1118442869 /nfs/dbraw/zinc/44/28/69/1118442869.db2.gz GMEYVVDVLAXLDK-UHFFFAOYSA-N 1 0 268.332 3.792 20 5 CHBDRO Cc1c(C[NH2+]C2C[C@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000084974850 1118480441 /nfs/dbraw/zinc/48/04/41/1118480441.db2.gz QQADEAKDIOIZLQ-VXGBXAGGSA-N 1 0 276.380 3.818 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1C[C@H](C)C[C@@H](C)C1 ZINC000084975422 1118480919 /nfs/dbraw/zinc/48/09/19/1118480919.db2.gz AUALMPWHNKTTSQ-VXGBXAGGSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC23CCCC3)cccc1[N+](=O)[O-] ZINC000616357494 1128787346 /nfs/dbraw/zinc/78/73/46/1128787346.db2.gz QBDUCTDDPWMGQP-OAHLLOKOSA-N 1 0 274.364 3.716 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](C)C2CC2)cccc1[N+](=O)[O-] ZINC000610805337 1118893559 /nfs/dbraw/zinc/89/35/59/1118893559.db2.gz SCFHXBLEWIONPQ-CMPLNLGQSA-N 1 0 262.353 3.600 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)c1ccncc1 ZINC000610830961 1118898667 /nfs/dbraw/zinc/89/86/67/1118898667.db2.gz PBYZFOIYDOBOCA-KBPBESRZSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000510991651 1118907700 /nfs/dbraw/zinc/90/77/00/1118907700.db2.gz JOSPKFCZWTUESP-HUUCEWRRSA-N 1 0 274.364 3.572 20 5 CHBDRO C[C@@H]1CC([NH2+]Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000084461584 1118945092 /nfs/dbraw/zinc/94/50/92/1118945092.db2.gz WNLDDEKBTUYHEQ-RYUDHWBXSA-N 1 0 262.353 3.509 20 5 CHBDRO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1ccccc1 ZINC000033394624 1118964770 /nfs/dbraw/zinc/96/47/70/1118964770.db2.gz UFUUFCDTWBSUSW-XFFZJAGNSA-N 1 0 296.370 3.783 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)Cc1cccnc1 ZINC000934234770 1118985387 /nfs/dbraw/zinc/98/53/87/1118985387.db2.gz QOMDWMUODUMWJR-KGLIPLIRSA-N 1 0 299.374 3.580 20 5 CHBDRO Cc1ccc(C[NH2+]C2(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000068979795 1128814990 /nfs/dbraw/zinc/81/49/90/1128814990.db2.gz PKTAIXJWEZIJCV-UHFFFAOYSA-N 1 0 282.343 3.682 20 5 CHBDRO CC(C)CCC[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511125865 1119080733 /nfs/dbraw/zinc/08/07/33/1119080733.db2.gz NNUAEWPIAODJCW-UHFFFAOYSA-N 1 0 264.369 3.505 20 5 CHBDRO CC[C@@H]([NH2+]C1CC(CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000342689221 1119127852 /nfs/dbraw/zinc/12/78/52/1119127852.db2.gz NGZRAMCJMYTFNB-ABIUDSBCSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001167655899 1119301291 /nfs/dbraw/zinc/30/12/91/1119301291.db2.gz CNNJDFCVSFQLTQ-LLVKDONJSA-N 1 0 282.771 3.726 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH+](CC(C)C)CC(C)C ZINC000248125857 1119317941 /nfs/dbraw/zinc/31/79/41/1119317941.db2.gz HJQAOXVKBWFQIQ-UHFFFAOYSA-N 1 0 294.395 3.717 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C2(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000584007723 1119454931 /nfs/dbraw/zinc/45/49/31/1119454931.db2.gz JRBFKTLEJNDPEJ-UHFFFAOYSA-N 1 0 276.380 3.996 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000219701529 1119511539 /nfs/dbraw/zinc/51/15/39/1119511539.db2.gz GCPYBZDXSAHDSB-OCCSQVGLSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000179136740 1119597476 /nfs/dbraw/zinc/59/74/76/1119597476.db2.gz MGKXVVGQVSFTGD-VHSXEESVSA-N 1 0 291.376 3.772 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000612803938 1119827675 /nfs/dbraw/zinc/82/76/75/1119827675.db2.gz NEDGNCVKCPZNGS-VIFPVBQESA-N 1 0 294.248 3.555 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)cccc1[N+](=O)[O-] ZINC000414211983 1119941982 /nfs/dbraw/zinc/94/19/82/1119941982.db2.gz PJIPWFBKRCOSFT-NEBZKDRISA-N 1 0 274.364 3.742 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)cc1[N+](=O)[O-] ZINC000414213370 1119942114 /nfs/dbraw/zinc/94/21/14/1119942114.db2.gz QZAOTOJYNAISNL-ATGSNQNLSA-N 1 0 274.364 3.742 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCO[C@H]1CC)c1cccc([N+](=O)[O-])c1 ZINC000414217990 1119944295 /nfs/dbraw/zinc/94/42/95/1119944295.db2.gz ZCVOTYCLIWENSV-XHSDSOJGSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)C1(OC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000414300580 1119971357 /nfs/dbraw/zinc/97/13/57/1119971357.db2.gz AOXTVVHVQKBWGO-WFASDCNBSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCC(F)(F)F)c(Cl)c1 ZINC000149060154 1120001382 /nfs/dbraw/zinc/00/13/82/1120001382.db2.gz VRGZOLPZBFNLRG-UHFFFAOYSA-N 1 0 296.676 3.680 20 5 CHBDRO Cc1occc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000414367243 1120001450 /nfs/dbraw/zinc/00/14/50/1120001450.db2.gz DHNVNTCITFUWFN-UHFFFAOYSA-N 1 0 288.347 3.907 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)CC2CC2)cc1[N+](=O)[O-] ZINC000153763999 1120172287 /nfs/dbraw/zinc/17/22/87/1120172287.db2.gz ICFPZCFQEITOSU-NWDGAFQWSA-N 1 0 292.379 3.833 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)CC2CC2)cc1[N+](=O)[O-] ZINC000153764282 1120172959 /nfs/dbraw/zinc/17/29/59/1120172959.db2.gz ICFPZCFQEITOSU-NEPJUHHUSA-N 1 0 292.379 3.833 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1NCC[NH+]1CCCCCC1 ZINC000040433115 1120176238 /nfs/dbraw/zinc/17/62/38/1120176238.db2.gz MZEPZWPHKZTFEQ-UHFFFAOYSA-N 1 0 297.786 3.536 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCC1CC(F)(F)C1 ZINC000565217710 1120197492 /nfs/dbraw/zinc/19/74/92/1120197492.db2.gz IZZCEYNNJXFYPS-ZDUSSCGKSA-N 1 0 296.317 3.607 20 5 CHBDRO C[C@H]1CC[C@]2(CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542882664 1120220602 /nfs/dbraw/zinc/22/06/02/1120220602.db2.gz CENHLVYXYMNLBE-YOEHRIQHSA-N 1 0 288.391 3.649 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000584543426 1120232859 /nfs/dbraw/zinc/23/28/59/1120232859.db2.gz JYUWKJMSSVPAGX-GFCCVEGCSA-N 1 0 294.782 3.870 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492788073 1120249200 /nfs/dbraw/zinc/24/92/00/1120249200.db2.gz HQSQJKIUSRRMQT-STQMWFEESA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1occc1C[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000254988156 1120306755 /nfs/dbraw/zinc/30/67/55/1120306755.db2.gz SOWCGWLCUHDENU-ALCCZGGFSA-N 1 0 286.331 3.641 20 5 CHBDRO C[C@H](c1cccs1)N(C)Cc1ccc([N+](=O)[O-])cc1F ZINC000313706515 1120406265 /nfs/dbraw/zinc/40/62/65/1120406265.db2.gz TUGYRNNXWJDXJJ-SNVBAGLBSA-N 1 0 294.351 3.988 20 5 CHBDRO CSCCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417313319 1120425803 /nfs/dbraw/zinc/42/58/03/1120425803.db2.gz PBQJTPUBAFMUKB-HNNXBMFYSA-N 1 0 294.420 3.705 20 5 CHBDRO CO[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)CC(C)C ZINC000417357715 1120435673 /nfs/dbraw/zinc/43/56/73/1120435673.db2.gz HDPOLWKYINQZKW-UONOGXRCSA-N 1 0 294.395 3.615 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCCCc2ccccc2)c1 ZINC000131013943 1120457824 /nfs/dbraw/zinc/45/78/24/1120457824.db2.gz KXSIGZODHQKVJV-UHFFFAOYSA-N 1 0 284.359 3.707 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)CCC(C)C)cccc1[N+](=O)[O-] ZINC000069234314 1120496816 /nfs/dbraw/zinc/49/68/16/1120496816.db2.gz TXTUHFVJAWVKOH-LBPRGKRZSA-N 1 0 264.369 3.818 20 5 CHBDRO C[N@H+](CCCNc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000037859950 1120497310 /nfs/dbraw/zinc/49/73/10/1120497310.db2.gz CGSYRSGAAZXOLT-UHFFFAOYSA-N 1 0 291.395 3.661 20 5 CHBDRO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])C1CCCC1 ZINC000070306627 1120529983 /nfs/dbraw/zinc/52/99/83/1120529983.db2.gz LBPWHYUWHHINEE-JTQLQIEISA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1csc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000379277552 1120534432 /nfs/dbraw/zinc/53/44/32/1120534432.db2.gz PHDBXLBTVYVDGI-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc(F)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000922537224 1120547945 /nfs/dbraw/zinc/54/79/45/1120547945.db2.gz CDEALVQPPGNKCU-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCc2cccs2)cc1[N+](=O)[O-] ZINC000020091127 1120582756 /nfs/dbraw/zinc/58/27/56/1120582756.db2.gz XTCCSSNRQRDPDQ-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO Cc1cc(N2CCC[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302187001 1120650384 /nfs/dbraw/zinc/65/03/84/1120650384.db2.gz PUSHETATCDCRQM-LLVKDONJSA-N 1 0 285.347 3.688 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH+](C1CCC1)C1CCC1 ZINC000429132176 1120671887 /nfs/dbraw/zinc/67/18/87/1120671887.db2.gz LISOGPAMPOYUST-UHFFFAOYSA-N 1 0 260.337 3.502 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)C1 ZINC000227398485 1120693841 /nfs/dbraw/zinc/69/38/41/1120693841.db2.gz AAJFWANJSHYBTM-SUNKGSAMSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c1 ZINC000313490470 1120741278 /nfs/dbraw/zinc/74/12/78/1120741278.db2.gz HHHLPKIFNIFXCJ-TXEJJXNPSA-N 1 0 294.782 3.870 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(C)C ZINC000112629142 1120839962 /nfs/dbraw/zinc/83/99/62/1120839962.db2.gz FUSKAPLONTWTNC-ZDUSSCGKSA-N 1 0 264.369 3.504 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000567548695 1120843634 /nfs/dbraw/zinc/84/36/34/1120843634.db2.gz NEESUPSUCUGOAX-GFCCVEGCSA-N 1 0 280.368 3.614 20 5 CHBDRO CCSCC[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072900531 1120949851 /nfs/dbraw/zinc/94/98/51/1120949851.db2.gz WSMNYURVZPAYQK-LBPRGKRZSA-N 1 0 282.409 3.558 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000343979483 1121029660 /nfs/dbraw/zinc/02/96/60/1121029660.db2.gz NHZJAMIEMQLFRY-DOMZBBRYSA-N 1 0 285.347 3.792 20 5 CHBDRO CS[C@@H]1CCCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246577426 1121311604 /nfs/dbraw/zinc/31/16/04/1121311604.db2.gz LUTILWQSUCVTOI-SWLSCSKDSA-N 1 0 294.420 3.873 20 5 CHBDRO CC[C@H]([NH2+]CC[C@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000704774872 1121367806 /nfs/dbraw/zinc/36/78/06/1121367806.db2.gz ZYUBZMPCAHWNTD-WFASDCNBSA-N 1 0 294.420 3.779 20 5 CHBDRO Cc1cc(Nc2cc([N+](=O)[O-])ccc2F)c2ccccc2[nH+]1 ZINC001175735178 1121441377 /nfs/dbraw/zinc/44/13/77/1121441377.db2.gz UWCBQAKHEAEZAM-UHFFFAOYSA-N 1 0 297.289 3.756 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)C1(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000706956639 1121446040 /nfs/dbraw/zinc/44/60/40/1121446040.db2.gz LZPQLZGAEXGROA-FZMZJTMJSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2C3CCCC2CCC3)cc1F ZINC000707156332 1121450378 /nfs/dbraw/zinc/45/03/78/1121450378.db2.gz RFWXVRNBYDRGGO-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000482507478 1121498460 /nfs/dbraw/zinc/49/84/60/1121498460.db2.gz JNLYCRAWSMKSHQ-OCCSQVGLSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]1CC2(CCC2)C[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000433020751 1121520360 /nfs/dbraw/zinc/52/03/60/1121520360.db2.gz DIVYSIPSQKBRST-HJHHMULASA-N 1 0 286.375 3.873 20 5 CHBDRO CCCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433134469 1121587719 /nfs/dbraw/zinc/58/77/19/1121587719.db2.gz KTRLQPNJVNDFQQ-AWEZNQCLSA-N 1 0 262.353 3.707 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000611408978 1121644631 /nfs/dbraw/zinc/64/46/31/1121644631.db2.gz PUGGAUVNYQYYHJ-QWRGUYRKSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C/C=C/c2cccc(F)c2)cc1 ZINC001177415823 1121728259 /nfs/dbraw/zinc/72/82/59/1121728259.db2.gz BPOVBAVPKOKZBR-DUXPYHPUSA-N 1 0 286.306 3.537 20 5 CHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]21 ZINC000542974916 1121737649 /nfs/dbraw/zinc/73/76/49/1121737649.db2.gz FWFFUPCSSBJMNE-KBRIMQKVSA-N 1 0 288.391 3.648 20 5 CHBDRO Cc1c(C[N@@H+]2CCCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000730264584 1121800042 /nfs/dbraw/zinc/80/00/42/1121800042.db2.gz JNYSOXLMXCRSQB-UHFFFAOYSA-N 1 0 296.370 3.852 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000037775711 1129014655 /nfs/dbraw/zinc/01/46/55/1129014655.db2.gz IEYDXLSMNXNLEF-CHWSQXEVSA-N 1 0 260.337 3.602 20 5 CHBDRO C[N@H+](CCNc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000071377559 1122048502 /nfs/dbraw/zinc/04/85/02/1122048502.db2.gz MOUDWLMYUUEHRR-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000034994313 1122135751 /nfs/dbraw/zinc/13/57/51/1122135751.db2.gz JRUBGHCJUKBWMC-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C1(C)CC1 ZINC000774282303 1122153154 /nfs/dbraw/zinc/15/31/54/1122153154.db2.gz DBUQJLIWPULVSK-ABAIWWIYSA-N 1 0 274.364 3.750 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC12CCCC2 ZINC001182753480 1122184828 /nfs/dbraw/zinc/18/48/28/1122184828.db2.gz INRYVVHOFIMJDM-UHFFFAOYSA-N 1 0 274.364 3.730 20 5 CHBDRO Cc1ccc(C[NH2+]C2CCC3(CC3)CC2)cc1[N+](=O)[O-] ZINC000434776069 1122410975 /nfs/dbraw/zinc/41/09/75/1122410975.db2.gz MCWADGWDMOUGFO-UHFFFAOYSA-N 1 0 274.364 3.716 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCSC(C)(C)CC1 ZINC000435050932 1122431298 /nfs/dbraw/zinc/43/12/98/1122431298.db2.gz VJCUJWHGJAMSDP-UHFFFAOYSA-N 1 0 294.420 3.621 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001167959357 1122474201 /nfs/dbraw/zinc/47/42/01/1122474201.db2.gz OUUGXIODJJHHQZ-ZDUSSCGKSA-N 1 0 292.379 3.616 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001167959355 1122474260 /nfs/dbraw/zinc/47/42/60/1122474260.db2.gz OUUGXIODJJHHQZ-CYBMUJFWSA-N 1 0 292.379 3.616 20 5 CHBDRO CC(C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC001191495426 1122602162 /nfs/dbraw/zinc/60/21/62/1122602162.db2.gz MBZMIGLIGATXDT-UHFFFAOYSA-N 1 0 294.370 3.992 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001191540975 1122604550 /nfs/dbraw/zinc/60/45/50/1122604550.db2.gz KSHFNNOHYRJRAM-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-])C1(C)CC1 ZINC000437532848 1122638992 /nfs/dbraw/zinc/63/89/92/1122638992.db2.gz DIKSUOWXGVEMSY-SNVBAGLBSA-N 1 0 282.771 3.869 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1C ZINC001193413275 1122690474 /nfs/dbraw/zinc/69/04/74/1122690474.db2.gz MJIUBKZDGMADSN-CZUORRHYSA-N 1 0 276.380 3.995 20 5 CHBDRO OCC[NH2+]Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000017309874 1122741144 /nfs/dbraw/zinc/74/11/44/1122741144.db2.gz LAYDFIKOQFLREV-UHFFFAOYSA-N 1 0 285.774 3.728 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2[nH]1 ZINC000775631181 1122834390 /nfs/dbraw/zinc/83/43/90/1122834390.db2.gz ZBHJVGXSNAWXKA-GFCCVEGCSA-N 1 0 295.342 3.927 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001195269473 1122859115 /nfs/dbraw/zinc/85/91/15/1122859115.db2.gz MGCUIUSSHILYCZ-QWHCGFSZSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c1 ZINC000507665542 1122983621 /nfs/dbraw/zinc/98/36/21/1122983621.db2.gz KVDFQOFNDHNEAZ-INIZCTEOSA-N 1 0 282.343 3.584 20 5 CHBDRO Cc1[nH+]ccc(N(C)Cc2ccccc2[N+](=O)[O-])c1Cl ZINC000350249594 1122992837 /nfs/dbraw/zinc/99/28/37/1122992837.db2.gz MFVGIELAVXZBPP-UHFFFAOYSA-N 1 0 291.738 3.588 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1CCCCC1 ZINC001198943405 1123015335 /nfs/dbraw/zinc/01/53/35/1123015335.db2.gz ZYXXIPQKRQUGIU-UHFFFAOYSA-N 1 0 262.353 3.634 20 5 CHBDRO Cc1cccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000052926192 1123061401 /nfs/dbraw/zinc/06/14/01/1123061401.db2.gz XONXCJSSDUWYRK-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@H]([NH2+]CC(C)(C)C(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000696566160 1123195046 /nfs/dbraw/zinc/19/50/46/1123195046.db2.gz BQRXEZDKKBUUKC-JTQLQIEISA-N 1 0 286.322 3.927 20 5 CHBDRO Cc1cc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000449314334 1123263008 /nfs/dbraw/zinc/26/30/08/1123263008.db2.gz CEFGZNKYOSGWET-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO CC1(C)C[C@@H]([NH2+][C@H]2C=CCC2)c2cc([N+](=O)[O-])ccc21 ZINC000850506905 1123277227 /nfs/dbraw/zinc/27/72/27/1123277227.db2.gz CHAARMJDXFNILG-XHDPSFHLSA-N 1 0 272.348 3.625 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1C=CCC1 ZINC000850509695 1123278096 /nfs/dbraw/zinc/27/80/96/1123278096.db2.gz PYVFRBBUMNXBOR-IMJJTQAJSA-N 1 0 286.375 3.614 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000474071599 1123411082 /nfs/dbraw/zinc/41/10/82/1123411082.db2.gz GISLJRFGSIDNMX-NSHDSACASA-N 1 0 298.333 3.898 20 5 CHBDRO C[NH2+]C[C@H](C)NCc1c2ccccc2cc2ccccc21 ZINC000853249501 1123429969 /nfs/dbraw/zinc/42/99/69/1123429969.db2.gz QQFUQSGDKCAPGX-AWEZNQCLSA-N 1 0 278.399 3.691 20 5 CHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000542632228 1129134048 /nfs/dbraw/zinc/13/40/48/1129134048.db2.gz PQTFPNCDPKUVED-AWEZNQCLSA-N 1 0 262.353 3.749 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1ccns1 ZINC000858575787 1123664034 /nfs/dbraw/zinc/66/40/34/1123664034.db2.gz DTMMWJBKCUCJTN-QWRGUYRKSA-N 1 0 291.376 3.772 20 5 CHBDRO Cc1ccc(O[C@H](C)C[N+](C)(C)C)c(C(C)(C)C)c1 ZINC001227449847 1123776524 /nfs/dbraw/zinc/77/65/24/1123776524.db2.gz IDAUXXLKZIHLER-CQSZACIVSA-N 1 0 264.433 3.766 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC1(C)CC1 ZINC000475224246 1123827938 /nfs/dbraw/zinc/82/79/38/1123827938.db2.gz MSUWCJFTSKPUPI-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@H]1CC=CCC1 ZINC000084439972 1129153117 /nfs/dbraw/zinc/15/31/17/1129153117.db2.gz UOSUFZGQWFUZTO-NSHDSACASA-N 1 0 280.755 3.694 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000865786191 1124014074 /nfs/dbraw/zinc/01/40/74/1124014074.db2.gz DRFPDFUDSZXALY-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)CC1CCC1 ZINC000444767041 1124061738 /nfs/dbraw/zinc/06/17/38/1124061738.db2.gz OMFPBPYPZJYPJH-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CCCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000088512088 1124064375 /nfs/dbraw/zinc/06/43/75/1124064375.db2.gz QXGXMPHOCSVBGH-JSGCOSHPSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000121646788 1124112268 /nfs/dbraw/zinc/11/22/68/1124112268.db2.gz YTBRNAVJNBOPAA-HIFRSBDPSA-N 1 0 296.370 3.894 20 5 CHBDRO CCC(CC)[N@H+](CCOC)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000508564849 1124114665 /nfs/dbraw/zinc/11/46/65/1124114665.db2.gz QTUZYKDBWXQVRP-UHFFFAOYSA-N 1 0 294.395 3.540 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccccc2C2CC2)cc1 ZINC000094357733 1124119746 /nfs/dbraw/zinc/11/97/46/1124119746.db2.gz NIIYJAKUGAPONF-UHFFFAOYSA-N 1 0 282.343 3.762 20 5 CHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CCC1 ZINC000441197081 1124132767 /nfs/dbraw/zinc/13/27/67/1124132767.db2.gz FDXUMAXUHWSODN-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCc1ccccc1)CCC2 ZINC000447518381 1124479725 /nfs/dbraw/zinc/47/97/25/1124479725.db2.gz VTRATKDFWDJTRE-GOSISDBHSA-N 1 0 296.370 3.805 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC=CCC1)CCC2 ZINC000447562758 1124490579 /nfs/dbraw/zinc/49/05/79/1124490579.db2.gz MWGKNFNGUUWVGS-CXAGYDPISA-N 1 0 286.375 3.918 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449065414 1124640950 /nfs/dbraw/zinc/64/09/50/1124640950.db2.gz UHXKQCVLIVHNIE-GJZGRUSLSA-N 1 0 298.386 3.919 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872038777 1124663560 /nfs/dbraw/zinc/66/35/60/1124663560.db2.gz OFGPIANKBMBGLB-GMTAPVOTSA-N 1 0 298.383 3.669 20 5 CHBDRO CC(C)CSCC[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449209436 1124669500 /nfs/dbraw/zinc/66/95/00/1124669500.db2.gz QQMBTPMIKKKXQB-ZDUSSCGKSA-N 1 0 296.436 3.505 20 5 CHBDRO CCSC1(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872089263 1124680691 /nfs/dbraw/zinc/68/06/91/1124680691.db2.gz WCQUYIUUEHTCGL-JTQLQIEISA-N 1 0 298.383 3.670 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCC12CC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872091234 1124681691 /nfs/dbraw/zinc/68/16/91/1124681691.db2.gz HGMUTYOGWXZOOB-MFKMUULPSA-N 1 0 278.327 3.717 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000872128137 1124690551 /nfs/dbraw/zinc/69/05/51/1124690551.db2.gz FTAKRJOYBMSPTR-SDDRHHMPSA-N 1 0 280.393 3.530 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cccs1 ZINC000873008974 1124735119 /nfs/dbraw/zinc/73/51/19/1124735119.db2.gz XYXSSQHBIVUBSC-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO C[C@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)(C)C ZINC000877042267 1125001457 /nfs/dbraw/zinc/00/14/57/1125001457.db2.gz NXIJTOAOLAHUNP-SNVBAGLBSA-N 1 0 291.351 3.508 20 5 CHBDRO CC(C)OC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000530926293 1125188055 /nfs/dbraw/zinc/18/80/55/1125188055.db2.gz QIOWAKCMPPSBLR-ZDUSSCGKSA-N 1 0 292.379 3.545 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccc2)C2CC2)cc1 ZINC000035053164 1125234686 /nfs/dbraw/zinc/23/46/86/1125234686.db2.gz OMTNWRFXUUKFOE-KRWDZBQOSA-N 1 0 282.343 3.836 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CC=CCC1 ZINC000532208851 1125240848 /nfs/dbraw/zinc/24/08/48/1125240848.db2.gz AOBQAWQQGDAKKR-KGLIPLIRSA-N 1 0 274.364 3.910 20 5 CHBDRO CC1(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC(F)(F)C1 ZINC000883250137 1125384805 /nfs/dbraw/zinc/38/48/05/1125384805.db2.gz CRECIJXHJANZBK-XQRVVYSFSA-N 1 0 296.317 3.633 20 5 CHBDRO C[C@H]1CC[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000132295477 1125416589 /nfs/dbraw/zinc/41/65/89/1125416589.db2.gz PHDIHARCTRFUBU-JOYOIKCWSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H](C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000734509747 1129310830 /nfs/dbraw/zinc/31/08/30/1129310830.db2.gz LIPFUWKJNFZEDG-JWJUJFCLSA-N 1 0 276.380 3.880 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000766224949 1129383985 /nfs/dbraw/zinc/38/39/85/1129383985.db2.gz NHUZRQSTMZGWQE-SGMGOOAPSA-N 1 0 294.420 3.838 20 5 CHBDRO CCC(C)(C)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000093279380 1129420222 /nfs/dbraw/zinc/42/02/22/1129420222.db2.gz ITECFOSSKHYUFQ-UHFFFAOYSA-N 1 0 250.342 3.524 20 5 CHBDRO CCC(C)(C)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093279321 1129420503 /nfs/dbraw/zinc/42/05/03/1129420503.db2.gz VCGYQVQPSCYYHL-CSKARUKUSA-N 1 0 262.353 3.728 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)[C@H](C)C1 ZINC000094773748 1129452042 /nfs/dbraw/zinc/45/20/42/1129452042.db2.gz AAJFWANJSHYBTM-JTNHKYCSSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCCCCCC2)cc1F ZINC000094774219 1129452110 /nfs/dbraw/zinc/45/21/10/1129452110.db2.gz RNYRTJYCMFLWMH-UHFFFAOYSA-N 1 0 266.316 3.500 20 5 CHBDRO Cc1c(C[N@@H+]2CCC3(CCCC3)C2)cccc1[N+](=O)[O-] ZINC000743864284 1129542173 /nfs/dbraw/zinc/54/21/73/1129542173.db2.gz ZJCYSCJTGYCXTG-UHFFFAOYSA-N 1 0 274.364 3.669 20 5 CHBDRO Cc1c(C[N@@H+]2CCCC(C)(C)CC2)cccc1[N+](=O)[O-] ZINC000303866205 1129576694 /nfs/dbraw/zinc/57/66/94/1129576694.db2.gz HHWNOPOZSFQLEC-UHFFFAOYSA-N 1 0 276.380 3.915 20 5 CHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]CCC2CCCCCCC2)C1 ZINC001168976996 1129686134 /nfs/dbraw/zinc/68/61/34/1129686134.db2.gz GQEDNBXQJZGGMY-JKSUJKDBSA-N 1 0 282.428 3.772 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168976685 1129686463 /nfs/dbraw/zinc/68/64/63/1129686463.db2.gz FBEDHCMVGMYSBR-BPUTZDHNSA-N 1 0 276.380 3.563 20 5 CHBDRO CC(C)=CCC/C(C)=C/C[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168979519 1129686890 /nfs/dbraw/zinc/68/68/90/1129686890.db2.gz YXWKEQNLMYOYAM-IYSULOHHSA-N 1 0 280.412 3.714 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001168965134 1129687491 /nfs/dbraw/zinc/68/74/91/1129687491.db2.gz YHPJFDIDECJTJK-HIFRSBDPSA-N 1 0 280.412 3.524 20 5 CHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]CCCCC2CCCCC2)C1 ZINC001169004583 1129689203 /nfs/dbraw/zinc/68/92/03/1129689203.db2.gz RFPKPABPXIAIFQ-JKSUJKDBSA-N 1 0 282.428 3.772 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169006535 1129689317 /nfs/dbraw/zinc/68/93/17/1129689317.db2.gz YRYILSXOBWFOSK-KBXIAJHMSA-N 1 0 282.428 3.626 20 5 CHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001169006251 1129689347 /nfs/dbraw/zinc/68/93/47/1129689347.db2.gz GJVDZTSIKNPVIS-UAGQMJEPSA-N 1 0 288.391 3.577 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(C)c1C ZINC001169001631 1129689402 /nfs/dbraw/zinc/68/94/02/1129689402.db2.gz HCJIVHDSVOLKQC-YQQAZPJKSA-N 1 0 290.407 3.790 20 5 CHBDRO CC(C)C[N@H+](Cc1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011218 1129689971 /nfs/dbraw/zinc/68/99/71/1129689971.db2.gz ILVYCMZQMZDTIA-SJORKVTESA-N 1 0 290.407 3.590 20 5 CHBDRO Cc1cc(Cl)ccc1[C@@H](C)[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168990063 1129690147 /nfs/dbraw/zinc/69/01/47/1129690147.db2.gz BEPGUUHCUYPRCV-MBNYWOFBSA-N 1 0 296.798 3.744 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1Cl ZINC001168988575 1129690190 /nfs/dbraw/zinc/69/01/90/1129690190.db2.gz SNQBJMSURXUFQV-OUCADQQQSA-N 1 0 296.798 3.744 20 5 CHBDRO CC[N@H+](Cc1cccc(Cl)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169042785 1129690489 /nfs/dbraw/zinc/69/04/89/1129690489.db2.gz FSCBNWDRFPANNW-DZGCQCFKSA-N 1 0 296.798 3.607 20 5 CHBDRO Cc1ccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169025014 1129691344 /nfs/dbraw/zinc/69/13/44/1129691344.db2.gz ILURVVJBSNOLED-OIISXLGYSA-N 1 0 288.391 3.577 20 5 CHBDRO C[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC001169090988 1129700323 /nfs/dbraw/zinc/70/03/23/1129700323.db2.gz KMUWVQVTKNEMIC-ZDUSSCGKSA-N 1 0 276.380 3.505 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001169553390 1129736666 /nfs/dbraw/zinc/73/66/66/1129736666.db2.gz CQVPCFFTDRLEDU-AWEZNQCLSA-N 1 0 298.333 3.931 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC1CCCCC1 ZINC001169667936 1129745750 /nfs/dbraw/zinc/74/57/50/1129745750.db2.gz YAXQVKIJXHMCAA-UHFFFAOYSA-N 1 0 276.380 3.649 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001169724938 1129751245 /nfs/dbraw/zinc/75/12/45/1129751245.db2.gz ZPKBHEDQNWUOMG-CYBMUJFWSA-N 1 0 294.370 3.992 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001169724911 1129751470 /nfs/dbraw/zinc/75/14/70/1129751470.db2.gz YWACNECHSJFQGB-AWEZNQCLSA-N 1 0 276.380 3.853 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C2CC(C(F)F)C2)cc1[N+](=O)[O-] ZINC000768697892 1129869136 /nfs/dbraw/zinc/86/91/36/1129869136.db2.gz QCLLZMNPNGNBSQ-OIKLOGQESA-N 1 0 284.306 3.598 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC12CCC2 ZINC000801526344 1129924137 /nfs/dbraw/zinc/92/41/37/1129924137.db2.gz LFFBWQXLYCFMPY-GFCCVEGCSA-N 1 0 292.354 3.746 20 5 CHBDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)C1 ZINC000801540138 1129925595 /nfs/dbraw/zinc/92/55/95/1129925595.db2.gz UWVMJOSMZRRAES-LRDDRELGSA-N 1 0 292.354 3.746 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1nccs1)c1ccccc1[N+](=O)[O-] ZINC000903244934 1130135622 /nfs/dbraw/zinc/13/56/22/1130135622.db2.gz GQAMQUXKKHZNRK-QWRGUYRKSA-N 1 0 291.376 3.506 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000903245845 1130136031 /nfs/dbraw/zinc/13/60/31/1130136031.db2.gz OWSLSVQNPLNIED-KBPBESRZSA-N 1 0 299.374 3.753 20 5 CHBDRO CCC(C)(C)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746673229 1130144397 /nfs/dbraw/zinc/14/43/97/1130144397.db2.gz OPKUCDHFPBMIAT-UHFFFAOYSA-N 1 0 270.760 3.869 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCc1cccnc1)c1ccc([N+](=O)[O-])cc1 ZINC000903288300 1130146781 /nfs/dbraw/zinc/14/67/81/1130146781.db2.gz WVJDGCACWDNSAX-UONOGXRCSA-N 1 0 299.374 3.662 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748807350 1130248488 /nfs/dbraw/zinc/24/84/88/1130248488.db2.gz MWRQJDQOPRDQOB-AWEZNQCLSA-N 1 0 280.343 3.744 20 5 CHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1C=CCC1 ZINC000826942657 1130317863 /nfs/dbraw/zinc/31/78/63/1130317863.db2.gz RUOQUZACLARDSI-SNVBAGLBSA-N 1 0 287.146 3.710 20 5 CHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)C(C)(C)C)c([N+](=O)[O-])c1 ZINC001170297375 1130476264 /nfs/dbraw/zinc/47/62/64/1130476264.db2.gz NGMBGCGDLNGOEJ-VXGBXAGGSA-N 1 0 294.395 3.559 20 5 CHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)C(C)(C)C)c([N+](=O)[O-])c1 ZINC001170297374 1130476509 /nfs/dbraw/zinc/47/65/09/1130476509.db2.gz NGMBGCGDLNGOEJ-RYUDHWBXSA-N 1 0 294.395 3.559 20 5 CHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)CC(C)C)c([N+](=O)[O-])c1 ZINC001170310429 1130480839 /nfs/dbraw/zinc/48/08/39/1130480839.db2.gz VUBBBJNTEYGWSA-STQMWFEESA-N 1 0 294.395 3.559 20 5 CHBDRO CCCC[C@@H](C)[NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170328869 1130483636 /nfs/dbraw/zinc/48/36/36/1130483636.db2.gz WWVPBIJJEJDNFY-CHWSQXEVSA-N 1 0 294.395 3.703 20 5 CHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C1CCCC1 ZINC000811471409 1130614617 /nfs/dbraw/zinc/61/46/17/1130614617.db2.gz AQLOTIFSZLCLAQ-UHFFFAOYSA-N 1 0 289.162 3.934 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCSCC1)c1ccc([N+](=O)[O-])cc1 ZINC000692465196 1130740123 /nfs/dbraw/zinc/74/01/23/1130740123.db2.gz MPGKOCHHJWVRHF-YPMHNXCESA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[C@H](C)C1 ZINC000783309282 1130814810 /nfs/dbraw/zinc/81/48/10/1130814810.db2.gz JTNLPODVURDTDI-WCFLWFBJSA-N 1 0 262.353 3.742 20 5 CHBDRO N[C@@]12C[C@@H]1C[N@H+](Cc1c3ccccc3cc3ccccc31)C2 ZINC001236026479 1130831299 /nfs/dbraw/zinc/83/12/99/1130831299.db2.gz MVZANKXCFWNNDN-OXQOHEQNSA-N 1 0 288.394 3.526 20 5 CHBDRO CC[C@]1(C)CC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783573918 1130839623 /nfs/dbraw/zinc/83/96/23/1130839623.db2.gz MYWKFHSUAPDFPR-CQSZACIVSA-N 1 0 282.771 3.870 20 5 CHBDRO CC(C)C([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)C(C)C ZINC000815597141 1131005791 /nfs/dbraw/zinc/00/57/91/1131005791.db2.gz NUBXUHSPGHLTBB-LLVKDONJSA-N 1 0 279.384 3.508 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000816648856 1131120709 /nfs/dbraw/zinc/12/07/09/1131120709.db2.gz QCEQSVUZROAMKV-NEPJUHHUSA-N 1 0 286.331 3.695 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCC[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC001202813096 1131436056 /nfs/dbraw/zinc/43/60/56/1131436056.db2.gz QSILICVUPSCNBS-JKSUJKDBSA-N 1 0 288.391 3.819 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844436104 1131564008 /nfs/dbraw/zinc/56/40/08/1131564008.db2.gz GQIKIGALNHFCQW-SMDDNHRTSA-N 1 0 296.317 3.777 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc2c1CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000845983406 1131674621 /nfs/dbraw/zinc/67/46/21/1131674621.db2.gz MQGOUXURNHGVKE-ZDUSSCGKSA-N 1 0 296.370 3.934 20 5 CHBDRO CC(=O)c1ccc2cc(O[C@H](C)C[N+](C)(C)C)ccc2c1 ZINC001227761214 1131739182 /nfs/dbraw/zinc/73/91/82/1131739182.db2.gz LBEHBTLFBDSJLC-CYBMUJFWSA-N 1 0 286.395 3.516 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)c2ccc[nH]2)cccc1[N+](=O)[O-] ZINC000773116279 1131949180 /nfs/dbraw/zinc/94/91/80/1131949180.db2.gz INTDZUGNLWWYEW-RYUDHWBXSA-N 1 0 273.336 3.643 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H]1Cc2ccccc21 ZINC001649155602 1131970985 /nfs/dbraw/zinc/97/09/85/1131970985.db2.gz KKLKAXNGTWJUMM-HNNXBMFYSA-N 1 0 296.370 3.641 20 5 CHBDRO C[NH+](C)[C@@H]1CCC[C@@H](Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000715573265 1131988539 /nfs/dbraw/zinc/98/85/39/1131988539.db2.gz OODDTVGWXPNXAW-VXGBXAGGSA-N 1 0 297.786 3.533 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccns2)cc1[N+](=O)[O-] ZINC000716055106 1132003857 /nfs/dbraw/zinc/00/38/57/1132003857.db2.gz NNJGBOPHYLFIBB-MNOVXSKESA-N 1 0 291.376 3.772 20 5 CHBDRO CC[C@H](C)C[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037173077 1132006299 /nfs/dbraw/zinc/00/62/99/1132006299.db2.gz NBGVGJUXHAUOQF-JTQLQIEISA-N 1 0 270.760 3.726 20 5 CHBDRO Cc1cc(Nc2ccccc2[N+](=O)[O-])c2ccccc2[nH+]1 ZINC001206140469 1132066501 /nfs/dbraw/zinc/06/65/01/1132066501.db2.gz VEYDAJQQLOOWDN-UHFFFAOYSA-N 1 0 279.299 3.617 20 5 CHBDRO CCCC[N@H+](CC)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908020 1132349240 /nfs/dbraw/zinc/34/92/40/1132349240.db2.gz KGCSSXQIYFUTGY-MRXNPFEDSA-N 1 0 290.407 3.964 20 5 CHBDRO CCCCC[N@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907906 1132350417 /nfs/dbraw/zinc/35/04/17/1132350417.db2.gz JLIISUXECSAGIK-INIZCTEOSA-N 1 0 290.407 3.964 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173216083 1132411105 /nfs/dbraw/zinc/41/11/05/1132411105.db2.gz KDHUGVQNVMLHQS-AWEZNQCLSA-N 1 0 284.359 3.624 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@](C)(F)C1 ZINC001173221381 1132411544 /nfs/dbraw/zinc/41/15/44/1132411544.db2.gz HWZZSYPPQUDEEH-BBRMVZONSA-N 1 0 294.370 3.740 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC12CCCCC2 ZINC001173220613 1132411753 /nfs/dbraw/zinc/41/17/53/1132411753.db2.gz BCTDDWYNAGCUOL-CQSZACIVSA-N 1 0 288.391 3.934 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001173225686 1132412858 /nfs/dbraw/zinc/41/28/58/1132412858.db2.gz FISJPSFCCSNFIS-WCQYABFASA-N 1 0 298.333 3.503 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC001173226213 1132413019 /nfs/dbraw/zinc/41/30/19/1132413019.db2.gz LJFSCTQPGJUUNC-NEPJUHHUSA-N 1 0 298.333 3.503 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC12CCC2 ZINC001173229446 1132413617 /nfs/dbraw/zinc/41/36/17/1132413617.db2.gz VANYKMTWTBMOJZ-XJKSGUPXSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC(c2ccccc2)C1 ZINC001173233203 1132413796 /nfs/dbraw/zinc/41/37/96/1132413796.db2.gz JNZRSLWHDQWPMM-AWEZNQCLSA-N 1 0 296.370 3.625 20 5 CHBDRO CC[C@H]1CCC[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173235811 1132415150 /nfs/dbraw/zinc/41/51/50/1132415150.db2.gz ZNDHNLDBGBKYGL-KGLIPLIRSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccccc2)CC1 ZINC001173213888 1132416537 /nfs/dbraw/zinc/41/65/37/1132416537.db2.gz LPOPBYBSQZBKDT-CQSZACIVSA-N 1 0 296.370 3.805 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCC[C@@H]1C ZINC001173213731 1132416766 /nfs/dbraw/zinc/41/67/66/1132416766.db2.gz HINYDLZUIBCMOD-ZENOOKHLSA-N 1 0 276.380 3.694 20 5 CHBDRO CC1(C)C[NH+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232218961 1132438494 /nfs/dbraw/zinc/43/84/94/1132438494.db2.gz IXPCIRCOHWYTJV-UHFFFAOYSA-N 1 0 277.371 3.625 20 5 CHBDRO CC[N@H+](Cc1ccc2ccc3cccnc3c2n1)C1CC1 ZINC001232219559 1132439567 /nfs/dbraw/zinc/43/95/67/1132439567.db2.gz UDWUQHSJVUIDGX-UHFFFAOYSA-N 1 0 277.371 3.767 20 5 CHBDRO [NH3+][C@H]1CCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC000843047633 1132494827 /nfs/dbraw/zinc/49/48/27/1132494827.db2.gz ZAIDSNYVCMUPDX-INIZCTEOSA-N 1 0 276.383 3.526 20 5 CHBDRO Cc1ccc(Nc2ccc(C3([NH3+])CCC3)cc2)c([N+](=O)[O-])c1 ZINC001159729218 1132899735 /nfs/dbraw/zinc/89/97/35/1132899735.db2.gz CEWHFZHSKFJXCE-UHFFFAOYSA-N 1 0 297.358 3.985 20 5 CHBDRO Cc1ccc(Nc2ccc(C3([NH3+])CCC3)cc2)cc1[N+](=O)[O-] ZINC001159730299 1132900152 /nfs/dbraw/zinc/90/01/52/1132900152.db2.gz OPQWYKXRKCLKBH-UHFFFAOYSA-N 1 0 297.358 3.985 20 5 CHBDRO Cc1ccc(Nc2ccc([C@@H]3CC[NH2+]C3)cc2)cc1[N+](=O)[O-] ZINC001159776290 1132908376 /nfs/dbraw/zinc/90/83/76/1132908376.db2.gz DETNWQFKRZFYBQ-CQSZACIVSA-N 1 0 297.358 3.724 20 5 CHBDRO CCC[NH+](CCC)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001167023788 1133299850 /nfs/dbraw/zinc/29/98/50/1133299850.db2.gz KUCFPHZBKAZUCH-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO CC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)CC(C)C ZINC001204881722 1133494630 /nfs/dbraw/zinc/49/46/30/1133494630.db2.gz SMYRMDRBODALJG-NTEUORMPSA-N 1 0 276.380 3.976 20 5 CHBDRO Cc1c(C[NH2+]C2CC3(C2)CCCC3)cccc1[N+](=O)[O-] ZINC001205403466 1133574401 /nfs/dbraw/zinc/57/44/01/1133574401.db2.gz XJTVIOOKLJIVSA-UHFFFAOYSA-N 1 0 274.364 3.716 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC001205403251 1133574584 /nfs/dbraw/zinc/57/45/84/1133574584.db2.gz WKCVLGMQFAELGS-CABCVRRESA-N 1 0 276.380 3.818 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)CCN1 ZINC001206389389 1133697485 /nfs/dbraw/zinc/69/74/85/1133697485.db2.gz RVAAPSUHRFLCEE-OAHLLOKOSA-N 1 0 290.410 3.787 20 5 CHBDRO C[C@@H]1C[NH2+]C[C@H]1OCc1c2ccccc2nc2ccccc21 ZINC001217791488 1135000863 /nfs/dbraw/zinc/00/08/63/1135000863.db2.gz WILLLAMAKMNNME-BFUOFWGJSA-N 1 0 292.382 3.513 20 5 CHBDRO C[NH2+][C@H]1C[C@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001217950556 1135030221 /nfs/dbraw/zinc/03/02/21/1135030221.db2.gz KRWMBQAAYBVXRU-JOCQHMNTSA-N 1 0 278.355 3.517 20 5 CHBDRO c1ccc2cc3cc(O[C@H]4[C@@H]5C[C@H]4C[NH2+]C5)ccc3cc2c1 ZINC001218148879 1135063033 /nfs/dbraw/zinc/06/30/33/1135063033.db2.gz DXNJGOWKJCSQLL-RUYXUALKSA-N 1 0 289.378 3.980 20 5 CHBDRO C[C@@H](Oc1c2ccccc2c(O)c2ccccc21)C1C[NH2+]C1 ZINC001218196069 1135067711 /nfs/dbraw/zinc/06/77/11/1135067711.db2.gz TUWJFUZDLNRVRO-GFCCVEGCSA-N 1 0 293.366 3.685 20 5 CHBDRO C[C@@H]1CC[C@@H](Oc2nccc3c4ccccc4ccc32)C[NH2+]1 ZINC001218404039 1135100180 /nfs/dbraw/zinc/10/01/80/1135100180.db2.gz YYTLOUYFSPIQTR-UKRRQHHQSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@@H]1C[NH2+]CC[C@H]1Oc1cccc2ccc3cccnc3c21 ZINC001218419718 1135101934 /nfs/dbraw/zinc/10/19/34/1135101934.db2.gz OXYJVOJWCQVXTN-CZUORRHYSA-N 1 0 292.382 3.765 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@@H]3C[C@@H]4CC[C@H]3[NH2+]4)cc2c1 ZINC001218479974 1135113017 /nfs/dbraw/zinc/11/30/17/1135113017.db2.gz VAEPZQDSYQUSJJ-YXJHDRRASA-N 1 0 290.366 3.660 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCc1cccc(-c2ccccc2)c1 ZINC001222118573 1135195949 /nfs/dbraw/zinc/19/59/49/1135195949.db2.gz XNDKCKQZCVFLRJ-MRXNPFEDSA-N 1 0 284.423 3.965 20 5 CHBDRO CC(C)[NH+]1CCC(O[C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC001224024688 1135412211 /nfs/dbraw/zinc/41/22/11/1135412211.db2.gz KKIRBBARZXJNCZ-CYBMUJFWSA-N 1 0 292.379 3.545 20 5 CHBDRO C[N+](C)(C)CCOC1c2ccccc2C=Cc2ccccc21 ZINC001224775559 1135480460 /nfs/dbraw/zinc/48/04/60/1135480460.db2.gz MNMSXKXWSYPGFZ-UHFFFAOYSA-N 1 0 294.418 3.983 20 5 CHBDRO C[N+](C)(C)CCO[C@H]1CCCC[C@@H]1C1CCCCC1 ZINC001224772726 1135480470 /nfs/dbraw/zinc/48/04/70/1135480470.db2.gz BYPDKJSLVSTKIM-SJORKVTESA-N 1 0 268.465 3.848 20 5 CHBDRO C[N+](C)(C)CCO[C@H]1CCCC[C@H]1C1CCCCC1 ZINC001224772725 1135480517 /nfs/dbraw/zinc/48/05/17/1135480517.db2.gz BYPDKJSLVSTKIM-IRXDYDNUSA-N 1 0 268.465 3.848 20 5 CHBDRO COc1ccc2cc([C@@H](C)OCC[N+](C)(C)C)ccc2c1 ZINC001224776293 1135481557 /nfs/dbraw/zinc/48/15/57/1135481557.db2.gz UORDKABFHMYYOK-CQSZACIVSA-N 1 0 288.411 3.632 20 5 CHBDRO Cc1ccc(C(C)C)cc1O[C@H](C)C[N+](C)(C)C ZINC001225224323 1135519265 /nfs/dbraw/zinc/51/92/65/1135519265.db2.gz CMSTWYSRUWBKQS-CQSZACIVSA-N 1 0 250.406 3.592 20 5 CHBDRO CCC(CC)C[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000573283363 334924244 /nfs/dbraw/zinc/92/42/44/334924244.db2.gz KHMLADQVSZSCPA-UHFFFAOYSA-N 1 0 289.379 3.644 20 5 CHBDRO CCc1ccc(C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)cn1 ZINC000352753296 529657120 /nfs/dbraw/zinc/65/71/20/529657120.db2.gz DHLYUGYDYAEDGC-QGZVFWFLSA-N 1 0 299.374 3.793 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C1CCCCC1 ZINC000083511466 178537828 /nfs/dbraw/zinc/53/78/28/178537828.db2.gz NFZWPHMDENNMLO-UHFFFAOYSA-N 1 0 268.744 3.671 20 5 CHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC000344460643 530004577 /nfs/dbraw/zinc/00/45/77/530004577.db2.gz IYTUGASOXBOYSP-CYBMUJFWSA-N 1 0 262.353 3.605 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000574340321 335012489 /nfs/dbraw/zinc/01/24/89/335012489.db2.gz ZDBWFIJARTYFBF-FOLVSLTJSA-N 1 0 274.364 3.606 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@H](C)C2(C)CC2)cccc1[N+](=O)[O-] ZINC000177243303 261341785 /nfs/dbraw/zinc/34/17/85/261341785.db2.gz BSZZDVGAOPWQFP-GFCCVEGCSA-N 1 0 262.353 3.524 20 5 CHBDRO CSCCCCC[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574650675 335037559 /nfs/dbraw/zinc/03/75/59/335037559.db2.gz HECIYLXJWSYBEQ-AWEZNQCLSA-N 1 0 294.420 3.705 20 5 CHBDRO CC(C)OCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000171500017 335067255 /nfs/dbraw/zinc/06/72/55/335067255.db2.gz IJIYKHIRHVGGGA-UHFFFAOYSA-N 1 0 294.395 3.620 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Cl)cc2)cc1 ZINC000020209913 171073965 /nfs/dbraw/zinc/07/39/65/171073965.db2.gz CTKKEBNPGLDOOO-UHFFFAOYSA-N 1 0 276.723 3.538 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000020526193 171239515 /nfs/dbraw/zinc/23/95/15/171239515.db2.gz FGYWSWCBXUQDGC-LRDDRELGSA-N 1 0 282.343 3.933 20 5 CHBDRO CC(C)CC[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000021516139 171312477 /nfs/dbraw/zinc/31/24/77/171312477.db2.gz RFJNISNVPBXWEE-LBPRGKRZSA-N 1 0 250.342 3.509 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000037031323 172899146 /nfs/dbraw/zinc/89/91/46/172899146.db2.gz YUMWEYSVLWTPSS-OCCSQVGLSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@H]1CCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000071206251 176080137 /nfs/dbraw/zinc/08/01/37/176080137.db2.gz CWMUWGJMBNBQNS-ZANVPECISA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCCc2occc2C1 ZINC000344313828 225023769 /nfs/dbraw/zinc/02/37/69/225023769.db2.gz YILIBNHGSWTGNE-LBPRGKRZSA-N 1 0 286.331 3.697 20 5 CHBDRO Cc1ccc([C@@H]2CCCN2Cc2csc([N+](=O)[O-])c2)o1 ZINC000331433764 228100626 /nfs/dbraw/zinc/10/06/26/228100626.db2.gz UOFOFWAMFJPCCY-LBPRGKRZSA-N 1 0 292.360 3.895 20 5 CHBDRO Cc1ccccc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000037487184 260109689 /nfs/dbraw/zinc/10/96/89/260109689.db2.gz SZHZHUQXVAQZJW-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000070101813 260152119 /nfs/dbraw/zinc/15/21/19/260152119.db2.gz SJLPQEYFDDQFNH-IAQYHMDHSA-N 1 0 262.353 3.824 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394054093 260212319 /nfs/dbraw/zinc/21/23/19/260212319.db2.gz SIPUFCMWRJRHPW-NSHDSACASA-N 1 0 268.332 3.744 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000088747223 260234499 /nfs/dbraw/zinc/23/44/99/260234499.db2.gz UIDJKGNVZNTBMM-UKRRQHHQSA-N 1 0 260.337 3.744 20 5 CHBDRO C[C@H](CC(F)(F)F)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000222786479 260236121 /nfs/dbraw/zinc/23/61/21/260236121.db2.gz KWPODCPXBZMVME-RKDXNWHRSA-N 1 0 276.258 3.586 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C1CCCC1 ZINC000449155699 260260384 /nfs/dbraw/zinc/26/03/84/260260384.db2.gz QDQGCYFLJJEXAZ-OLZOCXBDSA-N 1 0 276.380 3.694 20 5 CHBDRO CCSCC[C@H](C)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449170154 260271240 /nfs/dbraw/zinc/27/12/40/260271240.db2.gz QHSAFPZLWSVBOY-QWHCGFSZSA-N 1 0 296.436 3.647 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000426773467 260351194 /nfs/dbraw/zinc/35/11/94/260351194.db2.gz JUAKLAKNOVVOIS-RDBSUJKOSA-N 1 0 274.364 3.778 20 5 CHBDRO CC[C@H]([NH2+]Cc1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000128507445 260375961 /nfs/dbraw/zinc/37/59/61/260375961.db2.gz OEJHSVQCNOBEHI-INIZCTEOSA-N 1 0 285.347 3.539 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000449299010 260376741 /nfs/dbraw/zinc/37/67/41/260376741.db2.gz JYTZPEQTCINCFA-VXGBXAGGSA-N 1 0 298.333 3.551 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000086642438 260395613 /nfs/dbraw/zinc/39/56/13/260395613.db2.gz JAGFDSNRGXDIBA-UHFFFAOYSA-N 1 0 250.342 3.653 20 5 CHBDRO OCCCC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000139950573 260946965 /nfs/dbraw/zinc/94/69/65/260946965.db2.gz OSPKKZAZFFJLIS-UHFFFAOYSA-N 1 0 279.383 3.855 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000152955643 261071599 /nfs/dbraw/zinc/07/15/99/261071599.db2.gz JPVKUAUGTHCSRN-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000163765821 261328704 /nfs/dbraw/zinc/32/87/04/261328704.db2.gz YHIXHHNUJJFXNT-LRDDRELGSA-N 1 0 285.347 3.792 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000514083982 261353870 /nfs/dbraw/zinc/35/38/70/261353870.db2.gz NOSKLCQGQBODCR-LLVKDONJSA-N 1 0 268.382 3.667 20 5 CHBDRO C[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000183995693 262004492 /nfs/dbraw/zinc/00/44/92/262004492.db2.gz FVSBMLJBDJYTJA-CZUORRHYSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@H]([NH2+]CCOC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000108942777 262074930 /nfs/dbraw/zinc/07/49/30/262074930.db2.gz XZNQUNAPITZBLH-INIZCTEOSA-N 1 0 292.379 3.595 20 5 CHBDRO C[C@@H]1C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000390157147 262143343 /nfs/dbraw/zinc/14/33/43/262143343.db2.gz MXCLUFSDDHGEAJ-ACJLOTCBSA-N 1 0 296.370 3.975 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000020088799 262191812 /nfs/dbraw/zinc/19/18/12/262191812.db2.gz FMCLFJASGRWBQQ-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525786412 262236277 /nfs/dbraw/zinc/23/62/77/262236277.db2.gz FTWMCLALEGCUAT-UMVBOHGHSA-N 1 0 274.364 3.748 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000186279744 262313457 /nfs/dbraw/zinc/31/34/57/262313457.db2.gz XXQRPZCEKZCFFX-VXGBXAGGSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+]C[C@H](C)c1nccs1)c1ccc([N+](=O)[O-])cc1 ZINC000186733443 262321028 /nfs/dbraw/zinc/32/10/28/262321028.db2.gz OEXDRXCKDQIDRI-WDEREUQCSA-N 1 0 291.376 3.506 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@H]2CCCC(F)(F)C2)cs1 ZINC000282071864 263074131 /nfs/dbraw/zinc/07/41/31/263074131.db2.gz QPRGDZULAANOPP-VIFPVBQESA-N 1 0 290.335 3.571 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)cccc1[N+](=O)[O-] ZINC000187846494 263270545 /nfs/dbraw/zinc/27/05/45/263270545.db2.gz ZCXXXPPAINWCPN-QWHCGFSZSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](CC2CC2)CC2CCC2)c(F)c1 ZINC000475673692 264335201 /nfs/dbraw/zinc/33/52/01/264335201.db2.gz HWPNPXVYNJVPJI-UHFFFAOYSA-N 1 0 292.354 3.746 20 5 CHBDRO C[C@H]([NH2+]CC1CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000525858710 264503754 /nfs/dbraw/zinc/50/37/54/264503754.db2.gz UMEMIMCUUFPZAT-NSHDSACASA-N 1 0 262.353 3.682 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000292561512 264879940 /nfs/dbraw/zinc/87/99/40/264879940.db2.gz BRQUAEPDVPGZKA-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO CCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000518852128 265184326 /nfs/dbraw/zinc/18/43/26/265184326.db2.gz SQEGGDBLYUQSNL-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000094307444 265234750 /nfs/dbraw/zinc/23/47/50/265234750.db2.gz KYYWSCBIUZGXBQ-BXUZGUMPSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CC12CCC2 ZINC000357025723 266235818 /nfs/dbraw/zinc/23/58/18/266235818.db2.gz PMPDFEXBYJYGHX-LBPRGKRZSA-N 1 0 292.354 3.746 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1(C(F)F)CC1)CCC2 ZINC000358996303 266520305 /nfs/dbraw/zinc/52/03/05/266520305.db2.gz DHGNJPNDIWOISC-ZDUSSCGKSA-N 1 0 296.317 3.607 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000062726405 327894543 /nfs/dbraw/zinc/89/45/43/327894543.db2.gz YFXYOZVKUUEOCL-DZGCQCFKSA-N 1 0 276.380 3.696 20 5 CHBDRO C[C@@H]1CCC[C@](CNc2ccc([N+](=O)[O-])cc2)([NH+](C)C)C1 ZINC000040670118 328015239 /nfs/dbraw/zinc/01/52/39/328015239.db2.gz IFJDXORXWCNCBL-CJNGLKHVSA-N 1 0 291.395 3.517 20 5 CHBDRO C[C@@H]([N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000534349904 328047618 /nfs/dbraw/zinc/04/76/18/328047618.db2.gz AWADKSQPNUSLEK-CHOZFAJLSA-N 1 0 276.380 3.974 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](c2cccnc2)C2CC2)cc1[N+](=O)[O-] ZINC000340102862 328240237 /nfs/dbraw/zinc/24/02/37/328240237.db2.gz GUPIHLMQWJFLTP-QGZVFWFLSA-N 1 0 297.358 3.539 20 5 CHBDRO Cc1ccc(N[C@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC000534530366 328305101 /nfs/dbraw/zinc/30/51/01/328305101.db2.gz BCSWMDNQGFACHJ-INIZCTEOSA-N 1 0 297.358 3.502 20 5 CHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000110788953 328319213 /nfs/dbraw/zinc/31/92/13/328319213.db2.gz YFMGUFDJPJNZIR-UHFFFAOYSA-N 1 0 262.353 3.748 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000049120324 328340094 /nfs/dbraw/zinc/34/00/94/328340094.db2.gz ZWSDZZJUMCKDOO-UONOGXRCSA-N 1 0 292.379 3.662 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1ccsc1Cl ZINC000312764087 326963625 /nfs/dbraw/zinc/96/36/25/326963625.db2.gz LFUHARNGXRFOBV-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO CC(C)SCC[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000558260374 327083918 /nfs/dbraw/zinc/08/39/18/327083918.db2.gz YGRWWNVVGNJUBD-ZDUSSCGKSA-N 1 0 296.436 3.647 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000558697936 327114765 /nfs/dbraw/zinc/11/47/65/327114765.db2.gz IAMXLXFCWSNAAF-YUTCNCBUSA-N 1 0 294.782 3.569 20 5 CHBDRO C[C@H]1CCC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000088195114 327130409 /nfs/dbraw/zinc/13/04/09/327130409.db2.gz LTJLEDDJBLEDTJ-JSGCOSHPSA-N 1 0 262.353 3.511 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1N(C)C ZINC000089511956 327170715 /nfs/dbraw/zinc/17/07/15/327170715.db2.gz TXADTGVTCJJBTL-ZDUSSCGKSA-N 1 0 299.374 3.512 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1N(C)C ZINC000089513233 327170998 /nfs/dbraw/zinc/17/09/98/327170998.db2.gz JWIIFCVBXWSUHI-CYBMUJFWSA-N 1 0 299.374 3.512 20 5 CHBDRO CCc1cccnc1[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000507462276 332807001 /nfs/dbraw/zinc/80/70/01/332807001.db2.gz OOTVSPFBEFMCQT-STQMWFEESA-N 1 0 299.374 3.964 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1CCC1 ZINC000324945033 328815180 /nfs/dbraw/zinc/81/51/80/328815180.db2.gz RTZYEUSBDZPUAO-GFCCVEGCSA-N 1 0 268.382 3.715 20 5 CHBDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccoc1 ZINC000582383537 328977025 /nfs/dbraw/zinc/97/70/25/328977025.db2.gz FIJGGIAGZIMOLR-LLVKDONJSA-N 1 0 299.330 3.562 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC1(C)C ZINC000582550691 329106240 /nfs/dbraw/zinc/10/62/40/329106240.db2.gz WAMCNBCCYRKXOX-SWLSCSKDSA-N 1 0 276.380 3.694 20 5 CHBDRO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000188877089 329374035 /nfs/dbraw/zinc/37/40/35/329374035.db2.gz CCKFBPPWTKBUQK-MRXNPFEDSA-N 1 0 298.342 3.517 20 5 CHBDRO C[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000509021899 332856067 /nfs/dbraw/zinc/85/60/67/332856067.db2.gz NKWRVYVCKIFHQA-SNVBAGLBSA-N 1 0 298.333 3.931 20 5 CHBDRO CSCCCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000133650682 329654208 /nfs/dbraw/zinc/65/42/08/329654208.db2.gz KSLYNQBXYSKODB-GFCCVEGCSA-N 1 0 282.409 3.697 20 5 CHBDRO CC[C@H](C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000421870642 330100089 /nfs/dbraw/zinc/10/00/89/330100089.db2.gz FTFLOKVPTQWBOL-SWLSCSKDSA-N 1 0 276.380 3.552 20 5 CHBDRO CC(C)[C@@H]1CC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000445428454 330216070 /nfs/dbraw/zinc/21/60/70/330216070.db2.gz WJGOQIDUDYUYKD-GXTWGEPZSA-N 1 0 262.353 3.634 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000396933636 330231594 /nfs/dbraw/zinc/23/15/94/330231594.db2.gz BWIWFHUHNHVNAT-NXEZZACHSA-N 1 0 290.285 3.834 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000035257093 330244767 /nfs/dbraw/zinc/24/47/67/330244767.db2.gz VMHGXDZQCHLLAS-HUUCEWRRSA-N 1 0 276.380 3.962 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC(C)C1 ZINC000536871124 330263967 /nfs/dbraw/zinc/26/39/67/330263967.db2.gz NUUNJAJLLJIWNO-OTTFEQOBSA-N 1 0 294.420 3.854 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000036778548 330264969 /nfs/dbraw/zinc/26/49/69/330264969.db2.gz OIFPTSAMKNNWJV-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CC23CC3)c2ccccc2)c1 ZINC000424325724 330341214 /nfs/dbraw/zinc/34/12/14/330341214.db2.gz OIXIOHNIDAMCOF-DLBZAZTESA-N 1 0 294.354 3.826 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC13CC3)CCCC2 ZINC000424327441 330341606 /nfs/dbraw/zinc/34/16/06/330341606.db2.gz PXYLVVXBFRYWMU-GJZGRUSLSA-N 1 0 272.348 3.504 20 5 CHBDRO C[C@@H](CC1CC1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447535882 330868667 /nfs/dbraw/zinc/86/86/67/330868667.db2.gz JCIYJBNOEYPXBA-ZBEGNZNMSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccccc1 ZINC000449061832 330896333 /nfs/dbraw/zinc/89/63/33/330896333.db2.gz HRMRWIBQLSVJEQ-KBPBESRZSA-N 1 0 284.359 3.877 20 5 CHBDRO C[C@H]([NH2+]CCCCOC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000451102794 331015580 /nfs/dbraw/zinc/01/55/80/331015580.db2.gz LIRWAGXHPMWSTR-ZDUSSCGKSA-N 1 0 294.395 3.841 20 5 CHBDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000452010380 331050160 /nfs/dbraw/zinc/05/01/60/331050160.db2.gz FFNGXNQABMSDGW-APHBMKBZSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2C[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC000453379223 331125395 /nfs/dbraw/zinc/12/53/95/331125395.db2.gz WWHMJIXDOZYFCB-ZLDLUXBVSA-N 1 0 274.364 3.600 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000164091028 331161238 /nfs/dbraw/zinc/16/12/38/331161238.db2.gz NQEQKODHDWNNEK-WCQYABFASA-N 1 0 282.409 3.695 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](c2ccccc2)C2CC2)cc1 ZINC000195601163 331178236 /nfs/dbraw/zinc/17/82/36/331178236.db2.gz LIZYDAKTBYILRK-SFHVURJKSA-N 1 0 296.370 3.878 20 5 CHBDRO C[C@H]([NH2+]C1CC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000459563156 331287915 /nfs/dbraw/zinc/28/79/15/331287915.db2.gz GVGRGNMBXJYZQM-NSHDSACASA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1ccc(C[NH2+]C2CCC(C(F)F)CC2)cc1[N+](=O)[O-] ZINC000459712508 331295312 /nfs/dbraw/zinc/29/53/12/331295312.db2.gz MRZYNEOKACJOJQ-UHFFFAOYSA-N 1 0 298.333 3.817 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459774308 331300164 /nfs/dbraw/zinc/30/01/64/331300164.db2.gz ITHTUQQTBUHYGD-GBIKHYSHSA-N 1 0 280.755 3.526 20 5 CHBDRO CC[NH+](CC)CCS[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000461549298 331313829 /nfs/dbraw/zinc/31/38/29/331313829.db2.gz QUZVSZPALGCHFW-GFCCVEGCSA-N 1 0 282.409 3.731 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]CCCCF)c2cc([N+](=O)[O-])ccc21 ZINC000462818565 331330886 /nfs/dbraw/zinc/33/08/86/331330886.db2.gz JCHCBINADHVWAJ-CQSZACIVSA-N 1 0 280.343 3.657 20 5 CHBDRO CCC1(CC)C[N@H+](Cc2cccc([N+](=O)[O-])c2)CCS1 ZINC000464568344 331362808 /nfs/dbraw/zinc/36/28/08/331362808.db2.gz INKQRZVOGIMKIL-UHFFFAOYSA-N 1 0 294.420 3.702 20 5 CHBDRO CC(C)[C@@H]1C[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CCS1 ZINC000464774712 331367335 /nfs/dbraw/zinc/36/73/35/331367335.db2.gz PZZIPVWKMKMHTI-WFASDCNBSA-N 1 0 294.420 3.729 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[C@H](C)C1 ZINC000468592632 331437460 /nfs/dbraw/zinc/43/74/60/331437460.db2.gz VIDHLQRGWQUVMV-SFPHSEHVSA-N 1 0 274.364 3.776 20 5 CHBDRO CC[C@H]([NH2+]CCC(O)(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000471788317 331520210 /nfs/dbraw/zinc/52/02/10/331520210.db2.gz PILAAEJUSSUYIO-HNNXBMFYSA-N 1 0 294.395 3.577 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C1CCSCC1)c1ccccc1[N+](=O)[O-] ZINC000474892276 331603114 /nfs/dbraw/zinc/60/31/14/331603114.db2.gz RSZHECNWIQXLHU-VXGBXAGGSA-N 1 0 294.420 3.777 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000479972857 331752977 /nfs/dbraw/zinc/75/29/77/331752977.db2.gz WSBOXSFYARMOQL-QWRGUYRKSA-N 1 0 280.343 3.648 20 5 CHBDRO CCOc1cc(C[N@H+](C)C2(C)CCCC2)ccc1[N+](=O)[O-] ZINC000489850678 332070036 /nfs/dbraw/zinc/07/00/36/332070036.db2.gz OAGXFXNFXPRAMK-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO CCOc1cc(C[NH2+][C@@H](C)[C@@H](C)CC)ccc1[N+](=O)[O-] ZINC000491599340 332242295 /nfs/dbraw/zinc/24/22/95/332242295.db2.gz QJBNMHFZGVVYFM-RYUDHWBXSA-N 1 0 280.368 3.518 20 5 CHBDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cn1 ZINC000575596068 335107158 /nfs/dbraw/zinc/10/71/58/335107158.db2.gz GBAFKFUQMIGTFT-AWEZNQCLSA-N 1 0 299.374 3.766 20 5 CHBDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000494843378 332487699 /nfs/dbraw/zinc/48/76/99/332487699.db2.gz AJPIWQOKBCKSAC-QMMMGPOBSA-N 1 0 296.314 3.867 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000250910776 334353277 /nfs/dbraw/zinc/35/32/77/334353277.db2.gz ABHNGAMRMJGVDQ-JYAVWHMHSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)oc1C ZINC000502711752 332670753 /nfs/dbraw/zinc/67/07/53/332670753.db2.gz KLQTWJCEOUHSOJ-GFCCVEGCSA-N 1 0 288.347 3.698 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000575790869 335115248 /nfs/dbraw/zinc/11/52/48/335115248.db2.gz SXXAANNGXMSNOE-LBPRGKRZSA-N 1 0 250.342 3.605 20 5 CHBDRO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000513702800 333033611 /nfs/dbraw/zinc/03/36/11/333033611.db2.gz NDFFTRFWYDFIAK-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO CC[C@@H]([NH2+]CCOC(C)(C)CC)c1cccc([N+](=O)[O-])c1 ZINC000308541921 333034605 /nfs/dbraw/zinc/03/46/05/333034605.db2.gz KJBLJZUVXCPGJC-OAHLLOKOSA-N 1 0 294.395 3.841 20 5 CHBDRO CC(C)C[C@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000311287875 333066660 /nfs/dbraw/zinc/06/66/60/333066660.db2.gz NMDNVDRZUOAKHO-QWHCGFSZSA-N 1 0 264.369 3.928 20 5 CHBDRO CC[C@H](C)C[N@H+](CC)Cc1ccc([N+](=O)[O-])cc1F ZINC000311403752 333067976 /nfs/dbraw/zinc/06/79/76/333067976.db2.gz GRHGJDJNJCSOAD-NSHDSACASA-N 1 0 268.332 3.602 20 5 CHBDRO CC(C)(C)C(C)(C)C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000312084540 333076232 /nfs/dbraw/zinc/07/62/32/333076232.db2.gz NGVHDSKGVCNYTD-UHFFFAOYSA-N 1 0 264.369 3.757 20 5 CHBDRO C[C@@H]1CCC[C@@H](C[NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000218940002 333138588 /nfs/dbraw/zinc/13/85/88/333138588.db2.gz BWXQPKVWGTVYCH-ZIAGYGMSSA-N 1 0 276.380 3.553 20 5 CHBDRO COc1ccsc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000186202295 333156727 /nfs/dbraw/zinc/15/67/27/333156727.db2.gz JHYSOQOGIOEYDN-JTQLQIEISA-N 1 0 292.360 3.516 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1CCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000187070371 333167776 /nfs/dbraw/zinc/16/77/76/333167776.db2.gz BQRFGIASJGQRNJ-RYUDHWBXSA-N 1 0 294.420 3.777 20 5 CHBDRO CCCC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000222298193 333180365 /nfs/dbraw/zinc/18/03/65/333180365.db2.gz XXDPUMJTJVNRCM-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO COc1ccc(C[NH2+]C[C@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000223449197 333208047 /nfs/dbraw/zinc/20/80/47/333208047.db2.gz SZGMZCULASPXBA-OLZOCXBDSA-N 1 0 292.379 3.519 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CCC[C@H](C)CC2)cc1[N+](=O)[O-] ZINC000227310188 333280037 /nfs/dbraw/zinc/28/00/37/333280037.db2.gz SMADDBHZJMNDSW-JSGCOSHPSA-N 1 0 292.379 3.662 20 5 CHBDRO CC(C)[N@H+](Cc1ccco1)Cc1ccc([N+](=O)[O-])cc1 ZINC000194956761 333280139 /nfs/dbraw/zinc/28/01/39/333280139.db2.gz QNOLCGFPGOGMQC-UHFFFAOYSA-N 1 0 274.320 3.598 20 5 CHBDRO CC1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000229587419 333306682 /nfs/dbraw/zinc/30/66/82/333306682.db2.gz JYYXGCIGDGPCRN-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000230659899 333319729 /nfs/dbraw/zinc/31/97/29/333319729.db2.gz GSPMXODWJGTFBA-SGMGOOAPSA-N 1 0 262.353 3.682 20 5 CHBDRO Cc1cccc(C)c1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000231884326 333331099 /nfs/dbraw/zinc/33/10/99/333331099.db2.gz IOYPBTUKBKMMFV-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO CC(C)C1CC([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000232539596 333338497 /nfs/dbraw/zinc/33/84/97/333338497.db2.gz IBKONBQFHWLXBM-LMWSTFAQSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000235306883 333367424 /nfs/dbraw/zinc/36/74/24/333367424.db2.gz ASTYUWBEDQQDOX-DGCLKSJQSA-N 1 0 262.353 3.509 20 5 CHBDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000524811131 333388968 /nfs/dbraw/zinc/38/89/68/333388968.db2.gz AHTCGYFVQFODLB-XJKSGUPXSA-N 1 0 276.380 3.995 20 5 CHBDRO Cc1ccccc1C[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000037777321 333539550 /nfs/dbraw/zinc/53/95/50/333539550.db2.gz QMZLJCLAOIUUDW-CQSZACIVSA-N 1 0 284.359 3.624 20 5 CHBDRO CC(C)=CCC[C@@H](C)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000540150828 333713601 /nfs/dbraw/zinc/71/36/01/333713601.db2.gz LWBBLUMECOIPAH-CQSZACIVSA-N 1 0 276.380 3.862 20 5 CHBDRO CCC[C@@H]([NH2+][C@H](CC)C(C)(C)O)c1cccc([N+](=O)[O-])c1 ZINC000340503821 335156968 /nfs/dbraw/zinc/15/69/68/335156968.db2.gz NUYUBUKYAADSDI-HUUCEWRRSA-N 1 0 294.395 3.575 20 5 CHBDRO C[C@H](C[NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000131242476 333913007 /nfs/dbraw/zinc/91/30/07/333913007.db2.gz HYWGTKZRPGFLBE-CQSZACIVSA-N 1 0 284.359 3.531 20 5 CHBDRO COCCC(C)(C)C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000546227738 334020933 /nfs/dbraw/zinc/02/09/33/334020933.db2.gz NIUFXSBRJNLWTJ-CYBMUJFWSA-N 1 0 294.395 3.617 20 5 CHBDRO CCC(CC)C[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000546582802 334038772 /nfs/dbraw/zinc/03/87/72/334038772.db2.gz YWOSUNYLIHLEAH-UHFFFAOYSA-N 1 0 264.369 3.856 20 5 CHBDRO CC[N@H+](CCC1CC1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000546932265 334055734 /nfs/dbraw/zinc/05/57/34/334055734.db2.gz VNXDHKUAXFAOFV-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO Cc1cc(F)ccc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000548161338 334144067 /nfs/dbraw/zinc/14/40/67/334144067.db2.gz IFAISHWEGGQRQN-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CCSCCC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000548790907 334174196 /nfs/dbraw/zinc/17/41/96/334174196.db2.gz SOYBYNAUZKNVJI-GFCCVEGCSA-N 1 0 282.409 3.697 20 5 CHBDRO CC(C)[C@H](C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000081045309 334177258 /nfs/dbraw/zinc/17/72/58/334177258.db2.gz HJAGBRYJAQUXJA-NEPJUHHUSA-N 1 0 250.342 3.538 20 5 CHBDRO CC[N@H+](CCc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000549208761 334187650 /nfs/dbraw/zinc/18/76/50/334187650.db2.gz RTKPNVKXFCRGOU-UHFFFAOYSA-N 1 0 298.386 3.968 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000245596517 334205910 /nfs/dbraw/zinc/20/59/10/334205910.db2.gz NEMQKOXEYWOOIC-XCCSTKFXSA-N 1 0 292.379 3.510 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@H]2F)cc1[N+](=O)[O-] ZINC000551307575 334245978 /nfs/dbraw/zinc/24/59/78/334245978.db2.gz RPENSCGBTLEPLK-RTXFEEFZSA-N 1 0 296.342 3.535 20 5 CHBDRO CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000552275334 334311442 /nfs/dbraw/zinc/31/14/42/334311442.db2.gz RTDHVHWBAIQMOM-SGMGOOAPSA-N 1 0 262.353 3.680 20 5 CHBDRO CC(C)[C@H]1CC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000552283016 334312993 /nfs/dbraw/zinc/31/29/93/334312993.db2.gz VCIIHFOSOPGKMD-OCCSQVGLSA-N 1 0 282.771 3.772 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000251922468 334372025 /nfs/dbraw/zinc/37/20/25/334372025.db2.gz USLCYRYVAJCDAL-YRGRVCCFSA-N 1 0 262.353 3.509 20 5 CHBDRO CC[C@H]1CC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000554108435 334412655 /nfs/dbraw/zinc/41/26/55/334412655.db2.gz FAKBHJSPWUMVMS-GOEBONIOSA-N 1 0 276.380 3.696 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000566678214 334659944 /nfs/dbraw/zinc/65/99/44/334659944.db2.gz XEWBOEAFVDDXKF-UHTWSYAYSA-N 1 0 266.316 3.526 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000384972612 336135239 /nfs/dbraw/zinc/13/52/39/336135239.db2.gz CDRPMRHNZYVZGT-GFCCVEGCSA-N 1 0 268.744 3.526 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000384972624 336135374 /nfs/dbraw/zinc/13/53/74/336135374.db2.gz CDRPMRHNZYVZGT-LBPRGKRZSA-N 1 0 268.744 3.526 20 5 CHBDRO CCOCC(C)(C)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000385573120 336151781 /nfs/dbraw/zinc/15/17/81/336151781.db2.gz UDDOIJXOQZBMBF-CYBMUJFWSA-N 1 0 294.395 3.617 20 5 CHBDRO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 ZINC000076901950 519322515 /nfs/dbraw/zinc/32/25/15/519322515.db2.gz OPGKUHHNNBHLEM-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000149611309 520776870 /nfs/dbraw/zinc/77/68/70/520776870.db2.gz XBCDNIOYTQGDGW-LSDHHAIUSA-N 1 0 294.420 3.921 20 5 CHBDRO CCC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000273615505 521159302 /nfs/dbraw/zinc/15/93/02/521159302.db2.gz XCVBLFLYNMYZBV-INIZCTEOSA-N 1 0 299.374 3.663 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000149558241 522617278 /nfs/dbraw/zinc/61/72/78/522617278.db2.gz HDTSXUWPIVSENS-KBPBESRZSA-N 1 0 280.393 3.531 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CCCO1 ZINC000246376160 522738218 /nfs/dbraw/zinc/73/82/18/522738218.db2.gz JRXXUNLBKFLGOD-INWMFGNUSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000037668297 522877314 /nfs/dbraw/zinc/87/73/14/522877314.db2.gz STUBNYAFTDNAOD-MRXNPFEDSA-N 1 0 270.332 3.836 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccsc2)cc1[N+](=O)[O-] ZINC000061361472 524604721 /nfs/dbraw/zinc/60/47/21/524604721.db2.gz XNORCMSLDNHDCB-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000037718977 525167790 /nfs/dbraw/zinc/16/77/90/525167790.db2.gz BSJSGXGPFPZRPZ-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000050344436 525367845 /nfs/dbraw/zinc/36/78/45/525367845.db2.gz VRKPJJMZJKANOK-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccsc1)c1ccc([N+](=O)[O-])cc1 ZINC000049153312 525465338 /nfs/dbraw/zinc/46/53/38/525465338.db2.gz ZXKAEXOYXXJDTN-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000020473284 525734510 /nfs/dbraw/zinc/73/45/10/525734510.db2.gz GNAAYNYHLWEKFL-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000156754254 525922666 /nfs/dbraw/zinc/92/26/66/525922666.db2.gz LCHOYVUTLIICGA-UBHSHLNASA-N 1 0 292.379 3.511 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1cccnc1 ZINC000347369043 527528570 /nfs/dbraw/zinc/52/85/70/527528570.db2.gz GYLOWEDYOISMCP-NTEUORMPSA-N 1 0 297.358 3.525 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1C[C@H]1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000348315655 528241116 /nfs/dbraw/zinc/24/11/16/528241116.db2.gz UQKIQQFMJQFBOM-AGIUHOORSA-N 1 0 284.306 3.679 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H](C)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000342274632 535804395 /nfs/dbraw/zinc/80/43/95/535804395.db2.gz WPANWJNAPIVMJJ-BXKDBHETSA-N 1 0 290.285 3.834 20 5 CHBDRO CC1(C)CCC[C@@H]1[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000149210067 1125462797 /nfs/dbraw/zinc/46/27/97/1125462797.db2.gz XRASEZZYRBPYKV-ZDUSSCGKSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1cccc(C(C)(C)C)c1O[C@@H](C)C[N+](C)(C)C ZINC001227991412 1131784055 /nfs/dbraw/zinc/78/40/55/1131784055.db2.gz FAXBQALDVLKQHR-AWEZNQCLSA-N 1 0 264.433 3.766 20 5 CHBDRO C[C@H]([NH2+]CCC1(F)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000348310380 1125521341 /nfs/dbraw/zinc/52/13/41/1125521341.db2.gz BXCGODNTEHHNCQ-NSHDSACASA-N 1 0 266.316 3.528 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000348325407 1125561089 /nfs/dbraw/zinc/56/10/89/1125561089.db2.gz LJIQMYJQJGLFOH-NFAWXSAZSA-N 1 0 280.343 3.916 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CC1CCCC1)C1CC1 ZINC000532747088 1125575621 /nfs/dbraw/zinc/57/56/21/1125575621.db2.gz ICPBWNRCWVRQJR-UHFFFAOYSA-N 1 0 274.364 3.749 20 5 CHBDRO C[N@H+](Cc1cccnc1[N+](=O)[O-])C1CCCCCCC1 ZINC000885973698 1125631653 /nfs/dbraw/zinc/63/16/53/1125631653.db2.gz YSMDVZHBJJMWIX-UHFFFAOYSA-N 1 0 277.368 3.535 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cccc(C2CC2)c1 ZINC000886221195 1125662869 /nfs/dbraw/zinc/66/28/69/1125662869.db2.gz VLJDBNVXVLTDCA-GFCCVEGCSA-N 1 0 297.358 3.718 20 5 CHBDRO C[C@@]1(c2ccccc2)CCC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886318076 1125668610 /nfs/dbraw/zinc/66/86/10/1125668610.db2.gz IXJYHLAWUQDRQY-KRWDZBQOSA-N 1 0 297.358 3.501 20 5 CHBDRO CO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000886615466 1125698019 /nfs/dbraw/zinc/69/80/19/1125698019.db2.gz HCHPRUNKFNAXJQ-JGGQBBKZSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+]C1(C2CC2)CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000886824594 1125720645 /nfs/dbraw/zinc/72/06/45/1125720645.db2.gz CGZLXIWRWVXUBT-JTQLQIEISA-N 1 0 278.327 3.717 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000090035851 1125738199 /nfs/dbraw/zinc/73/81/99/1125738199.db2.gz SMJVUIZKBWUZND-QWHCGFSZSA-N 1 0 260.337 3.663 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000159945214 1126759677 /nfs/dbraw/zinc/75/96/77/1126759677.db2.gz QAMOILVOCULAON-HIFRSBDPSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000482507476 1126762344 /nfs/dbraw/zinc/76/23/44/1126762344.db2.gz JNLYCRAWSMKSHQ-JSGCOSHPSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@@H]1[C@H](C)CC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000482515263 1126762651 /nfs/dbraw/zinc/76/26/51/1126762651.db2.gz VYLAIAMRJOYIDC-VEXXYJEVSA-N 1 0 274.364 3.728 20 5 CHBDRO CC[C@H]([NH2+]Cc1cncc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000181844749 1126861986 /nfs/dbraw/zinc/86/19/86/1126861986.db2.gz MYBZCGQOPZBJFI-INIZCTEOSA-N 1 0 285.347 3.539 20 5 CHBDRO C[N@H+](Cc1ccc(Cl)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000042977999 1126866520 /nfs/dbraw/zinc/86/65/20/1126866520.db2.gz DKQIFDLNXDWNGN-UHFFFAOYSA-N 1 0 290.750 3.880 20 5 CHBDRO OC1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000271049211 1127065514 /nfs/dbraw/zinc/06/55/14/1127065514.db2.gz UDMQOHPCXSCZBO-UHFFFAOYSA-N 1 0 291.394 3.950 20 5 CHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccncc1 ZINC000348898597 1127133545 /nfs/dbraw/zinc/13/35/45/1127133545.db2.gz YGBKWXPTPRFBLP-ALCCZGGFSA-N 1 0 297.358 3.525 20 5 CHBDRO C[C@@H](CC(F)(F)F)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000222262832 1127162205 /nfs/dbraw/zinc/16/22/05/1127162205.db2.gz AGCQSENNJJBJSW-ZETCQYMHSA-N 1 0 296.676 3.679 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C2CC2)CC1 ZINC000590006631 1127242486 /nfs/dbraw/zinc/24/24/86/1127242486.db2.gz LESUHKXQHREXGO-LBPRGKRZSA-N 1 0 274.364 3.778 20 5 CHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000286725374 1127273034 /nfs/dbraw/zinc/27/30/34/1127273034.db2.gz GSXQYUZPYIHBOG-UHFFFAOYSA-N 1 0 284.306 3.605 20 5 CHBDRO Cc1ccc(CN(C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)nc1 ZINC000590754360 1127270507 /nfs/dbraw/zinc/27/05/07/1127270507.db2.gz AIUGGGDACFPFSV-CQSZACIVSA-N 1 0 299.374 3.800 20 5 CHBDRO C[N@H+](CCCNc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000057877720 1127287604 /nfs/dbraw/zinc/28/76/04/1127287604.db2.gz QMMUBYRMKIYYFF-UHFFFAOYSA-N 1 0 299.374 3.529 20 5 CHBDRO Cc1ccc(CCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000354134929 1127296036 /nfs/dbraw/zinc/29/60/36/1127296036.db2.gz VUQQVZJILGSQBI-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000355108025 1127317924 /nfs/dbraw/zinc/31/79/24/1127317924.db2.gz KBYJZIVHXZCVIQ-QWRGUYRKSA-N 1 0 268.382 3.524 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)CC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000592392132 1127344346 /nfs/dbraw/zinc/34/43/46/1127344346.db2.gz BIOXHUYRPITUJM-VHSXEESVSA-N 1 0 272.295 3.537 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CC(F)F ZINC000592392129 1127344604 /nfs/dbraw/zinc/34/46/04/1127344604.db2.gz BIOXHUYRPITUJM-NXEZZACHSA-N 1 0 272.295 3.537 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)CC(F)F)cc1[N+](=O)[O-] ZINC000592392239 1127344936 /nfs/dbraw/zinc/34/49/36/1127344936.db2.gz JYZVUIMSPOKIGV-ONGXEEELSA-N 1 0 286.322 3.845 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761045771 1127408084 /nfs/dbraw/zinc/40/80/84/1127408084.db2.gz QZLYSMHFCFWEBS-VHSXEESVSA-N 1 0 288.269 3.540 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761045769 1127408136 /nfs/dbraw/zinc/40/81/36/1127408136.db2.gz QZLYSMHFCFWEBS-UWVGGRQHSA-N 1 0 288.269 3.540 20 5 CHBDRO CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000059037343 1127410858 /nfs/dbraw/zinc/41/08/58/1127410858.db2.gz ZBFJJNKTAMKSGT-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000358408199 1127420041 /nfs/dbraw/zinc/42/00/41/1127420041.db2.gz SBQJEXZGCHWPQT-KGLIPLIRSA-N 1 0 299.374 3.580 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594515839 1127420224 /nfs/dbraw/zinc/42/02/24/1127420224.db2.gz SUUHSGWAZSPBJV-ZIAGYGMSSA-N 1 0 299.374 3.580 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)Cc1ccccn1 ZINC000594516566 1127421067 /nfs/dbraw/zinc/42/10/67/1127421067.db2.gz XKXXRBGNKWVBAI-KBPBESRZSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@]1(CC[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC1(F)F ZINC000594977377 1127438147 /nfs/dbraw/zinc/43/81/47/1127438147.db2.gz KZVLOCGDHDNECL-YVZNUBBCSA-N 1 0 296.317 3.633 20 5 CHBDRO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1CCC(F)CC1 ZINC000594988598 1127443936 /nfs/dbraw/zinc/44/39/36/1127443936.db2.gz AJTIECJAAPUERB-OIKLOGQESA-N 1 0 286.372 3.663 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000595005183 1127445308 /nfs/dbraw/zinc/44/53/08/1127445308.db2.gz DSFGGWPPATXPTO-WCQYABFASA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000595050141 1127450989 /nfs/dbraw/zinc/45/09/89/1127450989.db2.gz QDXLQVHWZOOIRL-JSGCOSHPSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000595079222 1127453410 /nfs/dbraw/zinc/45/34/10/1127453410.db2.gz ISFOJQMTXBDOAW-GXFFZTMASA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCC(C)(C)F)cccc1[N+](=O)[O-] ZINC000595086515 1127453981 /nfs/dbraw/zinc/45/39/81/1127453981.db2.gz KOJKZXJUUDODAA-NSHDSACASA-N 1 0 268.332 3.692 20 5 CHBDRO CC[C@@H]([NH2+]CCC(C)(C)F)c1cccc([N+](=O)[O-])c1 ZINC000595086604 1127454209 /nfs/dbraw/zinc/45/42/09/1127454209.db2.gz MCLPEHIEHTZZDD-CYBMUJFWSA-N 1 0 268.332 3.774 20 5 CHBDRO CC(C)CC1([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000595095379 1127455469 /nfs/dbraw/zinc/45/54/69/1127455469.db2.gz LZJXDRPTNKSMMT-GFCCVEGCSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)cccc1[N+](=O)[O-] ZINC000595095013 1127455567 /nfs/dbraw/zinc/45/55/67/1127455567.db2.gz SVBTUVWBWKMKNN-MFKMUULPSA-N 1 0 298.333 3.845 20 5 CHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000359303809 1127457676 /nfs/dbraw/zinc/45/76/76/1127457676.db2.gz PTNWVJMWCGBYRL-RISCZKNCSA-N 1 0 280.393 3.668 20 5 CHBDRO Cc1noc(C[N@@H+]2CCC[C@H](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000595321183 1127459327 /nfs/dbraw/zinc/45/93/27/1127459327.db2.gz KTIFFIJGHHBYCW-LBPRGKRZSA-N 1 0 295.383 3.539 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000059971454 1127482772 /nfs/dbraw/zinc/48/27/72/1127482772.db2.gz WQLFYZODIHCJTQ-CXAGYDPISA-N 1 0 296.370 3.803 20 5 CHBDRO Cc1cc(N(C)Cc2ccoc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000360979512 1127526369 /nfs/dbraw/zinc/52/63/69/1127526369.db2.gz VUTVXKVLNUWMHW-UHFFFAOYSA-N 1 0 297.314 3.681 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H](CCF)C1 ZINC000597212104 1127533785 /nfs/dbraw/zinc/53/37/85/1127533785.db2.gz RSKQSCWYAMMDAT-HJHHMULASA-N 1 0 292.354 3.680 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1OC)c1cccc([N+](=O)[O-])c1 ZINC000361755447 1127586909 /nfs/dbraw/zinc/58/69/09/1127586909.db2.gz QTCZFIJGEMDGEB-ARFHVFGLSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C23CC(c4ccccc4)(C2)C3)c1 ZINC000603427731 1127648213 /nfs/dbraw/zinc/64/82/13/1127648213.db2.gz DODVUPZVNOGISX-UHFFFAOYSA-N 1 0 294.354 3.559 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1CC=CC1)CCC2 ZINC000599063608 1127654420 /nfs/dbraw/zinc/65/44/20/1127654420.db2.gz DTVILQYAFXVXOV-MRXNPFEDSA-N 1 0 272.348 3.528 20 5 CHBDRO CCC[C@@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)OCC ZINC000599061684 1127654463 /nfs/dbraw/zinc/65/44/63/1127654463.db2.gz QZLXHBVTCMYNLG-ZFWWWQNUSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]12 ZINC000603662029 1127665052 /nfs/dbraw/zinc/66/50/52/1127665052.db2.gz BDADJFSWWDQPBG-KBRIMQKVSA-N 1 0 288.391 3.995 20 5 CHBDRO Cc1c(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000599512457 1127676721 /nfs/dbraw/zinc/67/67/21/1127676721.db2.gz JXJIOGIIIKFJHS-GHMZBOCLSA-N 1 0 298.333 3.626 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cncc(F)c1 ZINC000296582945 1127677279 /nfs/dbraw/zinc/67/72/79/1127677279.db2.gz DYDJSFLCUHZVJE-WDEREUQCSA-N 1 0 289.310 3.541 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](CC2CC(F)(F)C2)C2CC2)c1 ZINC000296693406 1127681976 /nfs/dbraw/zinc/68/19/76/1127681976.db2.gz DDBJOJXSXPACEY-UHFFFAOYSA-N 1 0 296.317 3.605 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594499284 1127903328 /nfs/dbraw/zinc/90/33/28/1127903328.db2.gz BYPWOVXROGIBRL-FZMZJTMJSA-N 1 0 262.353 3.606 20 5 CHBDRO Cc1ccc(C[N@@H+]2C[C@@H](C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000539824827 1127940836 /nfs/dbraw/zinc/94/08/36/1127940836.db2.gz LGHUFINXMASNRK-WCQYABFASA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1ccc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000539827070 1127945020 /nfs/dbraw/zinc/94/50/20/1127945020.db2.gz WDLUVIJUQPEHSO-HUUCEWRRSA-N 1 0 274.364 3.525 20 5 CHBDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000466903936 1127949634 /nfs/dbraw/zinc/94/96/34/1127949634.db2.gz BALZSDCOPXRKLB-BXUZGUMPSA-N 1 0 262.353 3.524 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543855682 1127949878 /nfs/dbraw/zinc/94/98/78/1127949878.db2.gz KCZAWRADBBZALC-SNVBAGLBSA-N 1 0 270.760 3.869 20 5 CHBDRO C[C@H]([NH2+]C1CCC(F)(F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000540153867 1127964955 /nfs/dbraw/zinc/96/49/55/1127964955.db2.gz IJQNJQXPEKIOME-JTQLQIEISA-N 1 0 284.306 3.823 20 5 CHBDRO CC/C=C/CC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000467454363 1127969840 /nfs/dbraw/zinc/96/98/40/1127969840.db2.gz PABYFKKGYDUCHK-GFUIURDCSA-N 1 0 262.353 3.910 20 5 CHBDRO CC1=CCC[C@@H](C)[C@@H]1C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468003092 1127987530 /nfs/dbraw/zinc/98/75/30/1127987530.db2.gz HPPIDHCTGHWSSP-GDBMZVCRSA-N 1 0 288.391 3.719 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC[C@H](C)C1 ZINC000468257580 1128000467 /nfs/dbraw/zinc/00/04/67/1128000467.db2.gz SUNANIUJYJEGTC-QWHCGFSZSA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC[C@H](C)C1 ZINC000468260565 1128000312 /nfs/dbraw/zinc/00/03/12/1128000312.db2.gz KYKAOOKDXIHWFW-QWHCGFSZSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1noc(C[N@H+]2CC[C@@H](C(C)(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000595497489 1128003196 /nfs/dbraw/zinc/00/31/96/1128003196.db2.gz OOMVEWZUAQBGFU-CMPLNLGQSA-N 1 0 295.383 3.538 20 5 CHBDRO CC(C)[C@@H]1CCC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000468443898 1128008204 /nfs/dbraw/zinc/00/82/04/1128008204.db2.gz HIMSLCQQOAVBBW-JKSUJKDBSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@H]2CCCC[C@@H]12 ZINC000542040501 1128048823 /nfs/dbraw/zinc/04/88/23/1128048823.db2.gz LCIRLVLNHXGBGD-WXHSDQCUSA-N 1 0 280.393 3.667 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]1C(C)C ZINC000470175501 1128064732 /nfs/dbraw/zinc/06/47/32/1128064732.db2.gz ZBZHAUSLVKYSCM-LRFDDAOPSA-N 1 0 274.364 3.728 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000470178433 1128065164 /nfs/dbraw/zinc/06/51/64/1128065164.db2.gz YKNZYUDJEYOEDW-UKVVFRCISA-N 1 0 286.375 3.730 20 5 CHBDRO CCOc1cc(C[N@H+]2[C@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492629367 1128106602 /nfs/dbraw/zinc/10/66/02/1128106602.db2.gz KCUBHLLCROAKCE-BETUJISGSA-N 1 0 292.379 3.756 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@@H](C)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492788329 1128113344 /nfs/dbraw/zinc/11/33/44/1128113344.db2.gz IFNVYXNOICICCG-STQMWFEESA-N 1 0 292.379 3.614 20 5 CHBDRO CC1(C)CCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493002900 1128119628 /nfs/dbraw/zinc/11/96/28/1128119628.db2.gz KAXAKJNYONVFTA-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000324187808 1128136097 /nfs/dbraw/zinc/13/60/97/1128136097.db2.gz YODVRDLPJPRBQR-XHDPSFHLSA-N 1 0 262.353 3.680 20 5 CHBDRO CCCCN(CC)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494176956 1128158051 /nfs/dbraw/zinc/15/80/51/1128158051.db2.gz SZBOWFGVBHOMAS-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1 ZINC000152955433 1128159168 /nfs/dbraw/zinc/15/91/68/1128159168.db2.gz OMQVIGNPYSFKSX-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000609195404 1128171061 /nfs/dbraw/zinc/17/10/61/1128171061.db2.gz FUQLOWQATNIRJB-OAHLLOKOSA-N 1 0 276.380 3.914 20 5 CHBDRO Cc1cnc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000926954679 1128205996 /nfs/dbraw/zinc/20/59/96/1128205996.db2.gz MRPXMCDFEBOIBU-CQSZACIVSA-N 1 0 299.374 3.766 20 5 CHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCSC1 ZINC000495079244 1128229025 /nfs/dbraw/zinc/22/90/25/1128229025.db2.gz MWJLEGKBGUJELX-CQSZACIVSA-N 1 0 294.420 3.558 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCC1 ZINC000495421931 1128281810 /nfs/dbraw/zinc/28/18/10/1128281810.db2.gz WPHLWEQLQITMRB-JTQLQIEISA-N 1 0 282.771 3.569 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000562066864 1128375984 /nfs/dbraw/zinc/37/59/84/1128375984.db2.gz XZUNCBGQDXPBBG-ABAIWWIYSA-N 1 0 292.379 3.833 20 5 CHBDRO CC(C)=CCC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000562310986 1128394519 /nfs/dbraw/zinc/39/45/19/1128394519.db2.gz OHCNKFRNYRPHCP-ZDUSSCGKSA-N 1 0 262.353 3.910 20 5 CHBDRO CCC[C@@H](CC)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000564124775 1128494379 /nfs/dbraw/zinc/49/43/79/1128494379.db2.gz QWRONPFWZOPWSX-CYBMUJFWSA-N 1 0 289.379 3.787 20 5 CHBDRO CCC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000174846624 1128506876 /nfs/dbraw/zinc/50/68/76/1128506876.db2.gz WTYZAKBWQBQMAB-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CC1(C)C[C@H]([NH2+]C2(C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000565399558 1128525648 /nfs/dbraw/zinc/52/56/48/1128525648.db2.gz CZWZOONEMYIDIR-HNNXBMFYSA-N 1 0 286.375 3.849 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(Cl)c1 ZINC000042366032 1128575534 /nfs/dbraw/zinc/57/55/34/1128575534.db2.gz ITJHLGNXHQMRKC-UHFFFAOYSA-N 1 0 290.750 3.880 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1cccs1 ZINC000155586593 1128608513 /nfs/dbraw/zinc/60/85/13/1128608513.db2.gz BXKMKFSWEXVNPG-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@@H](F)C1 ZINC000570720117 1128630700 /nfs/dbraw/zinc/63/07/00/1128630700.db2.gz ZVLDHTVUGOKUKC-YUELXQCFSA-N 1 0 294.370 3.786 20 5 CHBDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000601150202 1128700958 /nfs/dbraw/zinc/70/09/58/1128700958.db2.gz YAAMGSQFMJXJNY-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@]12C[C@@H]1CCCC2 ZINC000601149852 1128701308 /nfs/dbraw/zinc/70/13/08/1128701308.db2.gz QSMRNRMTXYGZHF-NDRBSLDKSA-N 1 0 272.348 3.530 20 5 CHBDRO Cc1ncc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2C)s1 ZINC000601149408 1128701323 /nfs/dbraw/zinc/70/13/23/1128701323.db2.gz JYDXLLWPCLMUNU-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO Cc1c(C[NH+]2CCc3ccccc3CC2)cccc1[N+](=O)[O-] ZINC000609705571 1128722792 /nfs/dbraw/zinc/72/27/92/1128722792.db2.gz DXRACDJNNPLBGW-UHFFFAOYSA-N 1 0 296.370 3.504 20 5 CHBDRO Cc1cccc(C)c1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000610000992 1128734457 /nfs/dbraw/zinc/73/44/57/1128734457.db2.gz LRMIZHAAMKXRGE-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000430194002 1117841212 /nfs/dbraw/zinc/84/12/12/1117841212.db2.gz HSARYLYYBFSMDN-OCCSQVGLSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@@H](C)[C@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000064808238 1117879531 /nfs/dbraw/zinc/87/95/31/1117879531.db2.gz LIGHQTXNIJNEPO-OLZOCXBDSA-N 1 0 276.380 3.994 20 5 CHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000610215476 1117881994 /nfs/dbraw/zinc/88/19/94/1117881994.db2.gz YFNVAUZJTUMUNJ-NWDGAFQWSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610215478 1117882013 /nfs/dbraw/zinc/88/20/13/1117882013.db2.gz YFNVAUZJTUMUNJ-VXGBXAGGSA-N 1 0 280.343 3.744 20 5 CHBDRO CC1(C)C[C@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000608836501 1117882066 /nfs/dbraw/zinc/88/20/66/1117882066.db2.gz NGEGPQUCYJFQCY-OAHLLOKOSA-N 1 0 286.331 3.743 20 5 CHBDRO CC1=C[C@@H](C)C[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000430284716 1117992775 /nfs/dbraw/zinc/99/27/75/1117992775.db2.gz OVDUSJLZULTVCY-YPMHNXCESA-N 1 0 260.337 3.554 20 5 CHBDRO Cc1ccsc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000037775535 1118037629 /nfs/dbraw/zinc/03/76/29/1118037629.db2.gz QJTGOESBMWCYHL-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@H]1C[C@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001648800231 1118125838 /nfs/dbraw/zinc/12/58/38/1118125838.db2.gz XZXLBKFKEVKLPT-AAEUAGOBSA-N 1 0 286.331 3.600 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCC(F)(F)C1 ZINC000615721952 1128760829 /nfs/dbraw/zinc/76/08/29/1128760829.db2.gz MNRVKJVMIHEPOD-YLBKJLTLSA-N 1 0 296.317 3.776 20 5 CHBDRO O=[N+]([O-])c1cccc(CNc2cc[nH+]c3cc(F)ccc23)c1 ZINC000301296452 1118193678 /nfs/dbraw/zinc/19/36/78/1118193678.db2.gz VSVIIFNXFBFCPX-UHFFFAOYSA-N 1 0 297.289 3.894 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1F ZINC000610340766 1118333428 /nfs/dbraw/zinc/33/34/28/1118333428.db2.gz VZZPZJATFWHMFF-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO COc1ccc(C[NH+]2C3CCCC2CCC3)cc1[N+](=O)[O-] ZINC000610369926 1118362210 /nfs/dbraw/zinc/36/22/10/1118362210.db2.gz AKIRBQFXVUPRDD-UHFFFAOYSA-N 1 0 290.363 3.510 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000579749218 1118484769 /nfs/dbraw/zinc/48/47/69/1118484769.db2.gz MCRBMKIBUBVCOA-CABCVRRESA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ncc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000616357421 1128787280 /nfs/dbraw/zinc/78/72/80/1128787280.db2.gz AGTGTSFMSGNZPP-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000610518177 1118641425 /nfs/dbraw/zinc/64/14/25/1118641425.db2.gz ZBFHKMZCNACZLK-MRXNPFEDSA-N 1 0 285.347 3.539 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000132492224 1118645401 /nfs/dbraw/zinc/64/54/01/1118645401.db2.gz MBQVGZLATCNJMS-ZDUSSCGKSA-N 1 0 262.353 3.572 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC000090856344 1118646008 /nfs/dbraw/zinc/64/60/08/1118646008.db2.gz FVGLRIRSFYSJSF-NWDGAFQWSA-N 1 0 292.379 3.833 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)C[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000090918460 1118688860 /nfs/dbraw/zinc/68/88/60/1118688860.db2.gz GRTMLPHWZDPCTE-KCXAZCMYSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccsc1 ZINC000090910226 1118691705 /nfs/dbraw/zinc/69/17/05/1118691705.db2.gz UWWOKYUFBJHUJY-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000033299959 1118721853 /nfs/dbraw/zinc/72/18/53/1118721853.db2.gz QORYOCYECXKNSZ-XFFZJAGNSA-N 1 0 282.343 3.740 20 5 CHBDRO CC1(C)CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000510535152 1118767026 /nfs/dbraw/zinc/76/70/26/1118767026.db2.gz SUIVWSJSPSEZKP-YVMONPNESA-N 1 0 274.364 3.730 20 5 CHBDRO CN(Cc1cc2ccccc2[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC000610619776 1118798614 /nfs/dbraw/zinc/79/86/14/1118798614.db2.gz YSVJSWJRFZNYFI-UHFFFAOYSA-N 1 0 295.342 3.708 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CC1 ZINC000610805353 1118893433 /nfs/dbraw/zinc/89/34/33/1118893433.db2.gz VVDRCJWFNDSVSZ-LRDDRELGSA-N 1 0 288.391 3.552 20 5 CHBDRO Cc1occc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000610805242 1118893921 /nfs/dbraw/zinc/89/39/21/1118893921.db2.gz HIPUABZMDMYGOF-NSHDSACASA-N 1 0 274.320 3.655 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CC[C@H](F)C2)cc1[N+](=O)[O-] ZINC000342295666 1118968961 /nfs/dbraw/zinc/96/89/61/1118968961.db2.gz IPZGSEXOIPGVOR-STQMWFEESA-N 1 0 280.343 3.698 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CC[C@H]2C2CCC2)c(Cl)c1 ZINC000511044553 1118973051 /nfs/dbraw/zinc/97/30/51/1118973051.db2.gz BXZTXLYYYCPMKB-ZFWWWQNUSA-N 1 0 294.782 3.917 20 5 CHBDRO CC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000132692837 1119045943 /nfs/dbraw/zinc/04/59/43/1119045943.db2.gz HPFOQMXHAGQRLD-YWPYICTPSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000050443686 1119124257 /nfs/dbraw/zinc/12/42/57/1119124257.db2.gz PIUGDZJJVMQCDB-ZJUUUORDSA-N 1 0 270.760 3.772 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCCCC2(C)C)cc1[N+](=O)[O-] ZINC000094323619 1128840143 /nfs/dbraw/zinc/84/01/43/1128840143.db2.gz ROJHKVAKAWZRBI-OAHLLOKOSA-N 1 0 276.380 3.962 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccncc2)C1 ZINC000583603106 1119384411 /nfs/dbraw/zinc/38/44/11/1119384411.db2.gz UUMXNDKARUPQEH-UKRRQHHQSA-N 1 0 297.358 3.540 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000340525761 1119514719 /nfs/dbraw/zinc/51/47/19/1119514719.db2.gz XTXYKZYFLFXBQM-MELADBBJSA-N 1 0 266.316 3.526 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cs1 ZINC000294233432 1119623171 /nfs/dbraw/zinc/62/31/71/1119623171.db2.gz OLJPEBJBZABPQK-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc(C[NH2+]C2(C)CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000612192026 1119747763 /nfs/dbraw/zinc/74/77/63/1119747763.db2.gz IUVVPOFPBMGGNQ-UHFFFAOYSA-N 1 0 298.333 3.961 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1C[C@H]1C ZINC000414150602 1119918777 /nfs/dbraw/zinc/91/87/77/1119918777.db2.gz VTHRRZFPZWPYIX-PKIAMQTDSA-N 1 0 262.353 3.680 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2)cc1[N+](=O)[O-] ZINC000414153613 1119919643 /nfs/dbraw/zinc/91/96/43/1119919643.db2.gz ZTIFKRMXJJGDQD-YUELXQCFSA-N 1 0 292.379 3.510 20 5 CHBDRO COC1CCC([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000414167072 1119923870 /nfs/dbraw/zinc/92/38/70/1119923870.db2.gz FVSXSZKLBBHJMP-IYXRBSQSSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCCOC(C)C)cc1[N+](=O)[O-] ZINC000180454520 1120098268 /nfs/dbraw/zinc/09/82/68/1120098268.db2.gz KLRXFOGTLPMRBQ-AWEZNQCLSA-N 1 0 294.395 3.759 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCC(F)(F)C2)c1 ZINC000311796553 1120107332 /nfs/dbraw/zinc/10/73/32/1120107332.db2.gz BAEZFVTWPMWPSX-VIFPVBQESA-N 1 0 290.697 3.526 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1CC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000926890488 1120198400 /nfs/dbraw/zinc/19/84/00/1120198400.db2.gz DEGNSOJPOWXWRR-ZJUUUORDSA-N 1 0 284.306 3.679 20 5 CHBDRO Cc1cccc([C@@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000541388096 1120314981 /nfs/dbraw/zinc/31/49/81/1120314981.db2.gz ZRJBWRAHASTTMW-QGZVFWFLSA-N 1 0 296.370 3.893 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccco1)CCCC2 ZINC000417299627 1120423526 /nfs/dbraw/zinc/42/35/26/1120423526.db2.gz NHMUYSVBVZXCLM-INIZCTEOSA-N 1 0 286.331 3.745 20 5 CHBDRO CS[C@H](C)C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314232 1120425786 /nfs/dbraw/zinc/42/57/86/1120425786.db2.gz YKWPVGRTVAQJTE-IAQYHMDHSA-N 1 0 294.420 3.703 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618561385 1128918757 /nfs/dbraw/zinc/91/87/57/1128918757.db2.gz CQQUECAQFZUKAM-IAQYHMDHSA-N 1 0 262.353 3.750 20 5 CHBDRO Cc1occc1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618567132 1128919745 /nfs/dbraw/zinc/91/97/45/1128919745.db2.gz WHCVHQQBNXDHEE-INIZCTEOSA-N 1 0 286.331 3.663 20 5 CHBDRO C[C@@H](c1cccs1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000053428446 1120497540 /nfs/dbraw/zinc/49/75/40/1120497540.db2.gz CLWIUNZMVOCVIC-NSHDSACASA-N 1 0 276.361 3.849 20 5 CHBDRO CO[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C(C)(C)C ZINC000154945172 1120565480 /nfs/dbraw/zinc/56/54/80/1120565480.db2.gz ZWLPXJIVNAJMJZ-IUODEOHRSA-N 1 0 294.395 3.615 20 5 CHBDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000154931618 1120565671 /nfs/dbraw/zinc/56/56/71/1120565671.db2.gz TZWWLMOHCJUFGH-SWLSCSKDSA-N 1 0 294.395 3.615 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1ccc2occc2c1 ZINC000511753147 1120637864 /nfs/dbraw/zinc/63/78/64/1120637864.db2.gz FOLAVOCEJKGECD-UHFFFAOYSA-N 1 0 296.326 3.673 20 5 CHBDRO Cc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000225781418 1120652456 /nfs/dbraw/zinc/65/24/56/1120652456.db2.gz JJVDNQMRYNTEBQ-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000132456756 1120691426 /nfs/dbraw/zinc/69/14/26/1120691426.db2.gz QHSWJXQQUZSBAO-HIFRSBDPSA-N 1 0 294.420 3.921 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000132493467 1120692568 /nfs/dbraw/zinc/69/25/68/1120692568.db2.gz VOSSMUFFFZYVSO-LNSITVRQSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)[C@@H]1CCCO1 ZINC000090857657 1128933901 /nfs/dbraw/zinc/93/39/01/1128933901.db2.gz WMBLVIVYXIQSGB-NOLJZWGESA-N 1 0 292.379 3.511 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)C(C)C ZINC000112629144 1120840031 /nfs/dbraw/zinc/84/00/31/1120840031.db2.gz FUSKAPLONTWTNC-CYBMUJFWSA-N 1 0 264.369 3.504 20 5 CHBDRO CS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000300405530 1120916123 /nfs/dbraw/zinc/91/61/23/1120916123.db2.gz MPATYMUPXHUGTA-KCPJHIHWSA-N 1 0 294.420 3.920 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000511970253 1120946641 /nfs/dbraw/zinc/94/66/41/1120946641.db2.gz BVRYCWBQXWWRIV-GFCCVEGCSA-N 1 0 286.331 3.697 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493002272 1120965103 /nfs/dbraw/zinc/96/51/03/1120965103.db2.gz IFBOMATWYUKCFZ-JTQLQIEISA-N 1 0 268.744 3.623 20 5 CHBDRO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000032132146 1121054646 /nfs/dbraw/zinc/05/46/46/1121054646.db2.gz QKKGJBCRUWXLRD-UHFFFAOYSA-N 1 0 270.332 3.535 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CNCc2ccoc2)o1 ZINC000171050679 1121088183 /nfs/dbraw/zinc/08/81/83/1121088183.db2.gz SKPNWKNZXUMEGS-UHFFFAOYSA-N 1 0 298.298 3.738 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000222200531 1121104064 /nfs/dbraw/zinc/10/40/64/1121104064.db2.gz PABXHQSJWYANCN-OSMZGAPFSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000512230856 1121212681 /nfs/dbraw/zinc/21/26/81/1121212681.db2.gz VJLNWKNJRNKMRF-QQBNSCQMSA-N 1 0 276.380 3.974 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000174995528 1121312976 /nfs/dbraw/zinc/31/29/76/1121312976.db2.gz AZDLWDYEDBLVAH-HNNXBMFYSA-N 1 0 286.306 3.511 20 5 CHBDRO CC(C)(C)C(=[NH2+])Nc1ccnc2c1cccc2[N+](=O)[O-] ZINC001162665584 1121329065 /nfs/dbraw/zinc/32/90/65/1121329065.db2.gz JFIMKLYHEKHWBX-UHFFFAOYSA-N 1 0 272.308 3.578 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)C(C)C ZINC000706418026 1121429288 /nfs/dbraw/zinc/42/92/88/1121429288.db2.gz DZPJOOZBOSXJKZ-LLVKDONJSA-N 1 0 268.332 3.600 20 5 CHBDRO C[C@@H]1CC[C@@H](C)[NH+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000707145539 1121448734 /nfs/dbraw/zinc/44/87/34/1121448734.db2.gz RRSNUCFDZSZRPH-NXEZZACHSA-N 1 0 268.744 3.621 20 5 CHBDRO Cc1nc2ccccn2c1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175898946 1121491974 /nfs/dbraw/zinc/49/19/74/1121491974.db2.gz GMOGRKHKYRXBTM-PKNBQFBNSA-N 1 0 294.314 3.634 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC=C(C)CC1 ZINC000470181799 1121533988 /nfs/dbraw/zinc/53/39/88/1121533988.db2.gz HBJXEWVPSMQCIK-GXDHUFHOSA-N 1 0 272.348 3.650 20 5 CHBDRO CC(C)=CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433095870 1121568870 /nfs/dbraw/zinc/56/88/70/1121568870.db2.gz ZULHSXPXJBMSSM-OAHLLOKOSA-N 1 0 274.364 3.873 20 5 CHBDRO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000037096132 1121600470 /nfs/dbraw/zinc/60/04/70/1121600470.db2.gz SZSABBQJDSASNY-UHFFFAOYSA-N 1 0 270.760 3.869 20 5 CHBDRO CO[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000611337058 1121638202 /nfs/dbraw/zinc/63/82/02/1121638202.db2.gz KNYLHSSKJBBKBB-BPLDGKMQSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000611408970 1121644862 /nfs/dbraw/zinc/64/48/62/1121644862.db2.gz JOVWDXYRIRHAJQ-LLVKDONJSA-N 1 0 280.343 3.792 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000619785417 1129013466 /nfs/dbraw/zinc/01/34/66/1129013466.db2.gz QYJBZZBBXPNIPV-GOSISDBHSA-N 1 0 296.370 3.757 20 5 CHBDRO CCOc1cc(C[NH2+]C(C(C)C)C(C)C)ccc1[N+](=O)[O-] ZINC000617217464 1122039836 /nfs/dbraw/zinc/03/98/36/1122039836.db2.gz ANNILSMBTYIXHR-UHFFFAOYSA-N 1 0 294.395 3.764 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2C[C@H](c3ccccc3)C2)cc1 ZINC001181304042 1122049037 /nfs/dbraw/zinc/04/90/37/1122049037.db2.gz CTRLXVNIUNNPIH-QAQDUYKDSA-N 1 0 296.370 3.673 20 5 CHBDRO C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001183822801 1122242028 /nfs/dbraw/zinc/24/20/28/1122242028.db2.gz MYSRQTWSADBTNZ-FOUMNBMASA-N 1 0 294.782 3.630 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(C)o1 ZINC001203271188 1122258141 /nfs/dbraw/zinc/25/81/41/1122258141.db2.gz QNKBVSXORLQDRV-XYOKQWHBSA-N 1 0 286.331 3.689 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000505337650 1122357636 /nfs/dbraw/zinc/35/76/36/1122357636.db2.gz KUEHVBCJJRNQMI-CLFYSBASSA-N 1 0 274.364 3.873 20 5 CHBDRO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(C)C ZINC000434835157 1122416189 /nfs/dbraw/zinc/41/61/89/1122416189.db2.gz ZBFCXQZOVPYQOB-UHFFFAOYSA-N 1 0 291.351 3.604 20 5 CHBDRO Cc1ccsc1CN(C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505564131 1122420998 /nfs/dbraw/zinc/42/09/98/1122420998.db2.gz LHICIDDCCPORTG-UHFFFAOYSA-N 1 0 294.351 3.736 20 5 CHBDRO Cc1c(C[NH2+][C@@H](c2ccccn2)C(C)C)cccc1[N+](=O)[O-] ZINC000775448944 1122591252 /nfs/dbraw/zinc/59/12/52/1122591252.db2.gz MEVHIQZCOIDDNP-QGZVFWFLSA-N 1 0 299.374 3.785 20 5 CHBDRO CCCC[N@H+](CC)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000505908656 1122598738 /nfs/dbraw/zinc/59/87/38/1122598738.db2.gz ZJPIVEFDDLFJSA-CSKARUKUSA-N 1 0 262.353 3.730 20 5 CHBDRO CCC1(CC)CCC[N@H+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC001193430324 1122691435 /nfs/dbraw/zinc/69/14/35/1122691435.db2.gz HDAKEEXIAKNBNJ-UHFFFAOYSA-N 1 0 291.395 3.782 20 5 CHBDRO Cc1nc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)cs1 ZINC000126583055 1122707311 /nfs/dbraw/zinc/70/73/11/1122707311.db2.gz VBVONYGKYVHAQY-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO COc1ccc(C[NH+]2CCCCCCCC2)cc1[N+](=O)[O-] ZINC001194401512 1122772530 /nfs/dbraw/zinc/77/25/30/1122772530.db2.gz SCXXNJYREDYWNK-UHFFFAOYSA-N 1 0 292.379 3.760 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1(C)CCCC1 ZINC000426496171 1122806592 /nfs/dbraw/zinc/80/65/92/1122806592.db2.gz JIHHUDNGXPKLMZ-CLFYSBASSA-N 1 0 274.364 3.873 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@H]2CCC[C@H]21 ZINC000426524701 1122812223 /nfs/dbraw/zinc/81/22/23/1122812223.db2.gz PNQPWWYAGKGMAB-ZWNOBZJWSA-N 1 0 280.755 3.623 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]3CCC[C@H]32)c(Cl)c1 ZINC000426525044 1122814342 /nfs/dbraw/zinc/81/43/42/1122814342.db2.gz QCDTYULCFMMBKH-IINYFYTJSA-N 1 0 280.755 3.623 20 5 CHBDRO Cc1ccc(C[N@H+](C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000506751213 1122821716 /nfs/dbraw/zinc/82/17/16/1122821716.db2.gz IABYJZXORWKDHW-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1C(C)(C)C ZINC001195279151 1122860126 /nfs/dbraw/zinc/86/01/26/1122860126.db2.gz NAKHHFBUDJJEIB-UONOGXRCSA-N 1 0 291.395 3.636 20 5 CHBDRO CCCC[N@H+](CC)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037403786 1123028452 /nfs/dbraw/zinc/02/84/52/1123028452.db2.gz BUUYRBXUZBFBRK-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cs1 ZINC000294304334 1123143176 /nfs/dbraw/zinc/14/31/76/1123143176.db2.gz VJRWSACCUCAAGG-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO CCC(C)(C)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000229026170 1123213709 /nfs/dbraw/zinc/21/37/09/1123213709.db2.gz DSRBRRSKEPOREP-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C=CCC3)o2)cc1 ZINC000850358803 1123256286 /nfs/dbraw/zinc/25/62/86/1123256286.db2.gz LSOCHWCUXSSHOD-CYBMUJFWSA-N 1 0 284.315 3.663 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)C1(C)CC1 ZINC000776882202 1123558201 /nfs/dbraw/zinc/55/82/01/1123558201.db2.gz OJBTZUMHNZAKFT-NWDGAFQWSA-N 1 0 262.353 3.742 20 5 CHBDRO C/C=C/C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000862530177 1123816229 /nfs/dbraw/zinc/81/62/29/1123816229.db2.gz JWWHZLUVWOWJOB-NSCUHMNNSA-N 1 0 275.135 3.567 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000865581075 1123997355 /nfs/dbraw/zinc/99/73/55/1123997355.db2.gz JPWQVKSBMNNNDN-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC(C)[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000866274194 1124045648 /nfs/dbraw/zinc/04/56/48/1124045648.db2.gz HWINMKUHZHWDBL-QGZVFWFLSA-N 1 0 299.374 3.519 20 5 CHBDRO C[C@@H](CCc1cccnc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000866365758 1124058224 /nfs/dbraw/zinc/05/82/24/1124058224.db2.gz WVJDGCACWDNSAX-KBPBESRZSA-N 1 0 299.374 3.662 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@@H]1CCSC1 ZINC000866403838 1124063377 /nfs/dbraw/zinc/06/33/77/1124063377.db2.gz WTXPEEFXBQKAIK-QWHCGFSZSA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@@H]1CCCCC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000088512766 1124064193 /nfs/dbraw/zinc/06/41/93/1124064193.db2.gz PMPNHTOSGRVKQH-CZUORRHYSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000034996037 1124110399 /nfs/dbraw/zinc/11/03/99/1124110399.db2.gz OLEDGAQQBHHCDO-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000121647263 1124112063 /nfs/dbraw/zinc/11/20/63/1124112063.db2.gz YTBRNAVJNBOPAA-DZGCQCFKSA-N 1 0 296.370 3.894 20 5 CHBDRO CC[C@H]([NH2+]C1CC2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000448064666 1124560510 /nfs/dbraw/zinc/56/05/10/1124560510.db2.gz PICBLULNOYCCNX-HNNXBMFYSA-N 1 0 274.364 3.968 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449100330 1124648145 /nfs/dbraw/zinc/64/81/45/1124648145.db2.gz WEVGCAFRVBIWGN-YNEHKIRRSA-N 1 0 264.369 3.550 20 5 CHBDRO CC[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCO1 ZINC000449169739 1124658998 /nfs/dbraw/zinc/65/89/98/1124658998.db2.gz HLSMAMHTLUSYMX-BPLDGKMQSA-N 1 0 292.379 3.511 20 5 CHBDRO CSCC[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038751 1124663426 /nfs/dbraw/zinc/66/34/26/1124663426.db2.gz PUZDBZRNZHSLHW-NXEZZACHSA-N 1 0 286.372 3.526 20 5 CHBDRO C[C@@H]([NH2+]C1CC2(CCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872083144 1124678539 /nfs/dbraw/zinc/67/85/39/1124678539.db2.gz HUMAGNOCCMFBBQ-SNVBAGLBSA-N 1 0 278.327 3.717 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(C)(C)F ZINC000872094283 1124681505 /nfs/dbraw/zinc/68/15/05/1124681505.db2.gz ZNQYKAPTAOEETO-SECBINFHSA-N 1 0 286.372 3.715 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(F)F ZINC000449354087 1124707517 /nfs/dbraw/zinc/70/75/17/1124707517.db2.gz JZSHHCRBUOMLQC-NSHDSACASA-N 1 0 286.322 3.551 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCC(C)(F)F ZINC000873129810 1124739954 /nfs/dbraw/zinc/73/99/54/1124739954.db2.gz UOSVCCKZMJBJCM-UHFFFAOYSA-N 1 0 286.322 3.737 20 5 CHBDRO CS[C@H]1CC[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000449446813 1124740892 /nfs/dbraw/zinc/74/08/92/1124740892.db2.gz UJXZGWGHKKGQNG-ZDUSSCGKSA-N 1 0 294.420 3.656 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000124847712 1124822170 /nfs/dbraw/zinc/82/21/70/1124822170.db2.gz BNWFIJBECUQGOX-ZDUSSCGKSA-N 1 0 280.343 3.889 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000441432669 1125011802 /nfs/dbraw/zinc/01/18/02/1125011802.db2.gz FBGVBRHDFBIHML-CJNGLKHVSA-N 1 0 274.364 3.668 20 5 CHBDRO C[C@H](c1ccccc1F)N(C)Cc1cccc([N+](=O)[O-])c1 ZINC000052074206 1125374461 /nfs/dbraw/zinc/37/44/61/1125374461.db2.gz RZFSRSWKCIPPQT-GFCCVEGCSA-N 1 0 288.322 3.927 20 5 CHBDRO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000883461976 1125411453 /nfs/dbraw/zinc/41/14/53/1125411453.db2.gz HEVKUVXFTTXILD-MRXNPFEDSA-N 1 0 297.358 3.630 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC12CCC2)c1ccccc1[N+](=O)[O-] ZINC000282846752 1125431453 /nfs/dbraw/zinc/43/14/53/1125431453.db2.gz TURJSPJFEPEDCD-FZMZJTMJSA-N 1 0 260.337 3.578 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)C(C)(C)C ZINC000734510462 1129311434 /nfs/dbraw/zinc/31/14/34/1129311434.db2.gz QIGAHMJOFRQFHF-LBPRGKRZSA-N 1 0 294.395 3.765 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000766227558 1129387794 /nfs/dbraw/zinc/38/77/94/1129387794.db2.gz YHRQGTRJGCHCGJ-RWMBFGLXSA-N 1 0 294.420 3.838 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)s1 ZINC000094773506 1129452122 /nfs/dbraw/zinc/45/21/22/1129452122.db2.gz YJDSIVRYWGAFJN-SNVBAGLBSA-N 1 0 294.351 3.955 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303585910 1129547410 /nfs/dbraw/zinc/54/74/10/1129547410.db2.gz QKEONIOIVOHQCG-KRWDZBQOSA-N 1 0 286.375 3.917 20 5 CHBDRO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC001168859796 1129678138 /nfs/dbraw/zinc/67/81/38/1129678138.db2.gz RQQRVXBBFFULMV-UHFFFAOYSA-N 1 0 296.370 3.888 20 5 CHBDRO Cc1cc([C@H](C)[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)ccc1Cl ZINC001168979900 1129687252 /nfs/dbraw/zinc/68/72/52/1129687252.db2.gz BZSKNKAKQLPCKX-SGMGOOAPSA-N 1 0 296.798 3.744 20 5 CHBDRO CC(C)(C)C1CCC([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168968393 1129687820 /nfs/dbraw/zinc/68/78/20/1129687820.db2.gz YRYILSXOBWFOSK-PPWQZUPISA-N 1 0 282.428 3.626 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cc(C)ccc1C ZINC001169000751 1129688504 /nfs/dbraw/zinc/68/85/04/1129688504.db2.gz BGDHJDOYLPXANI-ZMSDIMECSA-N 1 0 290.407 3.790 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cc(C)ccc1C ZINC001169000749 1129688547 /nfs/dbraw/zinc/68/85/47/1129688547.db2.gz BGDHJDOYLPXANI-HLLBOEOZSA-N 1 0 290.407 3.790 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(C)c1C ZINC001169001633 1129689103 /nfs/dbraw/zinc/68/91/03/1129689103.db2.gz HCJIVHDSVOLKQC-ZMSDIMECSA-N 1 0 290.407 3.790 20 5 CHBDRO CC[C@H](C)C1CCC([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168988877 1129689949 /nfs/dbraw/zinc/68/99/49/1129689949.db2.gz ULVMCDWQWICQCX-WUPYBSFASA-N 1 0 282.428 3.626 20 5 CHBDRO CC(C)CC[NH+](CCC(C)C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046372 1129691407 /nfs/dbraw/zinc/69/14/07/1129691407.db2.gz LIJZMGRHQCIADG-HZPDHXFCSA-N 1 0 284.444 3.826 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCC23CCC3)c1 ZINC000800482709 1129877687 /nfs/dbraw/zinc/87/76/87/1129877687.db2.gz XFWNAOHMEGYOEO-ZDUSSCGKSA-N 1 0 280.755 3.671 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC12CCC2 ZINC000801526345 1129924094 /nfs/dbraw/zinc/92/40/94/1129924094.db2.gz LFFBWQXLYCFMPY-LBPRGKRZSA-N 1 0 292.354 3.746 20 5 CHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)C1 ZINC000801540140 1129925498 /nfs/dbraw/zinc/92/54/98/1129925498.db2.gz UWVMJOSMZRRAES-WBMJQRKESA-N 1 0 292.354 3.746 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCC12CCC2 ZINC000769984467 1129934869 /nfs/dbraw/zinc/93/48/69/1129934869.db2.gz OEJUVEPNUHXYSI-UHFFFAOYSA-N 1 0 280.755 3.767 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC1CCC1 ZINC000786818476 1130119219 /nfs/dbraw/zinc/11/92/19/1130119219.db2.gz YXHSIJKKPCKXJW-JLHYYAGUSA-N 1 0 274.364 3.778 20 5 CHBDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746663603 1130141879 /nfs/dbraw/zinc/14/18/79/1130141879.db2.gz SHBOGSZUJBWDNZ-ZDUSSCGKSA-N 1 0 282.771 3.869 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746671307 1130145141 /nfs/dbraw/zinc/14/51/41/1130145141.db2.gz HVDUWEYMNOHRBV-SNVBAGLBSA-N 1 0 270.760 3.726 20 5 CHBDRO CC[C@@H]1CC[N@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)[C@H]1C ZINC001462127893 1130205289 /nfs/dbraw/zinc/20/52/89/1130205289.db2.gz SYWQBVABMFILMF-UONOGXRCSA-N 1 0 276.380 3.832 20 5 CHBDRO COc1ccc(C[C@@H](C)[NH+](C(C)C)C(C)C)c([N+](=O)[O-])c1 ZINC001170328672 1130482875 /nfs/dbraw/zinc/48/28/75/1130482875.db2.gz LFIDYHDBKDVOTH-CYBMUJFWSA-N 1 0 294.395 3.653 20 5 CHBDRO COc1ccc(C[C@@H](C)[N@H+](C)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC001170348563 1130486937 /nfs/dbraw/zinc/48/69/37/1130486937.db2.gz YMSUAOPMDHNZQO-GFCCVEGCSA-N 1 0 294.395 3.512 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2CN1C[C@@H]2C[C@H]1C[NH2+]2 ZINC001235413467 1130740897 /nfs/dbraw/zinc/74/08/97/1130740897.db2.gz AAYIOFVCMGWIQN-IRXDYDNUSA-N 1 0 288.394 3.539 20 5 CHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000782107231 1130755595 /nfs/dbraw/zinc/75/55/95/1130755595.db2.gz LFQHECREIDQWIP-WBMJQRKESA-N 1 0 292.354 3.746 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[N@@H+]([C@H]1CCc3ccccc31)C2 ZINC000782181902 1130757444 /nfs/dbraw/zinc/75/74/44/1130757444.db2.gz JMMJKVYXTNHYHC-KRWDZBQOSA-N 1 0 294.354 3.640 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[C@@H](C)C1 ZINC000783309273 1130815685 /nfs/dbraw/zinc/81/56/85/1130815685.db2.gz JTNLPODVURDTDI-KGYLQXTDSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[N@H+](CCC1CC1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783674785 1130847434 /nfs/dbraw/zinc/84/74/34/1130847434.db2.gz QDOBNUCEBCGAAO-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783710659 1130851115 /nfs/dbraw/zinc/85/11/15/1130851115.db2.gz SFLOSLNAQRBXTR-MWLCHTKSSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)C(C)(C)C ZINC000815581013 1131002144 /nfs/dbraw/zinc/00/21/44/1131002144.db2.gz VNZZQLRFENIEHN-QWRGUYRKSA-N 1 0 279.384 3.510 20 5 CHBDRO CC(C)CC1(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000815595800 1131005763 /nfs/dbraw/zinc/00/57/63/1131005763.db2.gz BRYYODSNXVGERU-LBPRGKRZSA-N 1 0 291.395 3.654 20 5 CHBDRO C[C@@H](CCc1ccccc1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116330149 1131140865 /nfs/dbraw/zinc/14/08/65/1131140865.db2.gz WJIPSBBZHSHIKS-AWEZNQCLSA-N 1 0 296.370 3.932 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000824462805 1131471352 /nfs/dbraw/zinc/47/13/52/1131471352.db2.gz PGMSCEFOJZQETR-NSHDSACASA-N 1 0 274.320 3.655 20 5 CHBDRO C[N@@H+]1CCC[C@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001227764102 1131739226 /nfs/dbraw/zinc/73/92/26/1131739226.db2.gz KMXWEIWDHVGXDM-INIZCTEOSA-N 1 0 292.382 3.861 20 5 CHBDRO Cc1ccc(C(C)C)c(O[C@@H](C)C[N+](C)(C)C)c1 ZINC001227944697 1131773355 /nfs/dbraw/zinc/77/33/55/1131773355.db2.gz FTKFWEPXIVIART-AWEZNQCLSA-N 1 0 250.406 3.592 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1ccc[nH]1 ZINC000773117920 1131949657 /nfs/dbraw/zinc/94/96/57/1131949657.db2.gz MHESHHIYFIQJGY-RYUDHWBXSA-N 1 0 273.336 3.643 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036787259 1131974880 /nfs/dbraw/zinc/97/48/80/1131974880.db2.gz TXPGEZOTDITFFG-SNVBAGLBSA-N 1 0 270.760 3.725 20 5 CHBDRO C[C@H](Cc1ccco1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036993672 1131985765 /nfs/dbraw/zinc/98/57/65/1131985765.db2.gz HXEBJRHVRQOLLJ-SNVBAGLBSA-N 1 0 294.738 3.562 20 5 CHBDRO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCC1 ZINC000037092741 1131993994 /nfs/dbraw/zinc/99/39/94/1131993994.db2.gz MNWABCHCCCCPKS-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CCC[NH+](CCC)CCCNc1ccsc1[N+](=O)[O-] ZINC001649160314 1132009650 /nfs/dbraw/zinc/00/96/50/1132009650.db2.gz WLLOWZVWALYKJC-UHFFFAOYSA-N 1 0 285.413 3.580 20 5 CHBDRO CC(=O)c1cc2ccccc2cc1O[C@@H](C)C[N+](C)(C)C ZINC001230065158 1132152106 /nfs/dbraw/zinc/15/21/06/1132152106.db2.gz BSFKLENRFHNJPU-ZDUSSCGKSA-N 1 0 286.395 3.516 20 5 CHBDRO C[N@@H+]1CCC[C@@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001230203231 1132159426 /nfs/dbraw/zinc/15/94/26/1132159426.db2.gz KBDRXYHHPJARIQ-OAHLLOKOSA-N 1 0 292.382 3.861 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCC[C@H]2F)cc1Cl ZINC000840963025 1132313875 /nfs/dbraw/zinc/31/38/75/1132313875.db2.gz POJACBNHJSPWSI-VXGBXAGGSA-N 1 0 286.734 3.619 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1C=CCCC1)CC2 ZINC001172903129 1132348484 /nfs/dbraw/zinc/34/84/84/1132348484.db2.gz FFSVROCYICKUFB-HOTGVXAUSA-N 1 0 286.375 3.541 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[C@H](C)CC1 ZINC001173220578 1132411464 /nfs/dbraw/zinc/41/14/64/1132411464.db2.gz FYXUJCJVPFZYHP-NFAWXSAZSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC[C@H]1C ZINC001173227369 1132412413 /nfs/dbraw/zinc/41/24/13/1132412413.db2.gz QGMDUPPVNQFLSF-KGLIPLIRSA-N 1 0 276.380 3.790 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@](C)(F)CC1 ZINC001173229113 1132412630 /nfs/dbraw/zinc/41/26/30/1132412630.db2.gz PZRCPOGRUSSVTJ-BBRMVZONSA-N 1 0 294.370 3.740 20 5 CHBDRO CCCC1([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CCC1 ZINC001173224083 1132412683 /nfs/dbraw/zinc/41/26/83/1132412683.db2.gz LNGXMKXKLKAEOP-CYBMUJFWSA-N 1 0 276.380 3.838 20 5 CHBDRO CCC[N@H+](CC1CC1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173226580 1132412715 /nfs/dbraw/zinc/41/27/15/1132412715.db2.gz MRACCAAZZHIDLQ-CYBMUJFWSA-N 1 0 276.380 3.648 20 5 CHBDRO CCCC[N@H+](CC)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225417 1132412872 /nfs/dbraw/zinc/41/28/72/1132412872.db2.gz JWHFLLGLFPQPJW-CYBMUJFWSA-N 1 0 264.369 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001173233763 1132413554 /nfs/dbraw/zinc/41/35/54/1132413554.db2.gz NETIMAOYHQFIIN-RDTXWAMCSA-N 1 0 296.370 3.973 20 5 CHBDRO CCC[N@H+](CC(C)C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232429 1132413624 /nfs/dbraw/zinc/41/36/24/1132413624.db2.gz RFTWRTODIBQWAW-AWEZNQCLSA-N 1 0 278.396 3.894 20 5 CHBDRO CC(C)C([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001173233261 1132413880 /nfs/dbraw/zinc/41/38/80/1132413880.db2.gz HTWCAVCZPVSNIZ-CYBMUJFWSA-N 1 0 278.396 3.796 20 5 CHBDRO Cc1csc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173211591 1132416902 /nfs/dbraw/zinc/41/69/02/1132416902.db2.gz TYDOQTYLXZYMGE-LBPRGKRZSA-N 1 0 290.388 3.686 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C[N@@H+]3CCC4(CC4)C3)nc12 ZINC001232218695 1132439358 /nfs/dbraw/zinc/43/93/58/1132439358.db2.gz KACQYBQZIIJLRN-UHFFFAOYSA-N 1 0 289.382 3.769 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1ccc(C(C)(C)C[NH3+])cc1 ZINC001159580933 1132867044 /nfs/dbraw/zinc/86/70/44/1132867044.db2.gz CTNFJZWQPXVJHE-UHFFFAOYSA-N 1 0 299.374 3.883 20 5 CHBDRO CC(C)(C)C(=[NH2+])Nc1cc([N+](=O)[O-])cc2cc[nH]c21 ZINC001162660361 1133101908 /nfs/dbraw/zinc/10/19/08/1133101908.db2.gz JYVPEWMVXXADJV-UHFFFAOYSA-N 1 0 260.297 3.511 20 5 CHBDRO CCC[N@H+](CC)C[C@@H](C)Nc1cc(C)c([N+](=O)[O-])cc1F ZINC001163419908 1133148900 /nfs/dbraw/zinc/14/89/00/1133148900.db2.gz UDUKDPORQGWTJI-GFCCVEGCSA-N 1 0 297.374 3.575 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCCC12CC2 ZINC001203331863 1133316487 /nfs/dbraw/zinc/31/64/87/1133316487.db2.gz IQGACTUXOQUYSS-IVOILVROSA-N 1 0 286.375 3.920 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC001207152187 1133771799 /nfs/dbraw/zinc/77/17/99/1133771799.db2.gz ZGFXPUGATCOLRR-JKSUJKDBSA-N 1 0 288.391 3.962 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)sn1 ZINC000404411119 1134945369 /nfs/dbraw/zinc/94/53/69/1134945369.db2.gz XRMJWCRYDBUYRD-NSHDSACASA-N 1 0 291.376 3.519 20 5 CHBDRO C[C@@H]1C[NH2+]C[C@@H]1OCc1c2ccccc2nc2ccccc21 ZINC001217769701 1134997297 /nfs/dbraw/zinc/99/72/97/1134997297.db2.gz WILLLAMAKMNNME-YJYMSZOUSA-N 1 0 292.382 3.513 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@@H]3CCCC[NH2+]C3)c12 ZINC001217973603 1135033425 /nfs/dbraw/zinc/03/34/25/1135033425.db2.gz YASWGFLTXKPWEI-MRXNPFEDSA-N 1 0 292.382 3.909 20 5 CHBDRO C[C@@H]1C[NH2+]C[C@@H]1Oc1ccc2cc3ccccc3cc2c1 ZINC001217969386 1135034257 /nfs/dbraw/zinc/03/42/57/1135034257.db2.gz ZQNFSWKMBZURQK-YJYMSZOUSA-N 1 0 277.367 3.980 20 5 CHBDRO c1ccc2cc3cc(O[C@@H]4CC[NH2+]C4)ccc3cc2c1 ZINC001218038437 1135048014 /nfs/dbraw/zinc/04/80/14/1135048014.db2.gz IUKWMEVJXHOGSG-GOSISDBHSA-N 1 0 263.340 3.734 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@H]3C[C@H]4C[C@@H]3C[NH2+]4)cc2c1 ZINC001218141472 1135061978 /nfs/dbraw/zinc/06/19/78/1135061978.db2.gz IQVVQDBVTQXELR-RKVPGOIHSA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@H](Oc1ccc2cc3ccccc3cc2c1)C1C[NH2+]C1 ZINC001218199095 1135068656 /nfs/dbraw/zinc/06/86/56/1135068656.db2.gz ZTXUIKIXUZTXDW-ZDUSSCGKSA-N 1 0 277.367 3.980 20 5 CHBDRO c1ccc2c(c1)nc(OC1CC3(CC[NH2+]3)C1)c1ccccc21 ZINC001218248713 1135074319 /nfs/dbraw/zinc/07/43/19/1135074319.db2.gz LAMFSXWIHCLXJB-UHFFFAOYSA-N 1 0 290.366 3.661 20 5 CHBDRO c1ccc2c(c1)nc(O[C@@H]1C[C@H]3C[NH2+][C@@H]1C3)c1ccccc21 ZINC001218487882 1135115834 /nfs/dbraw/zinc/11/58/34/1135115834.db2.gz BDVANSUPDZKBCH-JBBXEZCESA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@H](OC1CCC([NH+](C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC001223432526 1135345228 /nfs/dbraw/zinc/34/52/28/1135345228.db2.gz VIZPBSJINYYFAP-YGONEPDPSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H](OCCC[N+](C)(C)C)c1cc(-c2ccccc2)no1 ZINC001224620741 1135462213 /nfs/dbraw/zinc/46/22/13/1135462213.db2.gz CMYPDBHEQXOSMS-AWEZNQCLSA-N 1 0 289.399 3.516 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CC[C@H](F)C2)cc1[N+](=O)[O-] ZINC000342295664 130425910 /nfs/dbraw/zinc/42/59/10/130425910.db2.gz IPZGSEXOIPGVOR-QWHCGFSZSA-N 1 0 280.343 3.698 20 5 CHBDRO C[C@H]([NH2+]Cc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000020139633 171026715 /nfs/dbraw/zinc/02/67/15/171026715.db2.gz FJRGAQPTWKSMBJ-JTQLQIEISA-N 1 0 262.334 3.507 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 ZINC000020148039 171035525 /nfs/dbraw/zinc/03/55/25/171035525.db2.gz NHJATELYCNLMDB-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO Cc1ccc(C[NH2+]CCC2=CCCCC2)cc1[N+](=O)[O-] ZINC000035009672 171926632 /nfs/dbraw/zinc/92/66/32/171926632.db2.gz LTYBRSYHYBTONX-UHFFFAOYSA-N 1 0 274.364 3.883 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)Cc2cccs2)cc1[N+](=O)[O-] ZINC000035254186 172084239 /nfs/dbraw/zinc/08/42/39/172084239.db2.gz KNTLLPSPNMLHFT-GFCCVEGCSA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCCc3occc32)cc1[N+](=O)[O-] ZINC000035273637 172094169 /nfs/dbraw/zinc/09/41/69/172094169.db2.gz DDVHOFOCGQHIBL-CQSZACIVSA-N 1 0 286.331 3.663 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000035648598 172324746 /nfs/dbraw/zinc/32/47/46/172324746.db2.gz WLUMVWAACRDCQH-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO CC(C)CCC[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000038093555 174107640 /nfs/dbraw/zinc/10/76/40/174107640.db2.gz GVQFFRBAPLCTLC-LBPRGKRZSA-N 1 0 250.342 3.682 20 5 CHBDRO C[C@H](Cc1ccoc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000344328615 225029154 /nfs/dbraw/zinc/02/91/54/225029154.db2.gz RADIQKZPMQRTJB-SNVBAGLBSA-N 1 0 294.738 3.562 20 5 CHBDRO CSCCCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192881121 227331412 /nfs/dbraw/zinc/33/14/12/227331412.db2.gz MIDQGOUGPOHWDS-HNNXBMFYSA-N 1 0 294.420 3.705 20 5 CHBDRO Cc1ccc([C@H]2CCCN2Cc2csc([N+](=O)[O-])c2)o1 ZINC000331433760 228100490 /nfs/dbraw/zinc/10/04/90/228100490.db2.gz UOFOFWAMFJPCCY-GFCCVEGCSA-N 1 0 292.360 3.895 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@H](C)C2 ZINC000180825162 260133149 /nfs/dbraw/zinc/13/31/49/260133149.db2.gz OOCLOETVRDQBOL-ACJLOTCBSA-N 1 0 296.370 3.926 20 5 CHBDRO CC1(C)CCC([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000079653809 260176347 /nfs/dbraw/zinc/17/63/47/260176347.db2.gz VXGRVPQGXGXLLB-UHFFFAOYSA-N 1 0 262.353 3.653 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CC1CCCCCC1 ZINC000089560111 260187751 /nfs/dbraw/zinc/18/77/51/260187751.db2.gz BAGBVCUYVBNNCP-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394054091 260212767 /nfs/dbraw/zinc/21/27/67/260212767.db2.gz SIPUFCMWRJRHPW-LLVKDONJSA-N 1 0 268.332 3.744 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000426773466 260351138 /nfs/dbraw/zinc/35/11/38/260351138.db2.gz JUAKLAKNOVVOIS-MGPQQGTHSA-N 1 0 274.364 3.778 20 5 CHBDRO CN(c1ccccc1)c1ccc(C[NH2+]C2CC2)cc1[N+](=O)[O-] ZINC000518249366 260361714 /nfs/dbraw/zinc/36/17/14/260361714.db2.gz DHTNEIRZPZONAJ-UHFFFAOYSA-N 1 0 297.358 3.615 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000158526313 261166605 /nfs/dbraw/zinc/16/66/05/261166605.db2.gz XRCHQHOJSOFDSB-MRXNPFEDSA-N 1 0 287.363 3.564 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000178640736 261754247 /nfs/dbraw/zinc/75/42/47/261754247.db2.gz YVTUOVJGZVDINA-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC(C)[C@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000221382756 261825233 /nfs/dbraw/zinc/82/52/33/261825233.db2.gz NBCYCFLCZFZCBI-LSDHHAIUSA-N 1 0 276.380 3.899 20 5 CHBDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000119886957 262174132 /nfs/dbraw/zinc/17/41/32/262174132.db2.gz AMRYMEHZIMZEBO-VIFPVBQESA-N 1 0 291.376 3.519 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCCC1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000390918392 262363644 /nfs/dbraw/zinc/36/36/44/262363644.db2.gz VNHHESCJCPAVEP-JQWIXIFHSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@H]([NH2+]CCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000021015301 262373631 /nfs/dbraw/zinc/37/36/31/262373631.db2.gz UASPEQOEHAVVGQ-AWEZNQCLSA-N 1 0 284.359 3.878 20 5 CHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000519001673 265289975 /nfs/dbraw/zinc/28/99/75/265289975.db2.gz MOAGPHGKKHPOTJ-JSGCOSHPSA-N 1 0 262.353 3.605 20 5 CHBDRO CCOC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000314741366 266002800 /nfs/dbraw/zinc/00/28/00/266002800.db2.gz LJTCTYOCOQICIU-ZDUSSCGKSA-N 1 0 292.379 3.595 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CC12CCC2 ZINC000357025720 266235596 /nfs/dbraw/zinc/23/55/96/266235596.db2.gz PMPDFEXBYJYGHX-GFCCVEGCSA-N 1 0 292.354 3.746 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@H](C)CC2)cccc1[N+](=O)[O-] ZINC000357117670 266250753 /nfs/dbraw/zinc/25/07/53/266250753.db2.gz OSBHDKHXJVQWAD-LBPRGKRZSA-N 1 0 262.353 3.525 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1c2ccccc2O[C@H]1C ZINC000367402351 267071284 /nfs/dbraw/zinc/07/12/84/267071284.db2.gz QWYDVUYDCVCCPG-YVEFUNNKSA-N 1 0 298.342 3.515 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000062726402 327894527 /nfs/dbraw/zinc/89/45/27/327894527.db2.gz YFXYOZVKUUEOCL-HIFRSBDPSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC2CC(F)(F)C2)cc1[N+](=O)[O-] ZINC000394813814 328011157 /nfs/dbraw/zinc/01/11/57/328011157.db2.gz QAXHCHJYTYITON-SNVBAGLBSA-N 1 0 284.306 3.599 20 5 CHBDRO C[C@H]1CCC[C@](CNc2ccc([N+](=O)[O-])cc2)([NH+](C)C)C1 ZINC000040670121 328015328 /nfs/dbraw/zinc/01/53/28/328015328.db2.gz IFJDXORXWCNCBL-BBRMVZONSA-N 1 0 291.395 3.517 20 5 CHBDRO CCc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000040676153 328015567 /nfs/dbraw/zinc/01/55/67/328015567.db2.gz XPOALUFKZZBJOR-UHFFFAOYSA-N 1 0 290.388 3.551 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@@H]1CCCCO1 ZINC000540952862 328013764 /nfs/dbraw/zinc/01/37/64/328013764.db2.gz ARBYCDKGEUUAAP-ZFWWWQNUSA-N 1 0 292.379 3.513 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000531782314 328033696 /nfs/dbraw/zinc/03/36/96/328033696.db2.gz WSILSXWVKZEQLP-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO C[C@H]([N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000534349906 328047888 /nfs/dbraw/zinc/04/78/88/328047888.db2.gz AWADKSQPNUSLEK-KJJQSCHISA-N 1 0 276.380 3.974 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303681238 328357528 /nfs/dbraw/zinc/35/75/28/328357528.db2.gz JCMLRCIOENVNIA-KMFMINBZSA-N 1 0 288.391 3.790 20 5 CHBDRO C[C@@H]([NH2+]CCOC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000111636507 328370115 /nfs/dbraw/zinc/37/01/15/328370115.db2.gz DLWNBKCSCVONHW-CYBMUJFWSA-N 1 0 292.379 3.595 20 5 CHBDRO CCCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963087 328379679 /nfs/dbraw/zinc/37/96/79/328379679.db2.gz MKBXDXVVURCNOU-UHFFFAOYSA-N 1 0 256.733 3.528 20 5 CHBDRO Cc1ccc(C[N@H+](Cc2ccccn2)C(C)C)cc1[N+](=O)[O-] ZINC000535081532 328385335 /nfs/dbraw/zinc/38/53/35/328385335.db2.gz BXFHJEMPTRMLEN-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)CCC(C)C ZINC000070185941 328449224 /nfs/dbraw/zinc/44/92/24/328449224.db2.gz LWAONRNWOCCARN-GFCCVEGCSA-N 1 0 280.368 3.518 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)c1 ZINC000538399298 326827353 /nfs/dbraw/zinc/82/73/53/326827353.db2.gz ORNFJXUBZGORDG-QLFBSQMISA-N 1 0 274.364 3.653 20 5 CHBDRO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000557462426 327006809 /nfs/dbraw/zinc/00/68/09/327006809.db2.gz AFUYPZCFELLJNN-DNGMOHDESA-N 1 0 282.343 3.959 20 5 CHBDRO C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C(C)(C)C ZINC000577507509 327263735 /nfs/dbraw/zinc/26/37/35/327263735.db2.gz FWKNLKKZFDFWLN-UHFFFAOYSA-N 1 0 290.285 3.844 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000569724128 327542466 /nfs/dbraw/zinc/54/24/66/327542466.db2.gz UMLXXXCMMLTEQA-CYZMBNFOSA-N 1 0 266.316 3.526 20 5 CHBDRO CC(C)C1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000054556312 328697671 /nfs/dbraw/zinc/69/76/71/328697671.db2.gz ICSUZYOIZDNKBM-UHFFFAOYSA-N 1 0 290.407 3.942 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000042857636 328771323 /nfs/dbraw/zinc/77/13/23/328771323.db2.gz DZQJTRZRYCNHQM-TZMCWYRMSA-N 1 0 262.353 3.511 20 5 CHBDRO CSCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000173565052 329149346 /nfs/dbraw/zinc/14/93/46/329149346.db2.gz DUHMCTLBBNZWGY-UHFFFAOYSA-N 1 0 282.409 3.558 20 5 CHBDRO Cc1occc1C[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182687810 329244075 /nfs/dbraw/zinc/24/40/75/329244075.db2.gz RSCGLWDQLQLRFV-GFCCVEGCSA-N 1 0 288.347 3.998 20 5 CHBDRO CC(C)CSCC[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000582856630 329281182 /nfs/dbraw/zinc/28/11/82/329281182.db2.gz QMTDALRINZQSQA-AWEZNQCLSA-N 1 0 294.420 3.561 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000584366895 329295459 /nfs/dbraw/zinc/29/54/59/329295459.db2.gz SMERGVCVOXGRPJ-VRKREXBASA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C2CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000583095272 329315380 /nfs/dbraw/zinc/31/53/80/329315380.db2.gz DBDHRWBYGZQEQS-NSHDSACASA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000509021898 332856026 /nfs/dbraw/zinc/85/60/26/332856026.db2.gz NKWRVYVCKIFHQA-JTQLQIEISA-N 1 0 298.333 3.931 20 5 CHBDRO CC[C@H]([NH2+]CC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000040492781 329556207 /nfs/dbraw/zinc/55/62/07/329556207.db2.gz IZMYDVQMSMQYAH-ZDUSSCGKSA-N 1 0 250.342 3.682 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000086642623 332877078 /nfs/dbraw/zinc/87/70/78/332877078.db2.gz OQIYBWZNMGLNAL-UHFFFAOYSA-N 1 0 280.368 3.662 20 5 CHBDRO CC[C@@H](C)C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000421387301 329819309 /nfs/dbraw/zinc/81/93/09/329819309.db2.gz SJMNZBSDYBHHJV-FMNNIJNLSA-N 1 0 262.353 3.634 20 5 CHBDRO CCCC[C@@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000572401871 330061246 /nfs/dbraw/zinc/06/12/46/330061246.db2.gz LUKYOTJGURAYTD-GFCCVEGCSA-N 1 0 289.379 3.787 20 5 CHBDRO CC(C)[C@@H](C)[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000536873617 330281787 /nfs/dbraw/zinc/28/17/87/330281787.db2.gz ZFQSDXSKOQOBAJ-CYBMUJFWSA-N 1 0 264.369 3.552 20 5 CHBDRO Cc1ccccc1CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000105895031 330330606 /nfs/dbraw/zinc/33/06/06/330330606.db2.gz NLNVYQDHMSEJEB-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000424291383 330334742 /nfs/dbraw/zinc/33/47/42/330334742.db2.gz LSYWLEYKAVTEDM-PJODQICGSA-N 1 0 274.364 3.682 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000424316801 330339540 /nfs/dbraw/zinc/33/95/40/330339540.db2.gz BLCUNNZZGWDKOC-BYCMXARLSA-N 1 0 274.364 3.742 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC13CC3)CCCC2 ZINC000424327443 330341671 /nfs/dbraw/zinc/34/16/71/330341671.db2.gz PXYLVVXBFRYWMU-LSDHHAIUSA-N 1 0 272.348 3.504 20 5 CHBDRO C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000428557640 330528008 /nfs/dbraw/zinc/52/80/08/330528008.db2.gz JKHKYSNXOKWZOU-DMTLFAOVSA-N 1 0 298.342 3.664 20 5 CHBDRO COc1cc(C[NH+](C2CCC2)C2CCC2)ccc1[N+](=O)[O-] ZINC000429151887 330539224 /nfs/dbraw/zinc/53/92/24/330539224.db2.gz PKWZOBWEMMYTAF-UHFFFAOYSA-N 1 0 290.363 3.510 20 5 CHBDRO CC(C)=CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433095868 330617211 /nfs/dbraw/zinc/61/72/11/330617211.db2.gz ZULHSXPXJBMSSM-HNNXBMFYSA-N 1 0 274.364 3.873 20 5 CHBDRO Cc1c(C[NH+]2CCC(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000441482586 330770141 /nfs/dbraw/zinc/77/01/41/330770141.db2.gz DMFMFPYKIBRFJG-UHFFFAOYSA-N 1 0 276.380 3.771 20 5 CHBDRO CCC1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000447587885 330871950 /nfs/dbraw/zinc/87/19/50/330871950.db2.gz SGOCDOSUGUSTPA-HNNXBMFYSA-N 1 0 274.364 3.752 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCO[C@H](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000449177120 330903826 /nfs/dbraw/zinc/90/38/26/330903826.db2.gz UUVNEPUDMXHTOA-IMJJTQAJSA-N 1 0 292.379 3.593 20 5 CHBDRO CC/C=C\C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000449464645 330927743 /nfs/dbraw/zinc/92/77/43/330927743.db2.gz YNKWEPVTBRMWTK-GNPUEAEQSA-N 1 0 260.337 3.554 20 5 CHBDRO C[C@H]([NH2+]CCCc1ccsc1)c1ccc([N+](=O)[O-])cc1 ZINC000451106201 331015640 /nfs/dbraw/zinc/01/56/40/331015640.db2.gz VZSUDTKYDLJKPR-LBPRGKRZSA-N 1 0 290.388 3.940 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]1C(C)C ZINC000470175503 331044312 /nfs/dbraw/zinc/04/43/12/331044312.db2.gz ZBZHAUSLVKYSCM-RCBBPTIPSA-N 1 0 274.364 3.728 20 5 CHBDRO CC(C)[C@@H]1C[C@H]1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000453374945 331124641 /nfs/dbraw/zinc/12/46/41/331124641.db2.gz XDHCYIHMBUEARX-ZLDLUXBVSA-N 1 0 262.353 3.538 20 5 CHBDRO C[C@H]([NH2+]CCC1CC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453427474 331131114 /nfs/dbraw/zinc/13/11/14/331131114.db2.gz PJPNFYMUYYKTCW-JTQLQIEISA-N 1 0 284.306 3.681 20 5 CHBDRO CC[NH+](CC)CCCCNc1cc(C)c([N+](=O)[O-])cc1F ZINC000461767229 331314565 /nfs/dbraw/zinc/31/45/65/331314565.db2.gz KSVAEZBEDBDQIS-UHFFFAOYSA-N 1 0 297.374 3.576 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000464772608 331367260 /nfs/dbraw/zinc/36/72/60/331367260.db2.gz IESLJUJPBWYMQW-OAHLLOKOSA-N 1 0 280.343 3.746 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1CC(c2ccccc2)C1 ZINC000466420779 331396119 /nfs/dbraw/zinc/39/61/19/331396119.db2.gz GIFDHBYSVJBNAP-UHFFFAOYSA-N 1 0 296.370 3.939 20 5 CHBDRO C[C@@H](CCC1CC1)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000469127849 331446210 /nfs/dbraw/zinc/44/62/10/331446210.db2.gz YVCSGALHNQZPNH-BPJJOFIESA-N 1 0 274.364 3.776 20 5 CHBDRO CCCC[C@@H](COC)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000483207314 331863114 /nfs/dbraw/zinc/86/31/14/331863114.db2.gz FCZLUZZVTGVSHD-HOCLYGCPSA-N 1 0 294.395 3.841 20 5 CHBDRO CC(C)([NH2+]C/C=C/c1ccncc1)c1ccc([N+](=O)[O-])cc1 ZINC000487335881 331966938 /nfs/dbraw/zinc/96/69/38/331966938.db2.gz QTURNNZVJLOHMM-ONEGZZNKSA-N 1 0 297.358 3.528 20 5 CHBDRO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CS1 ZINC000488531273 332015968 /nfs/dbraw/zinc/01/59/68/332015968.db2.gz LOTIGXQWBDBPPR-GXTWGEPZSA-N 1 0 294.420 3.605 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000490084244 332080959 /nfs/dbraw/zinc/08/09/59/332080959.db2.gz IKPNQZUUPIJFJP-TUKIKUTGSA-N 1 0 274.364 3.552 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490551769 332091253 /nfs/dbraw/zinc/09/12/53/332091253.db2.gz ZJQKRJKTPPJZNU-HSMVNMDESA-N 1 0 292.354 3.887 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1 ZINC000491582379 332241361 /nfs/dbraw/zinc/24/13/61/332241361.db2.gz XLLSZOFIBUICHM-CYBMUJFWSA-N 1 0 298.333 3.900 20 5 CHBDRO CC(C)([NH2+]CC1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000492192874 332386493 /nfs/dbraw/zinc/38/64/93/332386493.db2.gz KNJUQDAVIPSJMN-UHFFFAOYSA-N 1 0 262.353 3.610 20 5 CHBDRO C[C@@H]1C[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000495068723 332503112 /nfs/dbraw/zinc/50/31/12/332503112.db2.gz KUZYLJPEZMJVDO-WWGRRREGSA-N 1 0 276.380 3.552 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCC12CCC2 ZINC000502412317 332657839 /nfs/dbraw/zinc/65/78/39/332657839.db2.gz CNLNXZYPCJQMMV-CQSZACIVSA-N 1 0 294.782 3.713 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000504930418 332725578 /nfs/dbraw/zinc/72/55/78/332725578.db2.gz PTRUSKIOCKZXRI-STQMWFEESA-N 1 0 294.395 3.936 20 5 CHBDRO C[C@H]1CC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000513057051 333002002 /nfs/dbraw/zinc/00/20/02/333002002.db2.gz MHDTZXGVNGMCEQ-FZMZJTMJSA-N 1 0 286.331 3.743 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000310903595 333062418 /nfs/dbraw/zinc/06/24/18/333062418.db2.gz FSYLBBVPNFFEQR-GFCCVEGCSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1c(C[N@H+]2CCCC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000516994721 333089122 /nfs/dbraw/zinc/08/91/22/333089122.db2.gz TYJJRILJHLEZLK-OAHLLOKOSA-N 1 0 276.380 3.914 20 5 CHBDRO Cc1ccc(C[NH2+]CC(C)(C)C(C)C)cc1[N+](=O)[O-] ZINC000218977519 333139695 /nfs/dbraw/zinc/13/96/95/333139695.db2.gz HKHAXNXWXODYIE-UHFFFAOYSA-N 1 0 264.369 3.675 20 5 CHBDRO COc1ccsc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000186202316 333156656 /nfs/dbraw/zinc/15/66/56/333156656.db2.gz JHYSOQOGIOEYDN-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO CC[C@H]([NH2+]C1CC(OC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000186551688 333162752 /nfs/dbraw/zinc/16/27/52/333162752.db2.gz HPQAXYLJQLKHBE-BCLQGDPASA-N 1 0 292.379 3.592 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C1CCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000187070423 333167770 /nfs/dbraw/zinc/16/77/70/333167770.db2.gz BQRFGIASJGQRNJ-VXGBXAGGSA-N 1 0 294.420 3.777 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCSC[C@H](C)C1 ZINC000190425426 333206769 /nfs/dbraw/zinc/20/67/69/333206769.db2.gz AEEIOIUADBJOLX-DGCLKSJQSA-N 1 0 294.420 3.649 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522554082 333289814 /nfs/dbraw/zinc/28/98/14/333289814.db2.gz GLTNRTHBGSJTEJ-LBPRGKRZSA-N 1 0 268.744 3.623 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000230407428 333317549 /nfs/dbraw/zinc/31/75/49/333317549.db2.gz PPAJKYDFROFXBF-AGIUHOORSA-N 1 0 262.353 3.682 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000524610298 333368705 /nfs/dbraw/zinc/36/87/05/333368705.db2.gz XRLISXNGBRSMOD-CQSZACIVSA-N 1 0 292.379 3.628 20 5 CHBDRO CC1=C[C@@H](C)C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000235704238 333371855 /nfs/dbraw/zinc/37/18/55/333371855.db2.gz CWWGPMPREORCQL-IUODEOHRSA-N 1 0 274.364 3.677 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000237580211 333380243 /nfs/dbraw/zinc/38/02/43/333380243.db2.gz RISWNPQPODOZIT-NSHDSACASA-N 1 0 286.331 3.743 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CSC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000338783269 335138342 /nfs/dbraw/zinc/13/83/42/335138342.db2.gz UTXVZNHRFCKZNS-CHWSQXEVSA-N 1 0 280.393 3.530 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000037253731 333525775 /nfs/dbraw/zinc/52/57/75/333525775.db2.gz VWWSOQQKFIMKBV-MBNYWOFBSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000062726585 333554150 /nfs/dbraw/zinc/55/41/50/333554150.db2.gz VFISDYYZRBBBMT-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO COc1ccc(C[NH2+][C@@H](C)CCC=C(C)C)cc1[N+](=O)[O-] ZINC000539074542 333655361 /nfs/dbraw/zinc/65/53/61/333655361.db2.gz QZLVPGBAIBGLOT-ZDUSSCGKSA-N 1 0 292.379 3.828 20 5 CHBDRO CC[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000539084770 333656722 /nfs/dbraw/zinc/65/67/22/333656722.db2.gz UOZJXGWSDDBXNX-MRXNPFEDSA-N 1 0 276.380 3.696 20 5 CHBDRO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000539218445 333662097 /nfs/dbraw/zinc/66/20/97/333662097.db2.gz TZURSOICCKYTPZ-QWHCGFSZSA-N 1 0 299.374 3.964 20 5 CHBDRO CC[C@H]1CCC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000071120275 333844467 /nfs/dbraw/zinc/84/44/67/333844467.db2.gz DMAMXXAIVRHYMV-DZGCQCFKSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1cc(N2CC[C@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543048491 333854040 /nfs/dbraw/zinc/85/40/40/333854040.db2.gz OZWBFFYPIZKSNO-ZDUSSCGKSA-N 1 0 297.358 3.688 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000545470280 333983954 /nfs/dbraw/zinc/98/39/54/333983954.db2.gz JXVMBIPWVIEJEM-LLVKDONJSA-N 1 0 290.285 3.724 20 5 CHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000135168087 334118485 /nfs/dbraw/zinc/11/84/85/334118485.db2.gz JIDCKAVDFALHPT-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000080346996 334170616 /nfs/dbraw/zinc/17/06/16/334170616.db2.gz ZOOUYPCFJGTWLB-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CC1CC(c2ccccc2)C1 ZINC000549249605 334188760 /nfs/dbraw/zinc/18/87/60/334188760.db2.gz LBERBYOFZLLVOA-UHFFFAOYSA-N 1 0 296.370 3.878 20 5 CHBDRO Cc1c(C[N@@H+]2CC[C@H](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000550051469 334211990 /nfs/dbraw/zinc/21/19/90/334211990.db2.gz VGGSWVPSVIQAAR-CQSZACIVSA-N 1 0 274.364 3.525 20 5 CHBDRO CC1(C)C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@@H]21 ZINC000550442913 334222647 /nfs/dbraw/zinc/22/26/47/334222647.db2.gz BTUXODZBHCEPIJ-HOTGVXAUSA-N 1 0 288.391 3.648 20 5 CHBDRO C[C@H](F)CC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000550883569 334231623 /nfs/dbraw/zinc/23/16/23/334231623.db2.gz XEQLIRVKSLWDTI-GUTXKFCHSA-N 1 0 294.370 3.644 20 5 CHBDRO CC1(C)C[C@@H]([NH2+][C@H]2CCC[C@H]2F)c2cc([N+](=O)[O-])ccc21 ZINC000551309276 334246314 /nfs/dbraw/zinc/24/63/14/334246314.db2.gz QJFNGAKWURYCOD-QLFBSQMISA-N 1 0 292.354 3.797 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@H]1C ZINC000552086310 334287698 /nfs/dbraw/zinc/28/76/98/334287698.db2.gz CFMOLMLVSOJSSX-JHJVBQTASA-N 1 0 294.420 3.854 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC(C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000088455632 334338749 /nfs/dbraw/zinc/33/87/49/334338749.db2.gz ZHSVLYZBBJUKAJ-GFCCVEGCSA-N 1 0 288.391 3.990 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000250927658 334353465 /nfs/dbraw/zinc/35/34/65/334353465.db2.gz YCDYNJQNFDWGBI-SCDSUCTJSA-N 1 0 262.353 3.742 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000090035986 334355924 /nfs/dbraw/zinc/35/59/24/334355924.db2.gz NTHWSFIFGIGNJI-TZMCWYRMSA-N 1 0 290.363 3.753 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2C=CCCC2)cc1[N+](=O)[O-] ZINC000090392826 334360165 /nfs/dbraw/zinc/36/01/65/334360165.db2.gz HXODSMINGVEXJO-JSGCOSHPSA-N 1 0 260.337 3.663 20 5 CHBDRO Cc1c(C[NH+](CC2CC2)CC2CC2)cccc1[N+](=O)[O-] ZINC000554659414 334445056 /nfs/dbraw/zinc/44/50/56/334445056.db2.gz WKMJDGZDCQEQHC-UHFFFAOYSA-N 1 0 274.364 3.525 20 5 CHBDRO C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000565720063 334591379 /nfs/dbraw/zinc/59/13/79/334591379.db2.gz NQBDCNBJYQUDKK-ZVTBTPLYSA-N 1 0 262.353 3.632 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC1CC(F)(F)C1 ZINC000567015295 334673370 /nfs/dbraw/zinc/67/33/70/334673370.db2.gz LDQCGLDRAJPYKJ-LLVKDONJSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCC2CC2)cc1[N+](=O)[O-] ZINC000163346937 334867120 /nfs/dbraw/zinc/86/71/20/334867120.db2.gz UJGLCFRIWQKTDG-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000324327601 334884274 /nfs/dbraw/zinc/88/42/74/334884274.db2.gz PTKQSQCSWWJDJR-SMDDNHRTSA-N 1 0 262.353 3.742 20 5 CHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)o1 ZINC000576314309 335188595 /nfs/dbraw/zinc/18/85/95/335188595.db2.gz NHJHWZYHCPXUSZ-UHFFFAOYSA-N 1 0 294.738 3.516 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@@H]2F)cc1[N+](=O)[O-] ZINC000577595056 335375407 /nfs/dbraw/zinc/37/54/07/335375407.db2.gz RPENSCGBTLEPLK-KGYLQXTDSA-N 1 0 296.342 3.535 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCCC2(F)F)cc1 ZINC000381765949 336072639 /nfs/dbraw/zinc/07/26/39/336072639.db2.gz XSNIQYYQODBYLC-GFCCVEGCSA-N 1 0 284.306 3.510 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H](C1CC1)C1CCC1 ZINC000581677112 336127205 /nfs/dbraw/zinc/12/72/05/336127205.db2.gz QUHWKCHOIKWAHG-RDJZCZTQSA-N 1 0 286.375 3.750 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1c(F)cccc1[N+](=O)[O-] ZINC000385104349 336138297 /nfs/dbraw/zinc/13/82/97/336138297.db2.gz QICMGGLPNSYABP-LBPRGKRZSA-N 1 0 297.374 3.656 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CCCC3)CC2)c(F)c1 ZINC000385562810 336151446 /nfs/dbraw/zinc/15/14/46/336151446.db2.gz QGLXXRHWDPXXKE-UHFFFAOYSA-N 1 0 292.354 3.890 20 5 CHBDRO CCOCC(C)(C)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000385573127 336151750 /nfs/dbraw/zinc/15/17/50/336151750.db2.gz UDDOIJXOQZBMBF-ZDUSSCGKSA-N 1 0 294.395 3.617 20 5 CHBDRO CS[C@@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)C(C)(C)C ZINC000344350409 533929004 /nfs/dbraw/zinc/92/90/04/533929004.db2.gz IVRFUYSYQQQLPZ-JTQLQIEISA-N 1 0 288.438 3.524 20 5 CHBDRO CCCC(CCC)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446827696 517550646 /nfs/dbraw/zinc/55/06/46/517550646.db2.gz PVPZZQLOTMRELZ-UHFFFAOYSA-N 1 0 290.367 3.530 20 5 CHBDRO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000291776841 519323501 /nfs/dbraw/zinc/32/35/01/519323501.db2.gz UJVCLJQCXMEPBV-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO CC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000340140081 522602403 /nfs/dbraw/zinc/60/24/03/522602403.db2.gz MFUJQZCHAKPLCG-KRWDZBQOSA-N 1 0 284.359 3.878 20 5 CHBDRO CC[C@H]([NH2+]C[C@]1(C)CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000122012596 522637658 /nfs/dbraw/zinc/63/76/58/522637658.db2.gz WNTSDPHWCZVIAY-GJZGRUSLSA-N 1 0 294.420 3.921 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000037010534 522887300 /nfs/dbraw/zinc/88/73/00/522887300.db2.gz BOSODAXMBBJSDH-CQSZACIVSA-N 1 0 276.361 3.897 20 5 CHBDRO CC[C@@H]([NH2+][C@H](CC)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000161630329 522942103 /nfs/dbraw/zinc/94/21/03/522942103.db2.gz SHRQPRHNBRZOMX-HUUCEWRRSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000050225123 524605039 /nfs/dbraw/zinc/60/50/39/524605039.db2.gz RNZNBHCFUPPMKO-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296189042 524853662 /nfs/dbraw/zinc/85/36/62/524853662.db2.gz YJSNDHLCKFLIKU-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000291489513 524919950 /nfs/dbraw/zinc/91/99/50/524919950.db2.gz GMCMBCZWTSJDFW-FVOPLDGLSA-N 1 0 296.317 3.585 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000157952589 525501389 /nfs/dbraw/zinc/50/13/89/525501389.db2.gz IRVQWNZZCGLHFL-BXUZGUMPSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CCCS2)cc1[N+](=O)[O-] ZINC000122050665 525730292 /nfs/dbraw/zinc/73/02/92/525730292.db2.gz IVLVYQIXNICSDB-IUODEOHRSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000036959969 525745932 /nfs/dbraw/zinc/74/59/32/525745932.db2.gz PWWPUWRYPQGLQO-VXGBXAGGSA-N 1 0 274.320 3.908 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CC34CC4)o2)cc1 ZINC000418089116 534881496 /nfs/dbraw/zinc/88/14/96/534881496.db2.gz BIZZFYHHHCUMSC-CYBMUJFWSA-N 1 0 298.342 3.745 20 5 CHBDRO Cc1ccsc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000070091561 525886453 /nfs/dbraw/zinc/88/64/53/525886453.db2.gz ROCCLBJIIDCAMP-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccsc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000070092046 525887593 /nfs/dbraw/zinc/88/75/93/525887593.db2.gz FOUGADQVHFCVAO-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000156754109 525900049 /nfs/dbraw/zinc/90/00/49/525900049.db2.gz LCHOYVUTLIICGA-YUTCNCBUSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]C2CCC(C(F)F)CC2)c1 ZINC000282487530 527385752 /nfs/dbraw/zinc/38/57/52/527385752.db2.gz XGMTUEHKTKDCBT-UHFFFAOYSA-N 1 0 298.333 3.551 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000282864679 527400872 /nfs/dbraw/zinc/40/08/72/527400872.db2.gz YUQDVCZTDQNTFW-TZMCWYRMSA-N 1 0 280.343 3.603 20 5 CHBDRO CCC(CC)[C@@H](CC[NH2+]Cc1cccc([N+](=O)[O-])c1)OC ZINC000344827920 528818445 /nfs/dbraw/zinc/81/84/45/528818445.db2.gz ONUZOXHDDJKTJV-MRXNPFEDSA-N 1 0 294.395 3.526 20 5 CHBDRO CC[C@@H]([NH2+]CCCCCF)c1cccc([N+](=O)[O-])c1 ZINC000341917099 535803505 /nfs/dbraw/zinc/80/35/05/535803505.db2.gz WPUYHQWSGJWIRE-CQSZACIVSA-N 1 0 268.332 3.775 20 5 CHBDRO CC(C)[NH+](CCCNc1ccsc1[N+](=O)[O-])C(C)C ZINC000610431099 1118426161 /nfs/dbraw/zinc/42/61/61/1118426161.db2.gz VHZNAQDNUPPOPY-UHFFFAOYSA-N 1 0 285.413 3.577 20 5 CHBDRO C[C@@H]([NH2+]CCC1(F)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000348310378 1125520923 /nfs/dbraw/zinc/52/09/23/1125520923.db2.gz BXCGODNTEHHNCQ-LLVKDONJSA-N 1 0 266.316 3.528 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1C[C@@H]1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000348315658 1125538454 /nfs/dbraw/zinc/53/84/54/1125538454.db2.gz UQKIQQFMJQFBOM-RWMBFGLXSA-N 1 0 284.306 3.679 20 5 CHBDRO CC(C)C1CC([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000486909985 1125593188 /nfs/dbraw/zinc/59/31/88/1125593188.db2.gz WYNYGLBXHIGOMI-UHFFFAOYSA-N 1 0 282.771 3.772 20 5 CHBDRO Cc1ccccc1[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C(C)C ZINC000886111926 1125651341 /nfs/dbraw/zinc/65/13/41/1125651341.db2.gz LFIHQVNXJFKPOS-INIZCTEOSA-N 1 0 299.374 3.785 20 5 CHBDRO Cc1cccc([C@@H]([NH2+]Cc2cccnc2[N+](=O)[O-])C(C)C)c1 ZINC000886300959 1125667210 /nfs/dbraw/zinc/66/72/10/1125667210.db2.gz SMRZTOYRNWFSKP-INIZCTEOSA-N 1 0 299.374 3.785 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000138871905 1126747492 /nfs/dbraw/zinc/74/74/92/1126747492.db2.gz ZLGJRVIXJCIIKE-MRXNPFEDSA-N 1 0 298.342 3.638 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@H+](CC2CC2)CC2CCC2)cc1 ZINC000483284691 1126778696 /nfs/dbraw/zinc/77/86/96/1126778696.db2.gz IKIKCCNAZMDCBJ-UHFFFAOYSA-N 1 0 288.391 3.649 20 5 CHBDRO CC1=C(C)C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000483370595 1126783836 /nfs/dbraw/zinc/78/38/36/1126783836.db2.gz GUXAICZPRAMCNX-ZDUSSCGKSA-N 1 0 260.337 3.698 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000036721119 1126799139 /nfs/dbraw/zinc/79/91/39/1126799139.db2.gz WAPWTQJKPZLZHW-LRDDRELGSA-N 1 0 285.347 3.792 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCc2ccccn2)cc1[N+](=O)[O-] ZINC000181486501 1126856702 /nfs/dbraw/zinc/85/67/02/1126856702.db2.gz YXDSFZIZROSXOL-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO O=[N+]([O-])c1cccc(COc2ccc([C@H]3CCC[NH2+]3)cc2)c1 ZINC000905617881 1126909746 /nfs/dbraw/zinc/90/97/46/1126909746.db2.gz RQUGIPOUSLRDFU-QGZVFWFLSA-N 1 0 298.342 3.598 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCCCCC1 ZINC000485797115 1126953814 /nfs/dbraw/zinc/95/38/14/1126953814.db2.gz XVNIURQAUACBGG-ZDUSSCGKSA-N 1 0 262.353 3.840 20 5 CHBDRO CN(Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1F ZINC000043626344 1127001877 /nfs/dbraw/zinc/00/18/77/1127001877.db2.gz OWFBPMOGFAKGAM-UHFFFAOYSA-N 1 0 292.285 3.505 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000323742415 1127049505 /nfs/dbraw/zinc/04/95/05/1127049505.db2.gz QKJGUEUALINPTA-LBPRGKRZSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccnc1 ZINC000270552632 1127057853 /nfs/dbraw/zinc/05/78/53/1127057853.db2.gz BRIKLTGVUIJAFR-CYBMUJFWSA-N 1 0 285.347 3.573 20 5 CHBDRO C[C@H]1CCCC[C@H]1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000042861628 1127080381 /nfs/dbraw/zinc/08/03/81/1127080381.db2.gz JEMHWUYXRLTGOL-ZFWWWQNUSA-N 1 0 276.380 3.553 20 5 CHBDRO COc1ccc(C[NH2+]C[C@@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000042863334 1127080582 /nfs/dbraw/zinc/08/05/82/1127080582.db2.gz RPTFZNKNXYZFAG-OCCSQVGLSA-N 1 0 292.379 3.519 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000029482277 1127123787 /nfs/dbraw/zinc/12/37/87/1127123787.db2.gz DGLKHFKSEQXVOB-KRWDZBQOSA-N 1 0 282.343 3.714 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000054993498 1127146983 /nfs/dbraw/zinc/14/69/83/1127146983.db2.gz SBRFAEADJJJXDL-MRXNPFEDSA-N 1 0 282.343 3.932 20 5 CHBDRO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@H]21 ZINC000590204436 1127251644 /nfs/dbraw/zinc/25/16/44/1127251644.db2.gz MMPXQBMFCIKLGR-CABCVRRESA-N 1 0 274.364 3.605 20 5 CHBDRO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@@H]21 ZINC000590204437 1127251732 /nfs/dbraw/zinc/25/17/32/1127251732.db2.gz MMPXQBMFCIKLGR-GJZGRUSLSA-N 1 0 274.364 3.605 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@@H](SC)C1)c1cccc([N+](=O)[O-])c1 ZINC000224288169 1127258042 /nfs/dbraw/zinc/25/80/42/1127258042.db2.gz YMXYNKRRJGCSHJ-CFVMTHIKSA-N 1 0 294.420 3.920 20 5 CHBDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000590777412 1127271509 /nfs/dbraw/zinc/27/15/09/1127271509.db2.gz IVSUIWQXOBYOTJ-LLVKDONJSA-N 1 0 250.342 3.509 20 5 CHBDRO COC1(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CCCC1 ZINC000590778647 1127272143 /nfs/dbraw/zinc/27/21/43/1127272143.db2.gz ALGRHFCKNMNTAK-CYBMUJFWSA-N 1 0 292.379 3.513 20 5 CHBDRO Cc1ccccc1C1([NH2+]Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000592139966 1127339128 /nfs/dbraw/zinc/33/91/28/1127339128.db2.gz PYPDBKQVUJXRJR-UHFFFAOYSA-N 1 0 296.370 3.991 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H](C)CC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000592392230 1127344846 /nfs/dbraw/zinc/34/48/46/1127344846.db2.gz JCDCTBDUEVWOGP-GWCFXTLKSA-N 1 0 286.322 3.927 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000592379533 1127345870 /nfs/dbraw/zinc/34/58/70/1127345870.db2.gz LJSNATTVYDEYCX-VZCZASAYSA-N 1 0 286.375 3.776 20 5 CHBDRO CC(C)[C@@H]1N(Cc2csc([N+](=O)[O-])c2)CC12CC=CC2 ZINC000592529030 1127353542 /nfs/dbraw/zinc/35/35/42/1127353542.db2.gz WBMBXYNLECQLOX-AWEZNQCLSA-N 1 0 292.404 3.833 20 5 CHBDRO Cc1ccccc1C1([NH2+]Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000592372805 1127367296 /nfs/dbraw/zinc/36/72/96/1127367296.db2.gz QXAUEWOXPRXUSK-UHFFFAOYSA-N 1 0 296.370 3.991 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]2C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000592400015 1127373042 /nfs/dbraw/zinc/37/30/42/1127373042.db2.gz MANZMERTQLFBRT-BJKJVOPESA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1N(C)C)c1ccccc1[N+](=O)[O-] ZINC000358058402 1127399330 /nfs/dbraw/zinc/39/93/30/1127399330.db2.gz GLVDOUDQXACSPD-CYBMUJFWSA-N 1 0 299.374 3.512 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594499283 1127418446 /nfs/dbraw/zinc/41/84/46/1127418446.db2.gz BYPWOVXROGIBRL-BXUZGUMPSA-N 1 0 262.353 3.606 20 5 CHBDRO C[C@@H]([NH2+][C@H]1C[C@H](OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000594515834 1127420365 /nfs/dbraw/zinc/42/03/65/1127420365.db2.gz SQVMXNDGRYLBFK-UXIGCNINSA-N 1 0 292.379 3.592 20 5 CHBDRO CC(C)c1ccc(C[NH2+]Cc2cccc(N)c2)cc1[N+](=O)[O-] ZINC000594736057 1127430563 /nfs/dbraw/zinc/43/05/63/1127430563.db2.gz OJIGHXBMBPQKDA-UHFFFAOYSA-N 1 0 299.374 3.590 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CC[C@@H]1c1ccccc1 ZINC000594993187 1127444604 /nfs/dbraw/zinc/44/46/04/1127444604.db2.gz AOEUFQUFKDWMQJ-HZPDHXFCSA-N 1 0 282.343 3.631 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C(C)C)C1CC1 ZINC000595097948 1127452311 /nfs/dbraw/zinc/45/23/11/1127452311.db2.gz AGAIQMHABXIKSG-BDJLRTHQSA-N 1 0 292.379 3.689 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H]2C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000595076782 1127452980 /nfs/dbraw/zinc/45/29/80/1127452980.db2.gz JXXVIMHVSBTYFA-ATVPRXPUSA-N 1 0 274.364 3.682 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000595080860 1127453572 /nfs/dbraw/zinc/45/35/72/1127453572.db2.gz OZWPRINGCWGQAT-IAQYHMDHSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@]1(C)CC1(F)F ZINC000595081566 1127453642 /nfs/dbraw/zinc/45/36/42/1127453642.db2.gz SDLSIFDAGSEGRF-BXUZGUMPSA-N 1 0 298.333 3.989 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1CCC[C@@H](C)O1)c1cccc([N+](=O)[O-])c1 ZINC000595079269 1127453760 /nfs/dbraw/zinc/45/37/60/1127453760.db2.gz JHTQXYRYAJHCON-WQVCFCJDSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCc2ccco2)cc1[N+](=O)[O-] ZINC000595093484 1127454934 /nfs/dbraw/zinc/45/49/34/1127454934.db2.gz KEPAQQUAXMAOEN-ZDUSSCGKSA-N 1 0 288.347 3.780 20 5 CHBDRO CCC[N@@H+](Cc1onc(C)c1[N+](=O)[O-])CC1CCCCC1 ZINC000595295839 1127457428 /nfs/dbraw/zinc/45/74/28/1127457428.db2.gz UCONDCKYTLGHAO-UHFFFAOYSA-N 1 0 295.383 3.684 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH+](C1CCC1)C1CCC1 ZINC000595511815 1127464830 /nfs/dbraw/zinc/46/48/30/1127464830.db2.gz RJPVGRQTPUBMFE-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO CCC(C)(C)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000595641305 1127470995 /nfs/dbraw/zinc/47/09/95/1127470995.db2.gz IKJKONGZJKDSCL-NSHDSACASA-N 1 0 280.368 3.518 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)C2CCC(F)CC2)cccc1[N+](=O)[O-] ZINC000595819396 1127475924 /nfs/dbraw/zinc/47/59/24/1127475924.db2.gz PBEFAZINCJJGCM-DNOWBOINSA-N 1 0 294.370 3.910 20 5 CHBDRO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000595821314 1127476782 /nfs/dbraw/zinc/47/67/82/1127476782.db2.gz YSFZYWXVYXZZTC-UNXYVOJBSA-N 1 0 298.333 3.740 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000059971449 1127482921 /nfs/dbraw/zinc/48/29/21/1127482921.db2.gz WQLFYZODIHCJTQ-SUMWQHHRSA-N 1 0 296.370 3.803 20 5 CHBDRO CC[N@H+](Cc1csc([N+](=O)[O-])c1)CC(C)(C)C ZINC000361018607 1127530035 /nfs/dbraw/zinc/53/00/35/1127530035.db2.gz SYBPILMHGSGWNA-UHFFFAOYSA-N 1 0 256.371 3.524 20 5 CHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC1(F)F ZINC000602560637 1127592675 /nfs/dbraw/zinc/59/26/75/1127592675.db2.gz ODBFJCVENKCRMK-RISCZKNCSA-N 1 0 298.333 3.551 20 5 CHBDRO CCC(C)(C)[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602708331 1127607480 /nfs/dbraw/zinc/60/74/80/1127607480.db2.gz DCWLZRUXAFBUPA-JTQLQIEISA-N 1 0 291.351 3.650 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H]1CC1(F)F ZINC000598648755 1127630487 /nfs/dbraw/zinc/63/04/87/1127630487.db2.gz SAWQREYZOLKUGA-YLBKJLTLSA-N 1 0 296.317 3.633 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@@H]1CC1(F)F ZINC000598680474 1127631801 /nfs/dbraw/zinc/63/18/01/1127631801.db2.gz YFUGBNZHTFQCGQ-GHMZBOCLSA-N 1 0 284.306 3.599 20 5 CHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CC(F)(F)C1 ZINC000295650176 1127649146 /nfs/dbraw/zinc/64/91/46/1127649146.db2.gz ZGMRCESWGVOMFP-UHFFFAOYSA-N 1 0 298.333 3.851 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2CC=CC2)cc1[N+](=O)[O-] ZINC000599063786 1127654778 /nfs/dbraw/zinc/65/47/78/1127654778.db2.gz HOWHRKATVSNJLK-GFCCVEGCSA-N 1 0 290.363 3.610 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1(C2CCC2)CC1 ZINC000593677148 1127657362 /nfs/dbraw/zinc/65/73/62/1127657362.db2.gz RVUVRTUSDGWQMG-GQCTYLIASA-N 1 0 272.348 3.530 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1(C2CCC2)CC1 ZINC000593677149 1127657378 /nfs/dbraw/zinc/65/73/78/1127657378.db2.gz RVUVRTUSDGWQMG-XQRVVYSFSA-N 1 0 272.348 3.530 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCCC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000599093067 1127657557 /nfs/dbraw/zinc/65/75/57/1127657557.db2.gz USXZJXZPDTWELJ-GXTWGEPZSA-N 1 0 274.364 3.826 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1CC2(CCC2)C1 ZINC000593688930 1127660621 /nfs/dbraw/zinc/66/06/21/1127660621.db2.gz YQGRJYYVHNKAOH-UTCJRWHESA-N 1 0 272.348 3.530 20 5 CHBDRO CC(C)C[NH+](Cc1csc([N+](=O)[O-])c1)CC(C)C ZINC000603934226 1127685656 /nfs/dbraw/zinc/68/56/56/1127685656.db2.gz UVKXPLOCDNUAKY-UHFFFAOYSA-N 1 0 270.398 3.770 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000604013249 1127689402 /nfs/dbraw/zinc/68/94/02/1127689402.db2.gz YAPJRJYMNTWLTG-HNNXBMFYSA-N 1 0 274.364 3.749 20 5 CHBDRO C[C@H]([N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000604012214 1127689420 /nfs/dbraw/zinc/68/94/20/1127689420.db2.gz MBPUWGTVMJGFDV-ZDUSSCGKSA-N 1 0 294.395 3.730 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000604012897 1127689672 /nfs/dbraw/zinc/68/96/72/1127689672.db2.gz CNZMEIAHLGRYFB-INIZCTEOSA-N 1 0 274.364 3.749 20 5 CHBDRO Cc1cncc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000297384822 1127694623 /nfs/dbraw/zinc/69/46/23/1127694623.db2.gz RHGMTFDYKGCOHI-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@H]1CCC[N@H+](CCCCNc2ccsc2[N+](=O)[O-])C1 ZINC000604433472 1127705379 /nfs/dbraw/zinc/70/53/79/1127705379.db2.gz JSAUWWVLFSUXJX-LBPRGKRZSA-N 1 0 297.424 3.580 20 5 CHBDRO CCC(CC)[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000604434777 1127705807 /nfs/dbraw/zinc/70/58/07/1127705807.db2.gz GDJPXFHEZDKEJO-UHFFFAOYSA-N 1 0 262.353 3.748 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cccc1[N+](=O)[O-] ZINC000298787130 1127732750 /nfs/dbraw/zinc/73/27/50/1127732750.db2.gz WHBWZSJUZZLPFG-INIZCTEOSA-N 1 0 285.347 3.568 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C12CCC(CC1)C2 ZINC000371754817 1127777892 /nfs/dbraw/zinc/77/78/92/1127777892.db2.gz VVQGHZIJDZLKDV-HWKANZROSA-N 1 0 272.348 3.530 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001168423485 1127829428 /nfs/dbraw/zinc/82/94/28/1127829428.db2.gz KWXJCPVZMSTGHR-LLVKDONJSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@H]1CCC[N@@H+](C(C)(C)CNc2ccccc2[N+](=O)[O-])C1 ZINC000608856069 1127892531 /nfs/dbraw/zinc/89/25/31/1127892531.db2.gz BYCZOPKLGNVOEI-ZDUSSCGKSA-N 1 0 291.395 3.517 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H]1Cc1ccccc1 ZINC000544610839 1127979383 /nfs/dbraw/zinc/97/93/83/1127979383.db2.gz AYARAMPNEKWKJS-KRWDZBQOSA-N 1 0 296.370 3.720 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468001647 1127987442 /nfs/dbraw/zinc/98/74/42/1127987442.db2.gz CWIVTSXOCGYFET-GXTWGEPZSA-N 1 0 276.380 3.552 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000540625917 1127987817 /nfs/dbraw/zinc/98/78/17/1127987817.db2.gz WZGYUTGGGDTDRQ-RYWCDNDXSA-N 1 0 296.317 3.776 20 5 CHBDRO CC[C@]1(C)CC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468138132 1127995242 /nfs/dbraw/zinc/99/52/42/1127995242.db2.gz KHUBSAJGCZYWAD-SWLSCSKDSA-N 1 0 262.353 3.778 20 5 CHBDRO CC[N@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1C ZINC000541776147 1128037314 /nfs/dbraw/zinc/03/73/14/1128037314.db2.gz MYVPRCNKOSJRQH-UHFFFAOYSA-N 1 0 290.388 3.987 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000470178434 1128064798 /nfs/dbraw/zinc/06/47/98/1128064798.db2.gz YKNZYUDJEYOEDW-YQPRGPPOSA-N 1 0 286.375 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCCCCC1 ZINC000470174563 1128064995 /nfs/dbraw/zinc/06/49/95/1128064995.db2.gz MDUXZSJKPWLXJP-SDNWHVSQSA-N 1 0 274.364 3.874 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C)[C@@H]1C ZINC000470180545 1128065224 /nfs/dbraw/zinc/06/52/24/1128065224.db2.gz OQZOPUGEGPPXTC-ZJTSMVRJSA-N 1 0 274.364 3.728 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H](C)C1CC1 ZINC000470176947 1128065548 /nfs/dbraw/zinc/06/55/48/1128065548.db2.gz ZFZILGASWFLYQI-SRXBQZRASA-N 1 0 274.364 3.728 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492558016 1128103494 /nfs/dbraw/zinc/10/34/94/1128103494.db2.gz KCGUJSNWXBZEKV-LBPRGKRZSA-N 1 0 280.368 3.614 20 5 CHBDRO CC1(C)CCC[C@@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000492910667 1128116139 /nfs/dbraw/zinc/11/61/39/1128116139.db2.gz GJENYDZSIPWDNS-HNNXBMFYSA-N 1 0 292.379 3.532 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccccn1 ZINC000152426334 1128122375 /nfs/dbraw/zinc/12/23/75/1128122375.db2.gz VLDHYWDYNWSWFC-KBPBESRZSA-N 1 0 299.374 3.662 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2CCCC2)cc1Cl ZINC000761520429 1128132837 /nfs/dbraw/zinc/13/28/37/1128132837.db2.gz FXFSGVIEKIUPKI-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO CCC[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761520423 1128132958 /nfs/dbraw/zinc/13/29/58/1128132958.db2.gz FVVUVNLIBGXBIC-SECBINFHSA-N 1 0 256.733 3.526 20 5 CHBDRO CCC[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761520425 1128133015 /nfs/dbraw/zinc/13/30/15/1128133015.db2.gz FVVUVNLIBGXBIC-VIFPVBQESA-N 1 0 256.733 3.526 20 5 CHBDRO CC(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000324271703 1128165442 /nfs/dbraw/zinc/16/54/42/1128165442.db2.gz NWGMCUNIMGXZFF-CQSZACIVSA-N 1 0 282.771 3.772 20 5 CHBDRO CCCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609193558 1128170646 /nfs/dbraw/zinc/17/06/46/1128170646.db2.gz RTPYNELKGFSTSW-UHFFFAOYSA-N 1 0 280.368 3.614 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)C1CCCC1 ZINC000609193331 1128170833 /nfs/dbraw/zinc/17/08/33/1128170833.db2.gz BCVLWLOUJRQJLL-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000609195400 1128170858 /nfs/dbraw/zinc/17/08/58/1128170858.db2.gz FUQLOWQATNIRJB-HNNXBMFYSA-N 1 0 276.380 3.914 20 5 CHBDRO CC(C)CC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609193110 1128170917 /nfs/dbraw/zinc/17/09/17/1128170917.db2.gz HMEUTPFOJVWTLW-UHFFFAOYSA-N 1 0 294.395 3.860 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(CF)cc1)c1cccc([N+](=O)[O-])c1 ZINC000777724037 1128254873 /nfs/dbraw/zinc/25/48/73/1128254873.db2.gz LOFAGOARBHAZRY-LBPRGKRZSA-N 1 0 288.322 3.915 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCS[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000927029883 1128209535 /nfs/dbraw/zinc/20/95/35/1128209535.db2.gz GFKYWKZEGRVYOG-WZRBSPASSA-N 1 0 280.393 3.530 20 5 CHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCSC1 ZINC000495079243 1128229308 /nfs/dbraw/zinc/22/93/08/1128229308.db2.gz MWJLEGKBGUJELX-AWEZNQCLSA-N 1 0 294.420 3.558 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(CNCc2ccccc2)c1 ZINC000035368064 1128291861 /nfs/dbraw/zinc/29/18/61/1128291861.db2.gz ROFJCNFPLYKYCO-UHFFFAOYSA-N 1 0 276.723 3.538 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1cccc([N+](=O)[O-])c1 ZINC000930208074 1128307473 /nfs/dbraw/zinc/30/74/73/1128307473.db2.gz JAHDRKINBMQMQK-ZNIXKSQXSA-N 1 0 296.317 3.537 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1CF)c1ccccc1[N+](=O)[O-] ZINC000930235273 1128310213 /nfs/dbraw/zinc/31/02/13/1128310213.db2.gz LJHCNAVXUXGIKM-LBPRGKRZSA-N 1 0 288.322 3.915 20 5 CHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000915685328 1128334081 /nfs/dbraw/zinc/33/40/81/1128334081.db2.gz VEFPDVRKNMDXGB-BXUZGUMPSA-N 1 0 280.343 3.744 20 5 CHBDRO CC[N@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])cc2)c1 ZINC000301117380 1128389490 /nfs/dbraw/zinc/38/94/90/1128389490.db2.gz MNCGZORNUVMRIL-UHFFFAOYSA-N 1 0 299.374 3.659 20 5 CHBDRO Cc1cc(F)ccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000932178100 1128398941 /nfs/dbraw/zinc/39/89/41/1128398941.db2.gz WJFIQDVGARIORC-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@H]([N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])C(C)(C)C ZINC000917099010 1128479343 /nfs/dbraw/zinc/47/93/43/1128479343.db2.gz ZYXGRPFQRXPGRB-JTQLQIEISA-N 1 0 268.332 3.600 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000917835793 1128521994 /nfs/dbraw/zinc/52/19/94/1128521994.db2.gz JLFQXDLKBWJPNQ-HNNXBMFYSA-N 1 0 292.354 3.889 20 5 CHBDRO CC(C)C1([NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])CC1 ZINC000556229011 1128565946 /nfs/dbraw/zinc/56/59/46/1128565946.db2.gz DXUZNEKGCWZFJO-CYBMUJFWSA-N 1 0 276.380 3.694 20 5 CHBDRO CC1=CC[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000556876182 1128632447 /nfs/dbraw/zinc/63/24/47/1128632447.db2.gz ABOXHYUZSMACSL-CQSZACIVSA-N 1 0 299.374 3.707 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCc1cccs1 ZINC000075966854 1128696675 /nfs/dbraw/zinc/69/66/75/1128696675.db2.gz YBTAJPHISUZOHT-LBPRGKRZSA-N 1 0 290.388 3.892 20 5 CHBDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609704831 1128722473 /nfs/dbraw/zinc/72/24/73/1128722473.db2.gz QVYWFUWIZAGBRX-GHMZBOCLSA-N 1 0 282.771 3.726 20 5 CHBDRO CC[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609766692 1128725292 /nfs/dbraw/zinc/72/52/92/1128725292.db2.gz FCQPWLZMBGCANO-AWEZNQCLSA-N 1 0 276.380 3.649 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)CCc2ccco2)cc1[N+](=O)[O-] ZINC000035011153 1117760892 /nfs/dbraw/zinc/76/08/92/1117760892.db2.gz NLFLWDVGVAJKBI-ZDUSSCGKSA-N 1 0 288.347 3.607 20 5 CHBDRO CC(C)[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000610133552 1128739511 /nfs/dbraw/zinc/73/95/11/1128739511.db2.gz QKKLSPCLDXRKSR-UHFFFAOYSA-N 1 0 292.379 3.627 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610080165 1128738193 /nfs/dbraw/zinc/73/81/93/1128738193.db2.gz KRQYUHWHDJCPKB-AWEZNQCLSA-N 1 0 292.379 3.628 20 5 CHBDRO CCC(CC)[N@H+](CCOC)Cc1cccc([N+](=O)[O-])c1C ZINC000064806005 1117851041 /nfs/dbraw/zinc/85/10/41/1117851041.db2.gz RUZGZIKYFRSISY-UHFFFAOYSA-N 1 0 294.395 3.540 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)C[C@@H]1C ZINC000610133400 1128739127 /nfs/dbraw/zinc/73/91/27/1128739127.db2.gz MJQCNADJFPAFHX-OLZOCXBDSA-N 1 0 292.379 3.612 20 5 CHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000610215373 1117882251 /nfs/dbraw/zinc/88/22/51/1117882251.db2.gz JETLCCMMILJNBH-STQMWFEESA-N 1 0 262.353 3.605 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000090918551 1117923994 /nfs/dbraw/zinc/92/39/94/1117923994.db2.gz TUDXVXNTSVVLIP-CABZTGNLSA-N 1 0 290.285 3.976 20 5 CHBDRO CC(C)C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C(C)C ZINC000509388880 1117934390 /nfs/dbraw/zinc/93/43/90/1117934390.db2.gz SINNEDCIQVTCQN-VQHVLOKHSA-N 1 0 276.380 3.974 20 5 CHBDRO CC[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609766693 1118008034 /nfs/dbraw/zinc/00/80/34/1118008034.db2.gz FCQPWLZMBGCANO-CQSZACIVSA-N 1 0 276.380 3.649 20 5 CHBDRO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000112675827 1118084482 /nfs/dbraw/zinc/08/44/82/1118084482.db2.gz VCPGGAXAKODDNL-CHWSQXEVSA-N 1 0 282.409 3.961 20 5 CHBDRO CCC(CC)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000130711617 1118084615 /nfs/dbraw/zinc/08/46/15/1118084615.db2.gz PYFZMSYTRXMRQS-NSHDSACASA-N 1 0 250.342 3.682 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000237592553 1118151732 /nfs/dbraw/zinc/15/17/32/1118151732.db2.gz NNWXGFNZYAHHQG-UWVGGRQHSA-N 1 0 268.382 3.571 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1NC1CC[NH+](C(C)(C)C)CC1 ZINC000301439783 1118235197 /nfs/dbraw/zinc/23/51/97/1118235197.db2.gz LWTZYKYLTJJPFE-UHFFFAOYSA-N 1 0 291.395 3.578 20 5 CHBDRO CCCCC[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000061002399 1118304389 /nfs/dbraw/zinc/30/43/89/1118304389.db2.gz GAUQERASWQMJRQ-UHFFFAOYSA-N 1 0 264.369 3.998 20 5 CHBDRO CC[N@H+](Cc1cccs1)Cc1cccc([N+](=O)[O-])c1 ZINC000061785446 1118308317 /nfs/dbraw/zinc/30/83/17/1118308317.db2.gz FVNIQEBFGCATBK-UHFFFAOYSA-N 1 0 276.361 3.678 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH+]1C2CCCC1CCC2 ZINC000610370170 1118362039 /nfs/dbraw/zinc/36/20/39/1118362039.db2.gz ZWRIHNMXNXUTGS-UHFFFAOYSA-N 1 0 290.363 3.510 20 5 CHBDRO CC[NH+](CC)CCCCNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000471542496 1118385342 /nfs/dbraw/zinc/38/53/42/1118385342.db2.gz NSVUMHRNBFROSP-UHFFFAOYSA-N 1 0 299.802 3.782 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)s1 ZINC000050225238 1118455436 /nfs/dbraw/zinc/45/54/36/1118455436.db2.gz VXIYOXGQZPWLFK-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000083640393 1118462096 /nfs/dbraw/zinc/46/20/96/1118462096.db2.gz PZLYJUXHSNOMTN-GXTWGEPZSA-N 1 0 262.353 3.653 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1C[C@@H](C)C[C@H](C)C1 ZINC000084975420 1118480512 /nfs/dbraw/zinc/48/05/12/1118480512.db2.gz AUALMPWHNKTTSQ-RYUDHWBXSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000096610062 1118545656 /nfs/dbraw/zinc/54/56/56/1118545656.db2.gz VRUJQXIPJKWOAL-LBPRGKRZSA-N 1 0 264.369 3.675 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC23CCCC3)cccc1[N+](=O)[O-] ZINC000616357493 1128787510 /nfs/dbraw/zinc/78/75/10/1128787510.db2.gz QBDUCTDDPWMGQP-HNNXBMFYSA-N 1 0 274.364 3.716 20 5 CHBDRO Cc1cccc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])c1 ZINC000157326418 1118637158 /nfs/dbraw/zinc/63/71/58/1118637158.db2.gz LSGDEJZAVCHZQD-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO CC(C)c1ccc(C[NH+]2C3CCC2CC3)cc1[N+](=O)[O-] ZINC000535779851 1118884256 /nfs/dbraw/zinc/88/42/56/1118884256.db2.gz GNCPDIQAXJUIBX-UHFFFAOYSA-N 1 0 274.364 3.845 20 5 CHBDRO C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CC1 ZINC000610805355 1118892749 /nfs/dbraw/zinc/89/27/49/1118892749.db2.gz VVDRCJWFNDSVSZ-WBMJQRKESA-N 1 0 288.391 3.552 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000610830979 1118899067 /nfs/dbraw/zinc/89/90/67/1118899067.db2.gz SUTYGKDHYFTHKJ-ZIAGYGMSSA-N 1 0 299.374 3.753 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000084986802 1119016421 /nfs/dbraw/zinc/01/64/21/1119016421.db2.gz USLCYRYVAJCDAL-MBNYWOFBSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1nc([C@@H](C)NCc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000050015555 1119091239 /nfs/dbraw/zinc/09/12/39/1119091239.db2.gz UMIPFUBJAAKJHL-SECBINFHSA-N 1 0 291.376 3.519 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(Cc2ccccc2)CC1 ZINC000479419760 1119117331 /nfs/dbraw/zinc/11/73/31/1119117331.db2.gz KZBBBHGATKZXEB-UHFFFAOYSA-N 1 0 296.370 3.768 20 5 CHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000479579257 1119125587 /nfs/dbraw/zinc/12/55/87/1119125587.db2.gz NTWFDMBBDZSRHX-SWLSCSKDSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000178640722 1119158664 /nfs/dbraw/zinc/15/86/64/1119158664.db2.gz YVTUOVJGZVDINA-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000121988798 1119255302 /nfs/dbraw/zinc/25/53/02/1119255302.db2.gz IICBFLLBLDOIKE-QWHCGFSZSA-N 1 0 294.395 3.757 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000221391363 1119277356 /nfs/dbraw/zinc/27/73/56/1119277356.db2.gz PHQQXTKVOZRUIE-TYNCELHUSA-N 1 0 276.380 3.818 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CC[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000583254489 1119327578 /nfs/dbraw/zinc/32/75/78/1119327578.db2.gz NJUYSIFMHDRJLT-STQMWFEESA-N 1 0 292.379 3.518 20 5 CHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000219701720 1119511302 /nfs/dbraw/zinc/51/13/02/1119511302.db2.gz GCPYBZDXSAHDSB-GXTWGEPZSA-N 1 0 262.353 3.605 20 5 CHBDRO CS[C@@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000235225006 1119526879 /nfs/dbraw/zinc/52/68/79/1119526879.db2.gz RMTFIQNYENRLTL-UONOGXRCSA-N 1 0 294.420 3.667 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000414208943 1119939571 /nfs/dbraw/zinc/93/95/71/1119939571.db2.gz MANZMERTQLFBRT-IPOQPSJVSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@H]([NH2+]CC(C)(C)c1cccnc1)c1ccc([N+](=O)[O-])cc1 ZINC000414320903 1119981128 /nfs/dbraw/zinc/98/11/28/1119981128.db2.gz BPMQIRMCJVWUAX-ZDUSSCGKSA-N 1 0 299.374 3.618 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccoc2)cc1[N+](=O)[O-] ZINC000181235356 1120031779 /nfs/dbraw/zinc/03/17/79/1120031779.db2.gz QVGHISXTZAMGAX-RYUDHWBXSA-N 1 0 274.320 3.908 20 5 CHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000062726459 1120205571 /nfs/dbraw/zinc/20/55/71/1120205571.db2.gz OHRSFOSCPYNMJC-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1cc[nH+]c(NCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000301635481 1120222075 /nfs/dbraw/zinc/22/20/75/1120222075.db2.gz KSYBRHLOKPILQW-UHFFFAOYSA-N 1 0 285.347 3.733 20 5 CHBDRO C[C@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000086889894 1120223813 /nfs/dbraw/zinc/22/38/13/1120223813.db2.gz OXPCZAOMMBMHBU-JSGCOSHPSA-N 1 0 262.353 3.653 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000020084133 1120279866 /nfs/dbraw/zinc/27/98/66/1120279866.db2.gz XUUKKMFFDJOXQQ-HNNXBMFYSA-N 1 0 274.320 3.819 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000312122485 1120309178 /nfs/dbraw/zinc/30/91/78/1120309178.db2.gz WKNHKYVZEVXEKZ-LLVKDONJSA-N 1 0 268.332 3.744 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000312630795 1120370460 /nfs/dbraw/zinc/37/04/60/1120370460.db2.gz YFFTYEUFIHQVAS-NSHDSACASA-N 1 0 280.343 3.792 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)c(F)c1 ZINC000313853446 1120414029 /nfs/dbraw/zinc/41/40/29/1120414029.db2.gz SXSKYOGUPODDLC-WBMJQRKESA-N 1 0 292.354 3.889 20 5 CHBDRO CS[C@@H](C)C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314234 1120425546 /nfs/dbraw/zinc/42/55/46/1120425546.db2.gz YKWPVGRTVAQJTE-XHDPSFHLSA-N 1 0 294.420 3.703 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CCC1 ZINC000618572284 1128919117 /nfs/dbraw/zinc/91/91/17/1128919117.db2.gz GZQVJVYMUQCZMJ-MEDUHNTESA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000020095899 1120492837 /nfs/dbraw/zinc/49/28/37/1120492837.db2.gz SAGNBNKOXNNANW-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000182024674 1128922174 /nfs/dbraw/zinc/92/21/74/1128922174.db2.gz SAPDQHNLEJBWSU-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CC1(C)CCC[C@@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000388951104 1120543639 /nfs/dbraw/zinc/54/36/39/1120543639.db2.gz ABBNFGRCBMHDSK-CYBMUJFWSA-N 1 0 262.353 3.511 20 5 CHBDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000154931307 1120565556 /nfs/dbraw/zinc/56/55/56/1120565556.db2.gz TZWWLMOHCJUFGH-DOMZBBRYSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@H]([NH2+]CC1(C2CC2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000155035802 1120567610 /nfs/dbraw/zinc/56/76/10/1120567610.db2.gz XUCKIQCYZSOPKA-LBPRGKRZSA-N 1 0 274.364 3.826 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)cc1 ZINC000282145713 1120629900 /nfs/dbraw/zinc/62/99/00/1120629900.db2.gz WNBWAAOFZKSQCA-LBPRGKRZSA-N 1 0 284.306 3.510 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000303016971 1120663193 /nfs/dbraw/zinc/66/31/93/1120663193.db2.gz SLJTUDAGUQMWTR-QGZVFWFLSA-N 1 0 296.370 3.627 20 5 CHBDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000313242018 1120696052 /nfs/dbraw/zinc/69/60/52/1120696052.db2.gz VOGUUJMYZBGZKV-VIFPVBQESA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1cc(CN2CCC[C@H]2c2ccccc2)cs1 ZINC000048609556 1120835616 /nfs/dbraw/zinc/83/56/16/1120835616.db2.gz ABQXHZOESHOWQT-AWEZNQCLSA-N 1 0 288.372 3.993 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000300404385 1120938107 /nfs/dbraw/zinc/93/81/07/1120938107.db2.gz QNDNBXCGNJERNT-MPKXVKKWSA-N 1 0 280.393 3.530 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000300405341 1120939863 /nfs/dbraw/zinc/93/98/63/1120939863.db2.gz KIVNATDPLGMZHB-MPKXVKKWSA-N 1 0 280.393 3.530 20 5 CHBDRO C[NH+](C)[C@H]1CCC[C@@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432309333 1120946437 /nfs/dbraw/zinc/94/64/37/1120946437.db2.gz AVIKHZSSTKWEBS-MNOVXSKESA-N 1 0 297.786 3.533 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000511970115 1120946580 /nfs/dbraw/zinc/94/65/80/1120946580.db2.gz DYRDWXKGTJYSPO-LBPRGKRZSA-N 1 0 286.331 3.697 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)CC(C)(C)C ZINC000389108016 1120976621 /nfs/dbraw/zinc/97/66/21/1120976621.db2.gz KKCYIGGHWDTOSZ-UHFFFAOYSA-N 1 0 268.332 3.602 20 5 CHBDRO Cc1c(C)c(C)c(CO[C@H](C)C[N+](C)(C)C)c(C)c1C ZINC001223322355 1121031286 /nfs/dbraw/zinc/03/12/86/1121031286.db2.gz PVJWEGHXVKYIRM-GFCCVEGCSA-N 1 0 278.460 3.840 20 5 CHBDRO CCC[C@H]([NH2+]CCC[C@@H](O)CC)c1cccc([N+](=O)[O-])c1 ZINC000358175641 1121067202 /nfs/dbraw/zinc/06/72/02/1121067202.db2.gz ZBDPIXYBMGIOTC-HOTGVXAUSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)C[C@H]1CC1(C)C ZINC001174908298 1121087025 /nfs/dbraw/zinc/08/70/25/1121087025.db2.gz ZAACLRWAYGBKJU-CHWSQXEVSA-N 1 0 276.380 3.942 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(CNCc3ccoc3)o2)c1 ZINC000171050654 1121088427 /nfs/dbraw/zinc/08/84/27/1121088427.db2.gz DLZMUNGNSWFVSN-UHFFFAOYSA-N 1 0 298.298 3.738 20 5 CHBDRO Cc1cc(C)[nH+]c(Nc2ccc(/C=C/[N+](=O)[O-])cc2)c1 ZINC001175901142 1121493151 /nfs/dbraw/zinc/49/31/51/1121493151.db2.gz ZVBMYKLJGXNFAS-BQYQJAHWSA-N 1 0 269.304 3.689 20 5 CHBDRO OC[C@H]1C[C@H]([NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000923008063 1121512212 /nfs/dbraw/zinc/51/22/12/1121512212.db2.gz NDFJPAUBHBHXQZ-CZIWCDLHSA-N 1 0 291.394 3.854 20 5 CHBDRO CC(C)C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)C ZINC000509292671 1121516626 /nfs/dbraw/zinc/51/66/26/1121516626.db2.gz AVDUADFZJQHEEK-UHFFFAOYSA-N 1 0 286.322 3.739 20 5 CHBDRO Cc1ccoc1C[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000429409173 1121567911 /nfs/dbraw/zinc/56/79/11/1121567911.db2.gz QYRZACOKYKCVKW-CYBMUJFWSA-N 1 0 288.347 3.998 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000611248320 1121632295 /nfs/dbraw/zinc/63/22/95/1121632295.db2.gz RSHNUAPFPTZGIL-VXGBXAGGSA-N 1 0 280.368 3.833 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCO[C@@H](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC001178205787 1121771366 /nfs/dbraw/zinc/77/13/66/1121771366.db2.gz UUVNEPUDMXHTOA-VNQPRFMTSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]1CCC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC001178386799 1121782581 /nfs/dbraw/zinc/78/25/81/1121782581.db2.gz NCHYTENKUIVJOH-ZFWWWQNUSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCC[C@H]2C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000619753695 1129010536 /nfs/dbraw/zinc/01/05/36/1129010536.db2.gz MANZMERTQLFBRT-AEAUEXCSSA-N 1 0 274.364 3.824 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000430034395 1121932092 /nfs/dbraw/zinc/93/20/92/1121932092.db2.gz JSXDZGPXDQXISU-KTLBGCOUSA-N 1 0 296.317 3.633 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](C)[C@@H](C)C1 ZINC001180199380 1121965735 /nfs/dbraw/zinc/96/57/35/1121965735.db2.gz RNGSGNNNEAYHLT-AAEUAGOBSA-N 1 0 276.380 3.690 20 5 CHBDRO CC(C)C[C@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001180348745 1121978770 /nfs/dbraw/zinc/97/87/70/1121978770.db2.gz ATMANGCKGAKOGN-NSHDSACASA-N 1 0 284.787 3.815 20 5 CHBDRO CC(C)[C@@H]1CC[C@H]1[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC001183652525 1122233061 /nfs/dbraw/zinc/23/30/61/1122233061.db2.gz RTDHVHWBAIQMOM-MBNYWOFBSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC001184044780 1122252216 /nfs/dbraw/zinc/25/22/16/1122252216.db2.gz DJXWQOXYOQKOPP-QWHCGFSZSA-N 1 0 276.380 3.867 20 5 CHBDRO CC[C@H](C)[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504925472 1122311164 /nfs/dbraw/zinc/31/11/64/1122311164.db2.gz CDVKAIDQVCZGQJ-RYUDHWBXSA-N 1 0 282.409 3.854 20 5 CHBDRO CCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)CC1CC1 ZINC000435239420 1122447037 /nfs/dbraw/zinc/44/70/37/1122447037.db2.gz WEEMBQYLNHJFCS-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(SC(F)(F)F)cc1 ZINC001225792068 1122467272 /nfs/dbraw/zinc/46/72/72/1122467272.db2.gz IAGCTCQLBZQJHI-SNVBAGLBSA-N 1 0 294.362 3.772 20 5 CHBDRO Cc1ccc(Cn2cnc3c2C[C@@H](C)[C@H](C)C3)cc1[N+](=O)[O-] ZINC001189416761 1122501081 /nfs/dbraw/zinc/50/10/81/1122501081.db2.gz ZWKVKVLFIJMEBF-CHWSQXEVSA-N 1 0 299.374 3.519 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000183521955 1129059634 /nfs/dbraw/zinc/05/96/34/1129059634.db2.gz WGQVQVWXVMBZSU-RYUDHWBXSA-N 1 0 282.409 3.695 20 5 CHBDRO Cc1ccc(C[N@@H+](CCC(C)C)C2CC2)cc1[N+](=O)[O-] ZINC001190323924 1122533816 /nfs/dbraw/zinc/53/38/16/1122533816.db2.gz AZYWUMFSIUOMIL-UHFFFAOYSA-N 1 0 276.380 3.914 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C)CCC[C@H]1C ZINC001191070295 1122568527 /nfs/dbraw/zinc/56/85/27/1122568527.db2.gz KCQGVHJGDCZCOV-CHWSQXEVSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000516558728 1122611484 /nfs/dbraw/zinc/61/14/84/1122611484.db2.gz DGGZWXNVNYJHMI-RYUDHWBXSA-N 1 0 298.333 3.941 20 5 CHBDRO C[C@H]1C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192499590 1122648516 /nfs/dbraw/zinc/64/85/16/1122648516.db2.gz CSSFMAHOSBTQFP-LLVKDONJSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000506220218 1122698033 /nfs/dbraw/zinc/69/80/33/1122698033.db2.gz VAEDHLRDBZZDCI-OCCSQVGLSA-N 1 0 262.353 3.605 20 5 CHBDRO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC[C@@H]1C[C@H]1C1CC1 ZINC001193743926 1122711867 /nfs/dbraw/zinc/71/18/67/1122711867.db2.gz WTEOMKXUTWGTTC-WBVHZDCISA-N 1 0 288.391 3.505 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC001194426144 1122775162 /nfs/dbraw/zinc/77/51/62/1122775162.db2.gz JPWXROAKOKHMKF-CQSZACIVSA-N 1 0 264.369 3.899 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H]1CC1(C)C ZINC000426569508 1122822844 /nfs/dbraw/zinc/82/28/44/1122822844.db2.gz AVTREXFKFFIJSA-PINLSGDHSA-N 1 0 274.364 3.728 20 5 CHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000543556613 1122885451 /nfs/dbraw/zinc/88/54/51/1122885451.db2.gz GKJRGRMBXOIPOK-GFCCVEGCSA-N 1 0 268.382 3.811 20 5 CHBDRO Cc1ccccc1[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000507184392 1122935609 /nfs/dbraw/zinc/93/56/09/1122935609.db2.gz UYRTWTJYGVKNKJ-OAHLLOKOSA-N 1 0 296.370 3.893 20 5 CHBDRO Cc1ccc(C[NH2+]C2(C)Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000507724117 1122990074 /nfs/dbraw/zinc/99/00/74/1122990074.db2.gz JCTITDFFQRIKMP-UHFFFAOYSA-N 1 0 296.370 3.550 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1CC(F)(F)C1 ZINC000519679469 1123013757 /nfs/dbraw/zinc/01/37/57/1123013757.db2.gz UYXRAWDEUVDBLO-JTQLQIEISA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000441432667 1123116680 /nfs/dbraw/zinc/11/66/80/1123116680.db2.gz FBGVBRHDFBIHML-BBRMVZONSA-N 1 0 274.364 3.668 20 5 CHBDRO CC[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000129579913 1123187294 /nfs/dbraw/zinc/18/72/94/1123187294.db2.gz YEPJEISSPPCHLD-GUTXKFCHSA-N 1 0 276.380 3.694 20 5 CHBDRO CC(C)C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000507999218 1123253889 /nfs/dbraw/zinc/25/38/89/1123253889.db2.gz NLAFSGBSZYOYPB-ALCCZGGFSA-N 1 0 274.364 3.728 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000776884015 1123559895 /nfs/dbraw/zinc/55/98/95/1123559895.db2.gz VRHCGPQFWREJRM-VXGBXAGGSA-N 1 0 292.379 3.833 20 5 CHBDRO COc1cc(C[N@H+](C)[C@@H]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000444665978 1124050753 /nfs/dbraw/zinc/05/07/53/1124050753.db2.gz QJQVGBUHZXBIHD-GXTWGEPZSA-N 1 0 292.379 3.614 20 5 CHBDRO CCc1ccccc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000445797457 1124103164 /nfs/dbraw/zinc/10/31/64/1124103164.db2.gz AHSJQAYGRJHREK-UHFFFAOYSA-N 1 0 284.359 3.789 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000525273842 1124119876 /nfs/dbraw/zinc/11/98/76/1124119876.db2.gz ZKALKBJZKFXEEQ-XPKDYRNWSA-N 1 0 274.364 3.748 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC13CCCC3)CCC2 ZINC000447599011 1124496441 /nfs/dbraw/zinc/49/64/41/1124496441.db2.gz IODNHCUPKCBYCP-JKSUJKDBSA-N 1 0 286.375 3.895 20 5 CHBDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038073 1124662633 /nfs/dbraw/zinc/66/26/33/1124662633.db2.gz HRWJKGBFZMNZFS-GHMZBOCLSA-N 1 0 298.358 3.588 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872038776 1124663687 /nfs/dbraw/zinc/66/36/87/1124663687.db2.gz OFGPIANKBMBGLB-GARJFASQSA-N 1 0 298.383 3.669 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])C1CCC1 ZINC000872051802 1124666862 /nfs/dbraw/zinc/66/68/62/1124666862.db2.gz NKOMDNBLZNYDSN-ZJUUUORDSA-N 1 0 266.316 3.573 20 5 CHBDRO CSCCCCC[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449256811 1124677709 /nfs/dbraw/zinc/67/77/09/1124677709.db2.gz KAGWWJHPKHHIRA-ZDUSSCGKSA-N 1 0 296.436 3.649 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1C=CCC1 ZINC000872086092 1124679603 /nfs/dbraw/zinc/67/96/03/1124679603.db2.gz UKDBUQLPUJNJOJ-GHMZBOCLSA-N 1 0 278.377 3.686 20 5 CHBDRO CC/C=C/C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000449464648 1124759434 /nfs/dbraw/zinc/75/94/34/1124759434.db2.gz YNKWEPVTBRMWTK-VBJRVQAISA-N 1 0 260.337 3.554 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](C2CC2)C2CCCC2)c(F)c1 ZINC000531348104 1125212076 /nfs/dbraw/zinc/21/20/76/1125212076.db2.gz REGFEARTWOQVRX-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO COc1ccc(C[NH2+]CCCCC(C)(C)C)cc1[N+](=O)[O-] ZINC000520215238 1125226931 /nfs/dbraw/zinc/22/69/31/1125226931.db2.gz RBQBOMBGUVHTJT-UHFFFAOYSA-N 1 0 294.395 3.909 20 5 CHBDRO CC(C)[N@H+]1CC=C(c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000138943298 1125244003 /nfs/dbraw/zinc/24/40/03/1125244003.db2.gz ULCXWNOYBKALNO-UHFFFAOYSA-N 1 0 285.347 3.574 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532292737 1125246596 /nfs/dbraw/zinc/24/65/96/1125246596.db2.gz AFQXCCCFUSWZIA-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532326595 1125249148 /nfs/dbraw/zinc/24/91/48/1125249148.db2.gz LDHFUSZSSGRDEK-CYBMUJFWSA-N 1 0 262.353 3.607 20 5 CHBDRO CCN(Cc1ccoc1)Cc1cccc([N+](=O)[O-])c1C ZINC000102407710 1125277535 /nfs/dbraw/zinc/27/75/35/1125277535.db2.gz RUTKPWOQUYGLAV-UHFFFAOYSA-N 1 0 274.320 3.518 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C(C2CCC2)C2CCC2)c(F)c1 ZINC000324710059 1125335355 /nfs/dbraw/zinc/33/53/55/1125335355.db2.gz CXVQIJNUFSFJOI-UHFFFAOYSA-N 1 0 292.354 3.792 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(C3CC3)cc2)c1 ZINC000094519692 1125385809 /nfs/dbraw/zinc/38/58/09/1125385809.db2.gz NBODLCRCOUJATF-UHFFFAOYSA-N 1 0 282.343 3.762 20 5 CHBDRO C[C@@H]([NH2+]CC(C)(C)CC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000883258543 1125386501 /nfs/dbraw/zinc/38/65/01/1125386501.db2.gz GEQZXXBUCIMANQ-SNVBAGLBSA-N 1 0 286.322 3.927 20 5 CHBDRO C=C/C=C\CC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000883269147 1125389543 /nfs/dbraw/zinc/38/95/43/1125389543.db2.gz AFHQUVNLDVVSDX-DOGVGXBMSA-N 1 0 264.300 3.517 20 5 CHBDRO CSCC[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000131623837 1125402176 /nfs/dbraw/zinc/40/21/76/1125402176.db2.gz RAWJQJSYCBMRJD-VXGBXAGGSA-N 1 0 282.409 3.695 20 5 CHBDRO CSC1(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000897465068 1125424718 /nfs/dbraw/zinc/42/47/18/1125424718.db2.gz SBPDPUDDMPQOOP-LBPRGKRZSA-N 1 0 294.420 3.574 20 5 CHBDRO C[C@H](C[NH2+]C1CC2(CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000897465210 1125424974 /nfs/dbraw/zinc/42/49/74/1125424974.db2.gz TVLIOSOSKNNCGE-GFCCVEGCSA-N 1 0 274.364 3.621 20 5 CHBDRO CC[C@H]([NH2+]Cc1occc1C)c1cccc([N+](=O)[O-])c1 ZINC000090224427 1129275442 /nfs/dbraw/zinc/27/54/42/1129275442.db2.gz TUCYAXWTQTXAOK-AWEZNQCLSA-N 1 0 274.320 3.737 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1C ZINC000094773111 1129451847 /nfs/dbraw/zinc/45/18/47/1129451847.db2.gz VJZVKMFTMJWIEU-JTNHKYCSSA-N 1 0 280.343 3.648 20 5 CHBDRO Cc1cccc(F)c1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000742380936 1129473295 /nfs/dbraw/zinc/47/32/95/1129473295.db2.gz UBHNPVVUDWGPAX-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO Cc1cc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)ccc1Cl ZINC001168979898 1129686865 /nfs/dbraw/zinc/68/68/65/1129686865.db2.gz BZSKNKAKQLPCKX-OUCADQQQSA-N 1 0 296.798 3.744 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001168980722 1129687146 /nfs/dbraw/zinc/68/71/46/1129687146.db2.gz GACPRARHDJTQGM-MAZHCROVSA-N 1 0 294.370 3.702 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001169001266 1129688337 /nfs/dbraw/zinc/68/83/37/1129688337.db2.gz FBEDHCMVGMYSBR-NUEKZKHPSA-N 1 0 276.380 3.563 20 5 CHBDRO CC(C)c1ccc([C@@H](C)[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001168993308 1129688422 /nfs/dbraw/zinc/68/84/22/1129688422.db2.gz MIZBOHCLZBICQW-KEYYUXOJSA-N 1 0 290.407 3.906 20 5 CHBDRO CC(C)(C)[N@H+](Cc1ccccc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169005754 1129689304 /nfs/dbraw/zinc/68/93/04/1129689304.db2.gz CSMCRMXTEJMECB-HZPDHXFCSA-N 1 0 290.407 3.733 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C)c(C)c1 ZINC001168988573 1129689751 /nfs/dbraw/zinc/68/97/51/1129689751.db2.gz SNPJGAULMRQIEZ-USXIJHARSA-N 1 0 290.407 3.790 20 5 CHBDRO CCCC[N@H+](Cc1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169030253 1129690848 /nfs/dbraw/zinc/69/08/48/1129690848.db2.gz XJUBTDQGFYXXBO-IRXDYDNUSA-N 1 0 290.407 3.734 20 5 CHBDRO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1(C)CCC1 ZINC000720830068 1129701005 /nfs/dbraw/zinc/70/10/05/1129701005.db2.gz PFGSXAJZBXLUNK-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C/C(=C\c1ccccc1)CN(C)Cc1cccnc1[N+](=O)[O-] ZINC001169242950 1129712334 /nfs/dbraw/zinc/71/23/34/1129712334.db2.gz DZURMRYUJCDVAW-SDNWHVSQSA-N 1 0 297.358 3.525 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@H+](CC1CC1)CC1CCC1 ZINC000796579166 1129785909 /nfs/dbraw/zinc/78/59/09/1129785909.db2.gz DDPQEZBIIYCTQC-UHFFFAOYSA-N 1 0 292.354 3.746 20 5 CHBDRO Cc1ccc(C[NH+]2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000768137333 1129834794 /nfs/dbraw/zinc/83/47/94/1129834794.db2.gz MAFCKASKHHMHPV-STQMWFEESA-N 1 0 262.353 3.666 20 5 CHBDRO C[C@]12C[C@H]1CCC[C@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000800481586 1129877463 /nfs/dbraw/zinc/87/74/63/1129877463.db2.gz AVEFZCWXGOVQHG-DFBGVHRSSA-N 1 0 294.782 3.917 20 5 CHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)C1 ZINC000801540139 1129925808 /nfs/dbraw/zinc/92/58/08/1129925808.db2.gz UWVMJOSMZRRAES-MLGOLLRUSA-N 1 0 292.354 3.746 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCC(C)(C)C1 ZINC000801554990 1129926609 /nfs/dbraw/zinc/92/66/09/1129926609.db2.gz CDCZWNROPQBTNA-GFCCVEGCSA-N 1 0 280.343 3.744 20 5 CHBDRO CC[C@H](C)C[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746671306 1129978532 /nfs/dbraw/zinc/97/85/32/1129978532.db2.gz HVDUWEYMNOHRBV-JTQLQIEISA-N 1 0 270.760 3.726 20 5 CHBDRO CNc1ccccc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000902302416 1129998705 /nfs/dbraw/zinc/99/87/05/1129998705.db2.gz VAOJKWVWCWRNQQ-CYBMUJFWSA-N 1 0 299.374 3.796 20 5 CHBDRO CCO[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000902893917 1130079685 /nfs/dbraw/zinc/07/96/85/1130079685.db2.gz FRPXFOOLEKAFMI-MGPQQGTHSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000903244731 1130135282 /nfs/dbraw/zinc/13/52/82/1130135282.db2.gz CGXNQMRFGWMRIE-CZUORRHYSA-N 1 0 299.374 3.834 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccns1)c1ccccc1[N+](=O)[O-] ZINC000903245351 1130135836 /nfs/dbraw/zinc/13/58/36/1130135836.db2.gz LFSSKINFQDVIEK-QWRGUYRKSA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000903284168 1130145770 /nfs/dbraw/zinc/14/57/70/1130145770.db2.gz PVMVCAOZIORNFV-DGCLKSJQSA-N 1 0 294.420 3.920 20 5 CHBDRO C(c1cc2cccnc2c2ncccc12)=C1CC[NH2+]CC1 ZINC001240877980 1130500024 /nfs/dbraw/zinc/50/00/24/1130500024.db2.gz CCBOYGAGMKPNBY-UHFFFAOYSA-N 1 0 275.355 3.550 20 5 CHBDRO CC1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811483963 1130611819 /nfs/dbraw/zinc/61/18/19/1130611819.db2.gz SNKPCIKIPWBFGA-UHFFFAOYSA-N 1 0 289.162 3.791 20 5 CHBDRO C[C@@H]1CC[C@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811505768 1130617601 /nfs/dbraw/zinc/61/76/01/1130617601.db2.gz HSWYTNOMLNOHPP-RDDDGLTNSA-N 1 0 289.162 3.790 20 5 CHBDRO Cc1ccc(O[C@@H](C)C[N+](C)(C)C)c(Cl)c1Cl ZINC001234928803 1130692615 /nfs/dbraw/zinc/69/26/15/1130692615.db2.gz AMWRHRURWWTQJB-JTQLQIEISA-N 1 0 277.215 3.775 20 5 CHBDRO CC1(C)CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783648584 1130844614 /nfs/dbraw/zinc/84/46/14/1130844614.db2.gz MYGMJCWYAXSUSB-NSHDSACASA-N 1 0 282.771 3.917 20 5 CHBDRO CC[N@H+](CCN)Cc1c2ccccc2cc2ccccc21 ZINC001236145333 1130875899 /nfs/dbraw/zinc/87/58/99/1130875899.db2.gz ZBEMLYVBGTZFTO-UHFFFAOYSA-N 1 0 278.399 3.774 20 5 CHBDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000815590138 1131005438 /nfs/dbraw/zinc/00/54/38/1131005438.db2.gz NAQUQHSYWKSIDC-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C/C=C/C1CC1)CCC2 ZINC001117713140 1131193921 /nfs/dbraw/zinc/19/39/21/1131193921.db2.gz NBRPOFKWFUOUIY-KZSQQDEKSA-N 1 0 272.348 3.528 20 5 CHBDRO CC(=O)c1c(O[C@H](C)C[N+](C)(C)C)ccc2ccccc21 ZINC001228253924 1131839029 /nfs/dbraw/zinc/83/90/29/1131839029.db2.gz VRGFVDMVPYNTKS-CYBMUJFWSA-N 1 0 286.395 3.516 20 5 CHBDRO CC(C)[NH+](CCCNc1ccc(F)cc1[N+](=O)[O-])C(C)C ZINC000348179976 1131899978 /nfs/dbraw/zinc/89/99/78/1131899978.db2.gz NNJRUZNIOYMZHI-UHFFFAOYSA-N 1 0 297.374 3.655 20 5 CHBDRO Cc1nc(-c2ccc(O[C@H](C)C[N+](C)(C)C)cc2)cs1 ZINC001228630954 1131924626 /nfs/dbraw/zinc/92/46/26/1131924626.db2.gz VBVAFCJIHOXRQI-GFCCVEGCSA-N 1 0 291.440 3.592 20 5 CHBDRO CC1(CO)C[NH+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000839145508 1132184697 /nfs/dbraw/zinc/18/46/97/1132184697.db2.gz MPCURFAIYXMFOL-UHFFFAOYSA-N 1 0 291.394 3.807 20 5 CHBDRO CCC1([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1 ZINC001172903825 1132346969 /nfs/dbraw/zinc/34/69/69/1132346969.db2.gz JOOWPGNDAHDBIS-OAHLLOKOSA-N 1 0 288.391 3.765 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCC1CCC1)CC2 ZINC001172902167 1132348611 /nfs/dbraw/zinc/34/86/11/1132348611.db2.gz WIWKBVVPYSBRPD-MRXNPFEDSA-N 1 0 288.391 3.622 20 5 CHBDRO CCC1([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1 ZINC001172903824 1132348707 /nfs/dbraw/zinc/34/87/07/1132348707.db2.gz JOOWPGNDAHDBIS-HNNXBMFYSA-N 1 0 288.391 3.765 20 5 CHBDRO CCC(C)(C)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172896199 1132360437 /nfs/dbraw/zinc/36/04/37/1132360437.db2.gz BLPPREYTGFLGLU-AWEZNQCLSA-N 1 0 276.380 3.620 20 5 CHBDRO CC1(C)CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172915911 1132360756 /nfs/dbraw/zinc/36/07/56/1132360756.db2.gz PNQCJTPNDNRQMD-OAHLLOKOSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@H]1CCCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909941 1132371429 /nfs/dbraw/zinc/37/14/29/1132371429.db2.gz VWLBNXCXZGKCPF-XJKSGUPXSA-N 1 0 288.391 3.717 20 5 CHBDRO CC(C)[NH+](C(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910089 1132371770 /nfs/dbraw/zinc/37/17/70/1132371770.db2.gz WVCJIQLKRROULL-INIZCTEOSA-N 1 0 290.407 3.961 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCc1ccccc1 ZINC001173217641 1132411619 /nfs/dbraw/zinc/41/16/19/1132411619.db2.gz YDKSREDJZJHEJY-OAHLLOKOSA-N 1 0 298.386 3.748 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1C[C@@H]1c1ccccc1 ZINC001173219241 1132411701 /nfs/dbraw/zinc/41/17/01/1132411701.db2.gz ZSWQWTNTKWSNAQ-XWIAVFTESA-N 1 0 296.370 3.672 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC(C)(C)C1 ZINC001173221744 1132411837 /nfs/dbraw/zinc/41/18/37/1132411837.db2.gz POZHRKSTDKHDLT-JSGCOSHPSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCC(C)(C)C1 ZINC001173226182 1132412191 /nfs/dbraw/zinc/41/21/91/1132412191.db2.gz VWVWAZNRNNIANX-HIFRSBDPSA-N 1 0 290.407 3.942 20 5 CHBDRO Cc1ccccc1C[N@@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225518 1132412610 /nfs/dbraw/zinc/41/26/10/1132412610.db2.gz CYOMSKJWNZWAHK-HNNXBMFYSA-N 1 0 298.386 3.966 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)[C@H]1C ZINC001173227900 1132412854 /nfs/dbraw/zinc/41/28/54/1132412854.db2.gz SHVXPKZHKMITSG-MGPQQGTHSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001173233717 1132413773 /nfs/dbraw/zinc/41/37/73/1132413773.db2.gz MLBDIBLCQIOCAQ-UKPHBRMFSA-N 1 0 288.391 3.790 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC1CC(F)(F)C1 ZINC001173235019 1132414361 /nfs/dbraw/zinc/41/43/61/1132414361.db2.gz VSUYXOSJUUQLQQ-LLVKDONJSA-N 1 0 298.333 3.503 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]1c1ccccc1 ZINC001173233758 1132414408 /nfs/dbraw/zinc/41/44/08/1132414408.db2.gz NETIMAOYHQFIIN-KDOFPFPSSA-N 1 0 296.370 3.973 20 5 CHBDRO Cc1cccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1C ZINC001173214231 1132416240 /nfs/dbraw/zinc/41/62/40/1132416240.db2.gz NOXLISDAUQMDPH-CQSZACIVSA-N 1 0 298.386 3.932 20 5 CHBDRO F[C@H]1CCCN(Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232221570 1132439447 /nfs/dbraw/zinc/43/94/47/1132439447.db2.gz IUDCQMPESBMDJS-HNNXBMFYSA-N 1 0 295.361 3.717 20 5 CHBDRO O=[N+]([O-])c1ccccc1Nc1cccc(C2CC[NH2+]CC2)c1 ZINC001159756917 1132903489 /nfs/dbraw/zinc/90/34/89/1132903489.db2.gz FUTYKINRGKVJDC-UHFFFAOYSA-N 1 0 297.358 3.805 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@@H+]2CCCC[C@@H]2C)c1 ZINC001162152895 1133054910 /nfs/dbraw/zinc/05/49/10/1133054910.db2.gz JKJVHHQQVCEHAL-UONOGXRCSA-N 1 0 291.395 3.578 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](C3CCC3)C2)cc1Cl ZINC001206288965 1133683649 /nfs/dbraw/zinc/68/36/49/1133683649.db2.gz YIFDPLKSFIWYQO-ZDUSSCGKSA-N 1 0 294.782 3.870 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(C)cn1)c1cccc([N+](=O)[O-])c1 ZINC000090224430 1133998278 /nfs/dbraw/zinc/99/82/78/1133998278.db2.gz ATHCPOQIXNPBTI-INIZCTEOSA-N 1 0 285.347 3.539 20 5 CHBDRO Cc1cc(Nc2cc(F)cc([N+](=O)[O-])c2)c2ccccc2[nH+]1 ZINC001216480722 1134903668 /nfs/dbraw/zinc/90/36/68/1134903668.db2.gz KNIKDVQXMFCOMH-UHFFFAOYSA-N 1 0 297.289 3.756 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2CO[C@@H]1CC[NH2+]C1 ZINC001217789832 1135001412 /nfs/dbraw/zinc/00/14/12/1135001412.db2.gz PJZBOXOSDSOQAL-MRXNPFEDSA-N 1 0 277.367 3.872 20 5 CHBDRO C[C@@H]1[NH2+]C[C@H]1OCc1c2ccccc2cc2ccccc21 ZINC001217905621 1135021537 /nfs/dbraw/zinc/02/15/37/1135021537.db2.gz AIDNLYLAJPTRBU-ORAYPTAESA-N 1 0 277.367 3.870 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@@H]3CCC[NH2+]C3)c12 ZINC001217961438 1135031589 /nfs/dbraw/zinc/03/15/89/1135031589.db2.gz BSAVFJZOWYSWLH-OAHLLOKOSA-N 1 0 278.355 3.519 20 5 CHBDRO c1ccc2c(c1)nc(O[C@@H]1CCC[NH2+]CC1)c1ccccc21 ZINC001217995391 1135038671 /nfs/dbraw/zinc/03/86/71/1135038671.db2.gz ORDJISQPCGQQIY-CQSZACIVSA-N 1 0 292.382 3.909 20 5 CHBDRO C[C@@H]1C[C@@H](Oc2cccc3cc4ccccc4nc32)C[NH2+]1 ZINC001218037584 1135048047 /nfs/dbraw/zinc/04/80/47/1135048047.db2.gz QPHASOSGUGZUEN-IUODEOHRSA-N 1 0 278.355 3.517 20 5 CHBDRO c1ccc2c(c1)nc(O[C@H]1C[C@H]3C[C@@H]1C[NH2+]3)c1ccccc21 ZINC001218142894 1135062304 /nfs/dbraw/zinc/06/23/04/1135062304.db2.gz YYLHLRSOXKACJO-VFVRVIDISA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OC1c2ccccc2-c2ccccc21 ZINC001222942776 1135287646 /nfs/dbraw/zinc/28/76/46/1135287646.db2.gz WWERONYBZVAOQQ-CQSZACIVSA-N 1 0 282.407 3.868 20 5 CHBDRO Cc1ccc2ccccc2c1CO[C@@H](C)C[N+](C)(C)C ZINC001223821932 1135388495 /nfs/dbraw/zinc/38/84/95/1135388495.db2.gz ZBYQLNRHHHOBHF-HNNXBMFYSA-N 1 0 272.412 3.760 20 5 CHBDRO C[N+](C)(C)CCCO[C@H]1Cc2cccc3cccc1c23 ZINC001224620415 1135462271 /nfs/dbraw/zinc/46/22/71/1135462271.db2.gz YQSIKHUAIHBIJU-KRWDZBQOSA-N 1 0 270.396 3.550 20 5 CHBDRO C[C@H](OCCC[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC001224860964 1135488566 /nfs/dbraw/zinc/48/85/66/1135488566.db2.gz SBFHODDNDHBLRA-AWEZNQCLSA-N 1 0 292.379 3.548 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc(Oc2ccccc2)c1 ZINC001226877128 1135753774 /nfs/dbraw/zinc/75/37/74/1135753774.db2.gz FEQFCKSZIJCDIA-OAHLLOKOSA-N 1 0 286.395 3.952 20 5 CHBDRO C[NH+]1CCC(Oc2nc3ccccc3c3ccccc32)CC1 ZINC001226992630 1135772207 /nfs/dbraw/zinc/77/22/07/1135772207.db2.gz MVXBIPFCKMMSIM-UHFFFAOYSA-N 1 0 292.382 3.861 20 5 CHBDRO CCCCCc1cc(O)cc(O[C@H](C)C[N+](C)(C)C)c1 ZINC001227190880 1135797955 /nfs/dbraw/zinc/79/79/55/1135797955.db2.gz RHMWLSBDLCDIJV-CQSZACIVSA-O 1 0 280.432 3.598 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc2ccccc2c1N=O ZINC001227469120 1135837972 /nfs/dbraw/zinc/83/79/72/1135837972.db2.gz RFVWRIDKNFVHAC-LBPRGKRZSA-N 1 0 273.356 3.711 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccccc1-c1ccccc1 ZINC001227472808 1135838221 /nfs/dbraw/zinc/83/82/21/1135838221.db2.gz OXFNXKOIKJDSDY-HNNXBMFYSA-N 1 0 270.396 3.827 20 5 CHBDRO CC[C@H]([NH2+]C1CCC(OC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000346445610 529584341 /nfs/dbraw/zinc/58/43/41/529584341.db2.gz YXOCGEWSTWRCDC-BCLQGDPASA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc(C[C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)s1 ZINC000080243044 260179864 /nfs/dbraw/zinc/17/98/64/260179864.db2.gz NTNSAWBGLWHKKD-VIFPVBQESA-N 1 0 296.417 3.747 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 ZINC000020148040 171035558 /nfs/dbraw/zinc/03/55/58/171035558.db2.gz NHJATELYCNLMDB-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000035737037 172390511 /nfs/dbraw/zinc/39/05/11/172390511.db2.gz PBCQXXIEFRUGTJ-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO CCC(CC)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000036882951 172778818 /nfs/dbraw/zinc/77/88/18/172778818.db2.gz OXKRTUWZRZAGKR-AWEZNQCLSA-N 1 0 250.342 3.824 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000037176958 173010912 /nfs/dbraw/zinc/01/09/12/173010912.db2.gz IHKCDQQEGUEWQI-SLEUVZQESA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)CCc1ccco1 ZINC000349978481 226904736 /nfs/dbraw/zinc/90/47/36/226904736.db2.gz UPKKIYDDIGAEHM-CYBMUJFWSA-N 1 0 288.347 3.607 20 5 CHBDRO Cc1sccc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000353452590 228105174 /nfs/dbraw/zinc/10/51/74/228105174.db2.gz CMXNUBLPQSVLEU-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO Cc1cncc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000184305463 262015739 /nfs/dbraw/zinc/01/57/39/262015739.db2.gz PBCBGUAXVVCABY-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525786410 262236348 /nfs/dbraw/zinc/23/63/48/262236348.db2.gz FTWMCLALEGCUAT-IPYPFGDCSA-N 1 0 274.364 3.748 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000186742127 262322861 /nfs/dbraw/zinc/32/28/61/262322861.db2.gz FIMHQRCZQRHDGP-MNOVXSKESA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCCC1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000390918398 262363920 /nfs/dbraw/zinc/36/39/20/262363920.db2.gz VNHHESCJCPAVEP-ZYHUDNBSSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000094423904 262369562 /nfs/dbraw/zinc/36/95/62/262369562.db2.gz RYCJRMISXBOMPG-RISCZKNCSA-N 1 0 292.379 3.592 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000094423901 262369625 /nfs/dbraw/zinc/36/96/25/262369625.db2.gz RYCJRMISXBOMPG-SMDDNHRTSA-N 1 0 292.379 3.592 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2)cccc1[N+](=O)[O-] ZINC000414146329 262810127 /nfs/dbraw/zinc/81/01/27/262810127.db2.gz PCENZJJHSYLPEJ-MCIONIFRSA-N 1 0 292.379 3.510 20 5 CHBDRO Cc1ccc(CNc2ccc([C@@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000414812879 263053323 /nfs/dbraw/zinc/05/33/23/263053323.db2.gz PYMSVOAEGJYWGZ-GFCCVEGCSA-N 1 0 285.347 3.535 20 5 CHBDRO C[C@@H]([NH2+][C@H]1COCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000417407318 264224434 /nfs/dbraw/zinc/22/44/34/264224434.db2.gz SIIMDTXZRCDQDQ-PXAZEXFGSA-N 1 0 298.342 3.517 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)[C@H]1CCCO1 ZINC000090857346 264411997 /nfs/dbraw/zinc/41/19/97/264411997.db2.gz JRXXUNLBKFLGOD-DUVNUKRYSA-N 1 0 292.379 3.511 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000094279280 265232520 /nfs/dbraw/zinc/23/25/20/265232520.db2.gz ODPHHACLZIVXNF-AWEZNQCLSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCCC2(C)C)cccc1[N+](=O)[O-] ZINC000094324518 265237352 /nfs/dbraw/zinc/23/73/52/265237352.db2.gz YCENMUSJXRFFBL-CQSZACIVSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000359541041 266599147 /nfs/dbraw/zinc/59/91/47/266599147.db2.gz CYVQNYJDXHYYAS-WBMJQRKESA-N 1 0 292.354 3.746 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C1CCC(F)(F)CC1 ZINC000580215790 327736233 /nfs/dbraw/zinc/73/62/33/327736233.db2.gz DOGFWMPJKHNLLG-ZDUSSCGKSA-N 1 0 296.317 3.750 20 5 CHBDRO COC[C@H](CC(C)C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000540222021 327837523 /nfs/dbraw/zinc/83/75/23/327837523.db2.gz LUGLCZNKRKJSRY-HIFRSBDPSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000062726457 327894540 /nfs/dbraw/zinc/89/45/40/327894540.db2.gz ACXHJVBLHKQHHU-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO C[C@@H]1CCC[C@@](CNc2ccc([N+](=O)[O-])cc2)([NH+](C)C)C1 ZINC000040670113 328015270 /nfs/dbraw/zinc/01/52/70/328015270.db2.gz IFJDXORXWCNCBL-CZUORRHYSA-N 1 0 291.395 3.517 20 5 CHBDRO CCCC[C@@H](CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000069376874 328040071 /nfs/dbraw/zinc/04/00/71/328040071.db2.gz ILLUXTVUJSRJFH-CYBMUJFWSA-N 1 0 250.342 3.653 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccncc1 ZINC000563419480 328063562 /nfs/dbraw/zinc/06/35/62/328063562.db2.gz WRAZVCBAYIDEKZ-HZPDHXFCSA-N 1 0 297.358 3.718 20 5 CHBDRO CCOc1cc(C[N@H+](C)[C@@H](C)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000571398740 328118914 /nfs/dbraw/zinc/11/89/14/328118914.db2.gz UVGVHONTXVWGKN-LBPRGKRZSA-N 1 0 294.395 3.860 20 5 CHBDRO CC(C)c1ccc(C[NH2+]Cc2ccoc2)cc1[N+](=O)[O-] ZINC000069833091 328295239 /nfs/dbraw/zinc/29/52/39/328295239.db2.gz UZRBLLZVZBPLPX-UHFFFAOYSA-N 1 0 274.320 3.601 20 5 CHBDRO COc1ccc(C[NH2+][C@@H](C)CCCC(C)C)cc1[N+](=O)[O-] ZINC000049130510 328341642 /nfs/dbraw/zinc/34/16/42/328341642.db2.gz ALFAZKPQTLKWRE-ZDUSSCGKSA-N 1 0 294.395 3.908 20 5 CHBDRO COc1ccc(C[NH2+][C@H](C)CCCC(C)C)cc1[N+](=O)[O-] ZINC000049130507 328341682 /nfs/dbraw/zinc/34/16/82/328341682.db2.gz ALFAZKPQTLKWRE-CYBMUJFWSA-N 1 0 294.395 3.908 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccsc2)cc1[N+](=O)[O-] ZINC000049153212 328349852 /nfs/dbraw/zinc/34/98/52/328349852.db2.gz WACIXUMIMZIHKA-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO CCCC[C@@H](COC)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000531969183 328356303 /nfs/dbraw/zinc/35/63/03/328356303.db2.gz RNXSVWLPUKXDIB-HIFRSBDPSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303681235 328357605 /nfs/dbraw/zinc/35/76/05/328357605.db2.gz JCMLRCIOENVNIA-FRFSOERESA-N 1 0 288.391 3.790 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC2(C1)CCCCC2 ZINC000303861670 328361908 /nfs/dbraw/zinc/36/19/08/328361908.db2.gz GPMRYYNOCZTCJC-UHFFFAOYSA-N 1 0 274.364 3.751 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000049505921 328366379 /nfs/dbraw/zinc/36/63/79/328366379.db2.gz MWROBOZNKXCPLH-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CC=CCC2)c(Cl)c1 ZINC000049963837 328380015 /nfs/dbraw/zinc/38/00/15/328380015.db2.gz FPLNSUYEBJPYCT-NSHDSACASA-N 1 0 280.755 3.694 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCCC1(F)F ZINC000583510701 328589420 /nfs/dbraw/zinc/58/94/20/328589420.db2.gz ZXNYAOHOTNTMRT-ZWNOBZJWSA-N 1 0 296.317 3.607 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000037770944 326861261 /nfs/dbraw/zinc/86/12/61/326861261.db2.gz JGFWULIGRZJXQI-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]3C[C@H]32)cc1[N+](=O)[O-] ZINC000558699787 327115669 /nfs/dbraw/zinc/11/56/69/327115669.db2.gz QZAOTOJYNAISNL-SPWCGHHHSA-N 1 0 274.364 3.742 20 5 CHBDRO C[C@H](C[NH+]1CCCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000047873375 327216283 /nfs/dbraw/zinc/21/62/83/327216283.db2.gz FPQNLCHOVNYDRS-LLVKDONJSA-N 1 0 297.786 3.535 20 5 CHBDRO CCC1(C)CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000507202581 332795515 /nfs/dbraw/zinc/79/55/15/332795515.db2.gz GZWOGYOUOFORFS-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO CC1(C)CCC[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000389048800 328607792 /nfs/dbraw/zinc/60/77/92/328607792.db2.gz RPTIELWZHZFNNW-CYBMUJFWSA-N 1 0 262.353 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCCCC1 ZINC000532442610 328778418 /nfs/dbraw/zinc/77/84/18/328778418.db2.gz VDYHROFHSLFYAQ-GFCCVEGCSA-N 1 0 262.353 3.887 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C2CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000583095271 329315351 /nfs/dbraw/zinc/31/53/51/329315351.db2.gz DBDHRWBYGZQEQS-LLVKDONJSA-N 1 0 262.353 3.742 20 5 CHBDRO CC(C)CSCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000397342697 329350760 /nfs/dbraw/zinc/35/07/60/329350760.db2.gz WJMLYFHFESLUKL-LBPRGKRZSA-N 1 0 282.409 3.635 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000222134122 329944678 /nfs/dbraw/zinc/94/46/78/329944678.db2.gz ABDJWBOIZOIYLX-TZMCWYRMSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H]([NH2+]CC1=CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000379588859 330137865 /nfs/dbraw/zinc/13/78/65/330137865.db2.gz PUUMICBBSRHPPV-LBPRGKRZSA-N 1 0 260.337 3.746 20 5 CHBDRO Cc1cc(N)cc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000423478742 330205856 /nfs/dbraw/zinc/20/58/56/330205856.db2.gz LGAHYSFJPRLWAM-CYBMUJFWSA-N 1 0 299.374 3.645 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000035648898 330248392 /nfs/dbraw/zinc/24/83/92/330248392.db2.gz RVMFIRVDLFDEDV-SMDDNHRTSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC1(C)C ZINC000536866041 330251628 /nfs/dbraw/zinc/25/16/28/330251628.db2.gz XLVAVVAGRBKPRM-GXTWGEPZSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000536879203 330315446 /nfs/dbraw/zinc/31/54/46/330315446.db2.gz UCEIQTZOQXDJLO-QANKJYHBSA-N 1 0 296.370 3.877 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000424329020 330341838 /nfs/dbraw/zinc/34/18/38/330341838.db2.gz RMPZDDSZRXPRIF-KGLIPLIRSA-N 1 0 260.337 3.578 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC12CC2 ZINC000424332530 330342620 /nfs/dbraw/zinc/34/26/20/330342620.db2.gz WTLGBFBTRCNERC-RISCZKNCSA-N 1 0 292.404 3.608 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C[C@@H]1C ZINC000085042369 330364182 /nfs/dbraw/zinc/36/41/82/330364182.db2.gz XYATZFKNFFDMML-SCVCMEIPSA-N 1 0 268.382 3.571 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](C2CC2)C2CCCC2)cc1 ZINC000057619649 330377039 /nfs/dbraw/zinc/37/70/39/330377039.db2.gz BQBIEXTYRABUPS-UHFFFAOYSA-N 1 0 260.337 3.502 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000157910096 330809954 /nfs/dbraw/zinc/80/99/54/330809954.db2.gz KBKUAFKMCWRWPZ-KOLCDFICSA-N 1 0 268.744 3.526 20 5 CHBDRO CC(C)=CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447596110 330872687 /nfs/dbraw/zinc/87/26/87/330872687.db2.gz BIFGEDBMGXMXIC-MRXNPFEDSA-N 1 0 274.364 3.918 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCC2 ZINC000194619725 330945173 /nfs/dbraw/zinc/94/51/73/330945173.db2.gz BHSOTQNYNGSFLE-ZDUSSCGKSA-N 1 0 296.370 3.934 20 5 CHBDRO CC[C@@H](F)C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543736 331033410 /nfs/dbraw/zinc/03/34/10/331033410.db2.gz CJRZNEFMMCGMPM-UONOGXRCSA-N 1 0 280.343 3.522 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H]1C(C)C ZINC000470175502 331044197 /nfs/dbraw/zinc/04/41/97/331044197.db2.gz ZBZHAUSLVKYSCM-OVHOFWQVSA-N 1 0 274.364 3.728 20 5 CHBDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000452029609 331051142 /nfs/dbraw/zinc/05/11/42/331051142.db2.gz DNENUZDUTUCBEI-APHBMKBZSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+]C1CC(C)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000453253505 331107975 /nfs/dbraw/zinc/10/79/75/331107975.db2.gz PWXDWSIXCDEEMQ-QRMWWUJWSA-N 1 0 266.316 3.526 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2CCCC2(F)F)cccc1[N+](=O)[O-] ZINC000453326680 331117175 /nfs/dbraw/zinc/11/71/75/331117175.db2.gz YNUPGCPAFOSPBI-NEPJUHHUSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cn1 ZINC000453379461 331125615 /nfs/dbraw/zinc/12/56/15/331125615.db2.gz WISRYOJHIOXXIF-AWEZNQCLSA-N 1 0 299.374 3.766 20 5 CHBDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453419530 331130457 /nfs/dbraw/zinc/13/04/57/331130457.db2.gz VPUPBTFZIDJESR-XNRPHZJLSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)c(Cl)c1 ZINC000459753166 331298427 /nfs/dbraw/zinc/29/84/27/331298427.db2.gz IUHSJERABASPOV-LQJRIPTKSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459753338 331298530 /nfs/dbraw/zinc/29/85/30/331298530.db2.gz IXUAMFVRXHDKKV-OJLVUWQFSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@]1([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC=CCC1 ZINC000459753288 331298555 /nfs/dbraw/zinc/29/85/55/331298555.db2.gz LXSLCQGRPOPVFL-DZFYGRHCSA-N 1 0 272.348 3.696 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC000463363031 331346711 /nfs/dbraw/zinc/34/67/11/331346711.db2.gz YGFDSMLRZCWGGD-UHFFFAOYSA-N 1 0 264.369 3.505 20 5 CHBDRO C[C@@H]1CC[C@@H](C)[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000464822212 331369842 /nfs/dbraw/zinc/36/98/42/331369842.db2.gz KXGIUFYLDKHJPN-GHMZBOCLSA-N 1 0 282.771 3.869 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCCCC1 ZINC000468634582 331437923 /nfs/dbraw/zinc/43/79/23/331437923.db2.gz GCGSGYFZPMRWIZ-JLHYYAGUSA-N 1 0 274.364 3.920 20 5 CHBDRO CC(C)=CCC[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000480310300 331767740 /nfs/dbraw/zinc/76/77/40/331767740.db2.gz VPSKADQXURUUMS-UVTDQMKNSA-N 1 0 274.364 3.944 20 5 CHBDRO Cc1c(C[NH2+]C[C@H]2C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000480489774 331774242 /nfs/dbraw/zinc/77/42/42/331774242.db2.gz XFMPPYVZRNSNNJ-SJORKVTESA-N 1 0 296.370 3.797 20 5 CHBDRO COc1cc(C[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000481171559 331799678 /nfs/dbraw/zinc/79/96/78/331799678.db2.gz FHYKBECNDNCWBU-YRGRVCCFSA-N 1 0 292.379 3.518 20 5 CHBDRO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000482516681 331836437 /nfs/dbraw/zinc/83/64/37/331836437.db2.gz CDFSRLZLYZUENF-ACJLOTCBSA-N 1 0 296.370 3.660 20 5 CHBDRO C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000482516683 331836444 /nfs/dbraw/zinc/83/64/44/331836444.db2.gz CDFSRLZLYZUENF-SCLBCKFNSA-N 1 0 296.370 3.660 20 5 CHBDRO CC[C@H](C)C[N@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489228743 332043756 /nfs/dbraw/zinc/04/37/56/332043756.db2.gz XAWCAEGLPCFWAU-AAEUAGOBSA-N 1 0 264.369 3.942 20 5 CHBDRO CC(C)([NH2+]C/C=C/c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000492151104 332384702 /nfs/dbraw/zinc/38/47/02/332384702.db2.gz LOBBDRXREIGDEK-AATRIKPKSA-N 1 0 297.358 3.528 20 5 CHBDRO CCC[NH+](CCC)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494179002 332465632 /nfs/dbraw/zinc/46/56/32/332465632.db2.gz JFVUMLILISZBQY-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1OC)c1cccc([N+](=O)[O-])c1 ZINC000494512372 332476724 /nfs/dbraw/zinc/47/67/24/332476724.db2.gz QTCZFIJGEMDGEB-BZUAXINKSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000495369147 332515899 /nfs/dbraw/zinc/51/58/99/332515899.db2.gz OJHPLUDDURPALI-ZDUSSCGKSA-N 1 0 284.787 3.815 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000252032056 334373281 /nfs/dbraw/zinc/37/32/81/334373281.db2.gz ZLBDWOJQOKPNKC-SDDRHHMPSA-N 1 0 250.342 3.680 20 5 CHBDRO CCCC(O)(CCC)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173431389 332971440 /nfs/dbraw/zinc/97/14/40/332971440.db2.gz YFFVVHIHKBVDIV-ZDUSSCGKSA-N 1 0 294.395 3.577 20 5 CHBDRO COc1ccc(C[N@@H+]2CCC[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000513753312 333037564 /nfs/dbraw/zinc/03/75/64/333037564.db2.gz BYDVEHBZTXCMTC-OAHLLOKOSA-N 1 0 292.379 3.614 20 5 CHBDRO CC1([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCCCC1 ZINC000311402598 333067968 /nfs/dbraw/zinc/06/79/68/333067968.db2.gz GKCCUYAVDCIDOS-UHFFFAOYSA-N 1 0 266.316 3.546 20 5 CHBDRO Cc1ccc2oc(C[NH2+]Cc3cccc([N+](=O)[O-])c3)cc2c1 ZINC000575824243 335119589 /nfs/dbraw/zinc/11/95/89/335119589.db2.gz MJZWXLIIWVUIHL-UHFFFAOYSA-N 1 0 296.326 3.939 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1(C3CC3)CC1)CCC2 ZINC000516860821 333084404 /nfs/dbraw/zinc/08/44/04/333084404.db2.gz OCOMEYYZEDVRMT-HNNXBMFYSA-N 1 0 272.348 3.504 20 5 CHBDRO C[C@@H]([NH2+][C@H]1COCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000336862411 335121836 /nfs/dbraw/zinc/12/18/36/335121836.db2.gz IWZKCLRGTPLMIB-PXAZEXFGSA-N 1 0 298.342 3.517 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000189086204 333180614 /nfs/dbraw/zinc/18/06/14/333180614.db2.gz YVSVPPZFWXMSLK-DOMZBBRYSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000222504541 333194961 /nfs/dbraw/zinc/19/49/61/333194961.db2.gz WLQSPYDBGBTBQX-UPJWGTAASA-N 1 0 262.353 3.824 20 5 CHBDRO C[N@H+](Cc1cc2ccccc2o1)Cc1cccc([N+](=O)[O-])c1 ZINC000195676030 333260427 /nfs/dbraw/zinc/26/04/27/333260427.db2.gz LGRPERCSJLELFY-UHFFFAOYSA-N 1 0 296.326 3.973 20 5 CHBDRO CCc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000227771586 333288232 /nfs/dbraw/zinc/28/82/32/333288232.db2.gz BLPYEBADQZAVHH-UHFFFAOYSA-N 1 0 284.359 3.755 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000230409369 333317988 /nfs/dbraw/zinc/31/79/88/333317988.db2.gz YYWXVBBEJXWATM-AGIUHOORSA-N 1 0 262.353 3.682 20 5 CHBDRO Cc1c(C[NH2+]Cc2cc(Cl)cs2)cccc1[N+](=O)[O-] ZINC000231884205 333331050 /nfs/dbraw/zinc/33/10/50/333331050.db2.gz UVNMQFHJNPKPQY-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1C(C)C ZINC000303695039 333345464 /nfs/dbraw/zinc/34/54/64/333345464.db2.gz QMRDZEVTDXWACF-OAHLLOKOSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H](CCc1ccccc1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000237336845 333378942 /nfs/dbraw/zinc/37/89/42/333378942.db2.gz ZVJIGRKKZPSINF-HNNXBMFYSA-N 1 0 298.386 3.748 20 5 CHBDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000524811128 333389027 /nfs/dbraw/zinc/38/90/27/333389027.db2.gz AHTCGYFVQFODLB-BBRMVZONSA-N 1 0 276.380 3.995 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CSC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000338776873 335138411 /nfs/dbraw/zinc/13/84/11/335138411.db2.gz VUDBJZKDHYECDG-UONOGXRCSA-N 1 0 294.420 3.920 20 5 CHBDRO C[C@@H](CCC1CC1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000398025226 333431434 /nfs/dbraw/zinc/43/14/34/333431434.db2.gz ADTGUCCTUYIIHB-JTQLQIEISA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000538280499 333582612 /nfs/dbraw/zinc/58/26/12/333582612.db2.gz SYYQYGCTRRPGMV-ZJUUUORDSA-N 1 0 290.285 3.752 20 5 CHBDRO C[C@H]([NH2+]CCCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000539067881 333654750 /nfs/dbraw/zinc/65/47/50/333654750.db2.gz WZINAWYOIOZBFG-LBPRGKRZSA-N 1 0 290.388 3.940 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000540162604 333716028 /nfs/dbraw/zinc/71/60/28/333716028.db2.gz LFDPBBHKLBANKW-CMPLNLGQSA-N 1 0 284.306 3.823 20 5 CHBDRO C[C@H]([NH2+]CCCc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000541205732 333765165 /nfs/dbraw/zinc/76/51/65/333765165.db2.gz OIOCKTCZWVSDQT-LBPRGKRZSA-N 1 0 290.388 3.940 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H]1C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000129670333 333786616 /nfs/dbraw/zinc/78/66/16/333786616.db2.gz WYLOAOIMPLLMTD-LNSITVRQSA-N 1 0 262.353 3.682 20 5 CHBDRO CCC(CC)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000130711803 333868429 /nfs/dbraw/zinc/86/84/29/333868429.db2.gz PYFZMSYTRXMRQS-LLVKDONJSA-N 1 0 250.342 3.682 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000546650151 334043515 /nfs/dbraw/zinc/04/35/15/334043515.db2.gz FAXWGAHRKUAHBN-CHWSQXEVSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000546650153 334043564 /nfs/dbraw/zinc/04/35/64/334043564.db2.gz FAXWGAHRKUAHBN-QWHCGFSZSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1Cc2ccccc2C1 ZINC000547278795 334075590 /nfs/dbraw/zinc/07/55/90/334075590.db2.gz CUTROOOWGABSCB-ZDUSSCGKSA-N 1 0 296.370 3.721 20 5 CHBDRO C/C(=C\c1ccccc1)C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000547739323 334113699 /nfs/dbraw/zinc/11/36/99/334113699.db2.gz GTKIEAKGKNWOMG-FYWRMAATSA-N 1 0 296.370 3.830 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000548066853 334138028 /nfs/dbraw/zinc/13/80/28/334138028.db2.gz KWKWOLBEQPVDRJ-SFHVURJKSA-N 1 0 296.370 3.878 20 5 CHBDRO C[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000081574988 334197621 /nfs/dbraw/zinc/19/76/21/334197621.db2.gz IXUVUQQYJLEODE-DYVFJYSZSA-N 1 0 282.343 3.788 20 5 CHBDRO CCOCC(C)(C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000550257354 334217736 /nfs/dbraw/zinc/21/77/36/334217736.db2.gz YHFPOSXFEJKJGY-UHFFFAOYSA-N 1 0 294.395 3.623 20 5 CHBDRO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCC[C@@H]21 ZINC000550444432 334222591 /nfs/dbraw/zinc/22/25/91/334222591.db2.gz VKFSCVIINCJXFI-LSDHHAIUSA-N 1 0 274.364 3.605 20 5 CHBDRO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCC[C@@H]21 ZINC000550444430 334222794 /nfs/dbraw/zinc/22/27/94/334222794.db2.gz VKFSCVIINCJXFI-GJZGRUSLSA-N 1 0 274.364 3.605 20 5 CHBDRO C[N@@H+]1CCCC[C@@H]1CCSCc1ccc([N+](=O)[O-])cc1 ZINC000551460864 334250983 /nfs/dbraw/zinc/25/09/83/334250983.db2.gz ALMCSGRFTNWNQF-CQSZACIVSA-N 1 0 294.420 3.702 20 5 CHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CCCCCC1 ZINC000248022578 334293411 /nfs/dbraw/zinc/29/34/11/334293411.db2.gz FSVPXXDEMZELCU-UHFFFAOYSA-N 1 0 262.353 3.749 20 5 CHBDRO CCC[C@H]([NH2+][C@H](COC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000086695566 334315165 /nfs/dbraw/zinc/31/51/65/334315165.db2.gz OMCBUVRUDJFGHL-JKSUJKDBSA-N 1 0 294.395 3.697 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000251855979 334370952 /nfs/dbraw/zinc/37/09/52/334370952.db2.gz NSSYBWRYOPKLFK-CYZMBNFOSA-N 1 0 264.369 3.988 20 5 CHBDRO CC[C@@H]1CC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000554108438 334412646 /nfs/dbraw/zinc/41/26/46/334412646.db2.gz FAKBHJSPWUMVMS-ZBFHGGJFSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])s1 ZINC000565219476 334545815 /nfs/dbraw/zinc/54/58/15/334545815.db2.gz VYYKVAVXYWOHSF-AWEZNQCLSA-N 1 0 288.372 3.742 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000575010872 334825860 /nfs/dbraw/zinc/82/58/60/334825860.db2.gz DXGKCDLXVHPPNF-AAEUAGOBSA-N 1 0 292.379 3.690 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000576392588 335197779 /nfs/dbraw/zinc/19/77/79/335197779.db2.gz SCUTUDVEYGPBDG-GPCFVJJQSA-N 1 0 298.386 3.873 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000578012738 335459610 /nfs/dbraw/zinc/45/96/10/335459610.db2.gz WTJLDCBQLNJBOB-GUTXKFCHSA-N 1 0 280.343 3.916 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)[C@H]1CCCO1 ZINC000181739785 335781866 /nfs/dbraw/zinc/78/18/66/335781866.db2.gz MASNXKNYJDSSEK-VBNZEHGJSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c(C[NH2+]C(C2CCC2)C2CCC2)cccc1[N+](=O)[O-] ZINC000385102108 336138019 /nfs/dbraw/zinc/13/80/19/336138019.db2.gz QCDQWAOVEIKZEH-UHFFFAOYSA-N 1 0 288.391 3.962 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC(C)C ZINC000468639676 517307384 /nfs/dbraw/zinc/30/73/84/517307384.db2.gz GKIOKKXMGLZNID-UKTHLTGXSA-N 1 0 262.353 3.634 20 5 CHBDRO CCC1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000510666390 517547978 /nfs/dbraw/zinc/54/79/78/517547978.db2.gz SWVWVKMXNHTBQK-ALCCZGGFSA-N 1 0 274.364 3.730 20 5 CHBDRO CCC[C@H]([NH2+]CC(C)(C)OCC)c1cccc([N+](=O)[O-])c1 ZINC000159271476 521157586 /nfs/dbraw/zinc/15/75/86/521157586.db2.gz JILGOSIWSNZZSD-HNNXBMFYSA-N 1 0 294.395 3.841 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000037010521 522741564 /nfs/dbraw/zinc/74/15/64/522741564.db2.gz SZQFSBDJBGAIMO-WBMJQRKESA-N 1 0 285.347 3.792 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cnc(C)s1)c1cccc([N+](=O)[O-])c1 ZINC000040997588 522888342 /nfs/dbraw/zinc/88/83/42/522888342.db2.gz XUJFVGKENVWHLF-CQSZACIVSA-N 1 0 291.376 3.601 20 5 CHBDRO CC[C@@H]([NH2+]Cc1scnc1C)c1cccc([N+](=O)[O-])c1 ZINC000071212546 522899606 /nfs/dbraw/zinc/89/96/06/522899606.db2.gz NEVHMALHUMJJMO-CYBMUJFWSA-N 1 0 291.376 3.601 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094773539 525359496 /nfs/dbraw/zinc/35/94/96/525359496.db2.gz VUMPHADJTULRQL-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cs1 ZINC000294304331 525469422 /nfs/dbraw/zinc/46/94/22/525469422.db2.gz VJRWSACCUCAAGG-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000054080635 525655218 /nfs/dbraw/zinc/65/52/18/525655218.db2.gz QVLCLRNKQWUJDU-VXGBXAGGSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccsc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000070091560 525868519 /nfs/dbraw/zinc/86/85/19/525868519.db2.gz ROCCLBJIIDCAMP-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+](C2CCC2)C2CCC2)cc1F ZINC000292487527 527347061 /nfs/dbraw/zinc/34/70/61/527347061.db2.gz SQZOUKSJYIIKGS-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO CCS[C@@H]1CCCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000353584529 529206655 /nfs/dbraw/zinc/20/66/55/529206655.db2.gz HTZWLYKVTRUXNW-CQSZACIVSA-N 1 0 294.420 3.702 20 5 CHBDRO Cc1ccc(C[N@H+](C)CC2CCCC2)cc1[N+](=O)[O-] ZINC000512679058 1121525397 /nfs/dbraw/zinc/52/53/97/1121525397.db2.gz UTLDDFGAXSMMIR-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000088507306 1124061727 /nfs/dbraw/zinc/06/17/27/1124061727.db2.gz HKYHIRVTPWDDHJ-DOMZBBRYSA-N 1 0 262.353 3.653 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@@H](C)F ZINC000872074032 1124675563 /nfs/dbraw/zinc/67/55/63/1124675563.db2.gz VAJKNNFYKAUTRW-NXEZZACHSA-N 1 0 286.372 3.715 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449183021 1124666031 /nfs/dbraw/zinc/66/60/31/1124666031.db2.gz CLFOXTYEZADGTC-OLZOCXBDSA-N 1 0 264.369 3.550 20 5 CHBDRO Cc1ccc(Cl)cc1[C@H](C)OCCC[N+](C)(C)C ZINC001224622562 1135462527 /nfs/dbraw/zinc/46/25/27/1135462527.db2.gz IEFRXXYKVFNRRX-ZDUSSCGKSA-N 1 0 270.824 3.822 20 5 CHBDRO Cc1ccc(C[N@H+](C2CC2)C2CCCC2)cc1[N+](=O)[O-] ZINC000536632155 1125537474 /nfs/dbraw/zinc/53/74/74/1125537474.db2.gz SJCMBENSYQSVNN-UHFFFAOYSA-N 1 0 274.364 3.810 20 5 CHBDRO Cc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1F ZINC000296389251 1125579882 /nfs/dbraw/zinc/57/98/82/1125579882.db2.gz KWSBRENCMGVRSJ-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC(C)CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CC1 ZINC000135333379 1125586741 /nfs/dbraw/zinc/58/67/41/1125586741.db2.gz WSRROYQRUQVDCO-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000216462034 1125595458 /nfs/dbraw/zinc/59/54/58/1125595458.db2.gz NYOKDCVPJDXYHB-TYNCELHUSA-N 1 0 292.379 3.518 20 5 CHBDRO CC1(C)CCC[C@H](C[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001649171967 1125623134 /nfs/dbraw/zinc/62/31/34/1125623134.db2.gz ZBYOAHOTDHZQJM-HNNXBMFYSA-N 1 0 290.407 3.943 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2ccccc2)CCC1 ZINC000064343702 1125631620 /nfs/dbraw/zinc/63/16/20/1125631620.db2.gz GPIKFXNDFISYNJ-UHFFFAOYSA-N 1 0 282.343 3.764 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1(C2CC2)CCC1 ZINC000886392077 1125676797 /nfs/dbraw/zinc/67/67/97/1125676797.db2.gz SKQPJCKSIFSIBP-ZZXKWVIFSA-N 1 0 272.348 3.530 20 5 CHBDRO CO[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000886512980 1125683100 /nfs/dbraw/zinc/68/31/00/1125683100.db2.gz QXLNFGXRBWKJSQ-DUVNUKRYSA-N 1 0 292.379 3.593 20 5 CHBDRO CO[C@H]1CCC[C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000886650163 1125702714 /nfs/dbraw/zinc/70/27/14/1125702714.db2.gz QRWVRCZBWNDYOC-IHRRRGAJSA-N 1 0 292.379 3.593 20 5 CHBDRO CO[C@H]1CCC[C@@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000886650164 1125703095 /nfs/dbraw/zinc/70/30/95/1125703095.db2.gz QRWVRCZBWNDYOC-MCIONIFRSA-N 1 0 292.379 3.593 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCC(C)(C)C1 ZINC000483108913 1126768250 /nfs/dbraw/zinc/76/82/50/1126768250.db2.gz ILGIHGCAXVMOJJ-CQSZACIVSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1c(C[N@H+](CC2CC2)C2CCC2)cccc1[N+](=O)[O-] ZINC000483308704 1126780666 /nfs/dbraw/zinc/78/06/66/1126780666.db2.gz ZNVFQVBIGLFMMQ-UHFFFAOYSA-N 1 0 274.364 3.668 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1ccns1)c1ccccc1[N+](=O)[O-] ZINC000903245352 1126798244 /nfs/dbraw/zinc/79/82/44/1126798244.db2.gz LFSSKINFQDVIEK-WDEREUQCSA-N 1 0 291.376 3.506 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000036721122 1126798888 /nfs/dbraw/zinc/79/88/88/1126798888.db2.gz WAPWTQJKPZLZHW-MLGOLLRUSA-N 1 0 285.347 3.792 20 5 CHBDRO CCCCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000484089528 1126810650 /nfs/dbraw/zinc/81/06/50/1126810650.db2.gz ZYNCGKGZWSCZMZ-UHFFFAOYSA-N 1 0 262.353 3.749 20 5 CHBDRO CC[C@H](C)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037173075 1126922551 /nfs/dbraw/zinc/92/25/51/1126922551.db2.gz AOPWGAMCQLBOTG-JTQLQIEISA-N 1 0 270.760 3.726 20 5 CHBDRO COc1cc(C[N@H+](C)CC2CCCCC2)ccc1[N+](=O)[O-] ZINC000485746882 1126950252 /nfs/dbraw/zinc/95/02/52/1126950252.db2.gz TZHGHNMTOQPEQB-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO C[C@@H]1CCCC[C@H]1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000042861625 1127080741 /nfs/dbraw/zinc/08/07/41/1127080741.db2.gz JEMHWUYXRLTGOL-HIFRSBDPSA-N 1 0 276.380 3.553 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2c3ccccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000111410775 1127126210 /nfs/dbraw/zinc/12/62/10/1127126210.db2.gz JQAZSFGBUJZAKC-ACJLOTCBSA-N 1 0 296.370 3.926 20 5 CHBDRO CC1(C)C[C@@H]([NH2+][C@@H]2C[C@H]3C[C@H]3C2)c2cc([N+](=O)[O-])ccc21 ZINC000571038895 1127153006 /nfs/dbraw/zinc/15/30/06/1127153006.db2.gz OOCHJGBCOBFKSU-AZKPJATDSA-N 1 0 286.375 3.705 20 5 CHBDRO CCC[C@@H](N[C@@H](C)c1ccon1)c1cccc([N+](=O)[O-])c1 ZINC000349832916 1127163538 /nfs/dbraw/zinc/16/35/38/1127163538.db2.gz KDNURFWQJZHECT-XHDPSFHLSA-N 1 0 289.335 3.775 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)C[C@@H]1CCCO1 ZINC000156751983 1127179412 /nfs/dbraw/zinc/17/94/12/1127179412.db2.gz JVUCJRMLDHBAOE-YDHLFZDLSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@@H]1CC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000588230224 1127182155 /nfs/dbraw/zinc/18/21/55/1127182155.db2.gz JFQMPYZVKQLUPR-ZWNOBZJWSA-N 1 0 282.771 3.569 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCSC(C)C ZINC000588926832 1127207640 /nfs/dbraw/zinc/20/76/40/1127207640.db2.gz FQNHJMMYPUDIRI-LCYFTJDESA-N 1 0 294.420 3.729 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000588977947 1127209089 /nfs/dbraw/zinc/20/90/89/1127209089.db2.gz DZMAALWBHWEIQM-OCCSQVGLSA-N 1 0 274.364 3.778 20 5 CHBDRO CC[C@@H](CSC)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589206623 1127216247 /nfs/dbraw/zinc/21/62/47/1127216247.db2.gz YBHGOOWJDCYQKO-LEJCZOIISA-N 1 0 294.420 3.681 20 5 CHBDRO CC(C)(C)OCCC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000590019588 1127243375 /nfs/dbraw/zinc/24/33/75/1127243375.db2.gz OKIIJSSCNBZNON-UHFFFAOYSA-N 1 0 294.395 3.625 20 5 CHBDRO Cc1ccnc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000285975212 1127250647 /nfs/dbraw/zinc/25/06/47/1127250647.db2.gz HJGHYRXNSFKUJA-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO CC1(C)C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000590204418 1127251392 /nfs/dbraw/zinc/25/13/92/1127251392.db2.gz IEXOXACGTIRLIE-IUODEOHRSA-N 1 0 292.354 3.744 20 5 CHBDRO CC1(F)CC([NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000591348195 1127299205 /nfs/dbraw/zinc/29/92/05/1127299205.db2.gz HJZDVZHHCPOKQX-DSSZZKGTSA-N 1 0 292.354 3.843 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@H](F)C2)cccc1[N+](=O)[O-] ZINC000592390727 1127346955 /nfs/dbraw/zinc/34/69/55/1127346955.db2.gz PERSCYBKBXCBTL-AVGNSLFASA-N 1 0 280.343 3.835 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H](C)CC(F)F)cccc1[N+](=O)[O-] ZINC000592392416 1127344276 /nfs/dbraw/zinc/34/42/76/1127344276.db2.gz SPBOBISJYHCXHR-KOLCDFICSA-N 1 0 286.322 3.845 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCS[C@H]2C)cc1[N+](=O)[O-] ZINC000592379126 1127346305 /nfs/dbraw/zinc/34/63/05/1127346305.db2.gz HIEQVVRNDIEGSE-SMDDNHRTSA-N 1 0 294.420 3.702 20 5 CHBDRO CCC(CC)C[N@H+](CC)Cc1ccc([N+](=O)[O-])cc1 ZINC000058579947 1127362215 /nfs/dbraw/zinc/36/22/15/1127362215.db2.gz JXCHYMVPYZKTTE-UHFFFAOYSA-N 1 0 264.369 3.853 20 5 CHBDRO C[C@H]([NH2+]C1(C2CCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000593082315 1127372442 /nfs/dbraw/zinc/37/24/42/1127372442.db2.gz VAAHSQVQSPYOHK-NSHDSACASA-N 1 0 260.337 3.578 20 5 CHBDRO CCCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000058933975 1127400067 /nfs/dbraw/zinc/40/00/67/1127400067.db2.gz ZRXVAWODLNIBDJ-UHFFFAOYSA-N 1 0 264.369 3.995 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761053970 1127413466 /nfs/dbraw/zinc/41/34/66/1127413466.db2.gz IFKIOJYXSLACPQ-MWLCHTKSSA-N 1 0 288.269 3.540 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCc2ccccc21 ZINC000594490962 1127418487 /nfs/dbraw/zinc/41/84/87/1127418487.db2.gz UYJOJZVPPKWAPE-IAGOWNOFSA-N 1 0 294.354 3.859 20 5 CHBDRO Cc1cc2c(c(C)c1)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CC2 ZINC000594503331 1127419053 /nfs/dbraw/zinc/41/90/53/1127419053.db2.gz VSNBALWPTXLFHH-MRXNPFEDSA-N 1 0 296.370 3.989 20 5 CHBDRO Cc1cc(C)cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)c1 ZINC000594972605 1127437959 /nfs/dbraw/zinc/43/79/59/1127437959.db2.gz CJYMYTYNMFJTRG-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CC[C@@H]2c2ccccc2)cs1 ZINC000594993673 1127444378 /nfs/dbraw/zinc/44/43/78/1127444378.db2.gz FLVLNLLXFUMUPD-ZIAGYGMSSA-N 1 0 288.372 3.692 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2(C(F)F)CC2)cccc1[N+](=O)[O-] ZINC000359006567 1127444377 /nfs/dbraw/zinc/44/43/77/1127444377.db2.gz XTVBIZONNMBMKZ-SNVBAGLBSA-N 1 0 284.306 3.599 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1C[C@H](OCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000595066537 1127447922 /nfs/dbraw/zinc/44/79/22/1127447922.db2.gz IDNGCLVUTGVLQW-FVQBIDKESA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000595050142 1127451059 /nfs/dbraw/zinc/45/10/59/1127451059.db2.gz QDXLQVHWZOOIRL-OCCSQVGLSA-N 1 0 299.374 3.753 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)C(C)(C)C ZINC000595048638 1127451298 /nfs/dbraw/zinc/45/12/98/1127451298.db2.gz XJWYDTGFQZDQPE-GHMZBOCLSA-N 1 0 280.368 3.689 20 5 CHBDRO CC(C)[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])C1CC1 ZINC000595107387 1127453069 /nfs/dbraw/zinc/45/30/69/1127453069.db2.gz XXWCNXNUEMLESL-ZBFHGGJFSA-N 1 0 274.364 3.606 20 5 CHBDRO CC[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595079645 1127453390 /nfs/dbraw/zinc/45/33/90/1127453390.db2.gz MDEKYBNKHFODHV-OLZOCXBDSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@@]1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1(F)F ZINC000595082756 1127453770 /nfs/dbraw/zinc/45/37/70/1127453770.db2.gz XCGNVGWCIMPEQC-KBPBESRZSA-N 1 0 296.317 3.607 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1C(C)(C)C1(F)F ZINC000595090369 1127453912 /nfs/dbraw/zinc/45/39/12/1127453912.db2.gz BBJUWTVKFKYANQ-GXFFZTMASA-N 1 0 298.333 3.845 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595090735 1127454269 /nfs/dbraw/zinc/45/42/69/1127454269.db2.gz FNVJUUKBNFXVNF-CABZTGNLSA-N 1 0 284.306 3.537 20 5 CHBDRO CCSC1(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000595098506 1127456167 /nfs/dbraw/zinc/45/61/67/1127456167.db2.gz GUTPARRPPZJAOU-GFCCVEGCSA-N 1 0 294.420 3.840 20 5 CHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359293515 1127456607 /nfs/dbraw/zinc/45/66/07/1127456607.db2.gz FPFTUFGXWWVTIJ-CZUORRHYSA-N 1 0 274.364 3.607 20 5 CHBDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000359298113 1127457701 /nfs/dbraw/zinc/45/77/01/1127457701.db2.gz KSKOVKBKHOPDOR-BLLLJJGKSA-N 1 0 292.354 3.746 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH+]1C2CCCC1CCC2 ZINC000595324545 1127459770 /nfs/dbraw/zinc/45/97/70/1127459770.db2.gz BPMONMLQAQBRMV-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO CC[C@@H]([NH2+]CC1CC=CC1)c1cccc([N+](=O)[O-])c1 ZINC000595421794 1127462296 /nfs/dbraw/zinc/46/22/96/1127462296.db2.gz VDVJBUKWSOUZRN-OAHLLOKOSA-N 1 0 260.337 3.602 20 5 CHBDRO CCC1(CC)CCC[N@H+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595455423 1127463437 /nfs/dbraw/zinc/46/34/37/1127463437.db2.gz NGKPXVASMUVXRZ-UHFFFAOYSA-N 1 0 295.383 3.684 20 5 CHBDRO Cc1noc(C[NH2+][C@@H]2CCC[C@@H]2CCC(C)C)c1[N+](=O)[O-] ZINC000595452164 1127463614 /nfs/dbraw/zinc/46/36/14/1127463614.db2.gz ZEPUOOZWYQZWQA-CHWSQXEVSA-N 1 0 295.383 3.586 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000595822172 1127476774 /nfs/dbraw/zinc/47/67/74/1127476774.db2.gz OKZVHVHXDSBNCO-XSRFYTQQSA-N 1 0 298.333 3.740 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595858277 1127477974 /nfs/dbraw/zinc/47/79/74/1127477974.db2.gz VLHPEJIMYNFGPL-CPIKKWJDSA-N 1 0 274.364 3.919 20 5 CHBDRO Cc1ccoc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000293700959 1127513698 /nfs/dbraw/zinc/51/36/98/1127513698.db2.gz OKQOWVOAPKAUIZ-GFCCVEGCSA-N 1 0 274.320 3.655 20 5 CHBDRO C[C@H](c1ccc(-c2ccc([N+](=O)[O-])nc2)cc1)[NH+]1CCCC1 ZINC000596637401 1127513767 /nfs/dbraw/zinc/51/37/67/1127513767.db2.gz KLEISRMYXLNKJJ-CYBMUJFWSA-N 1 0 297.358 3.814 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)Cc2ccncc2)cccc1[N+](=O)[O-] ZINC000361967274 1127603275 /nfs/dbraw/zinc/60/32/75/1127603275.db2.gz KALCCINIQRGSRP-TZMCWYRMSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc2c1CCC2)c1cccc([N+](=O)[O-])c1 ZINC000593585335 1127629758 /nfs/dbraw/zinc/62/97/58/1127629758.db2.gz FZZOEILBVDHRFH-ZDUSSCGKSA-N 1 0 296.370 3.934 20 5 CHBDRO COC[C@@H](CC(C)(C)C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000593585340 1127629832 /nfs/dbraw/zinc/62/98/32/1127629832.db2.gz GGFHHVCZWFWPLZ-GXTWGEPZSA-N 1 0 294.395 3.697 20 5 CHBDRO CC[C@@H]([NH2+]CC[C@@H]1CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000598678926 1127630971 /nfs/dbraw/zinc/63/09/71/1127630971.db2.gz AVBIMNYIQPENKZ-DGCLKSJQSA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC[C@@H]2CC2(F)F)cccc1[N+](=O)[O-] ZINC000598679654 1127631701 /nfs/dbraw/zinc/63/17/01/1127631701.db2.gz KPJGENWQTHYIFA-WDEREUQCSA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC[C@H]2CC2(F)F)cccc1[N+](=O)[O-] ZINC000598679652 1127631898 /nfs/dbraw/zinc/63/18/98/1127631898.db2.gz KPJGENWQTHYIFA-QWRGUYRKSA-N 1 0 284.306 3.599 20 5 CHBDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000598955295 1127647889 /nfs/dbraw/zinc/64/78/89/1127647889.db2.gz MEWZPYRMSMAECZ-UHFFFAOYSA-N 1 0 286.322 3.756 20 5 CHBDRO CCC(CC)[C@H](CNc1ccc(F)cc1[N+](=O)[O-])[NH+](C)C ZINC000603438381 1127649489 /nfs/dbraw/zinc/64/94/89/1127649489.db2.gz BVNPRXBYVGALQH-HNNXBMFYSA-N 1 0 297.374 3.512 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CC=CC1 ZINC000599063500 1127654471 /nfs/dbraw/zinc/65/44/71/1127654471.db2.gz CIZYVTJGMXYJQE-GFCCVEGCSA-N 1 0 260.337 3.520 20 5 CHBDRO CCc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)c1 ZINC000593690111 1127660770 /nfs/dbraw/zinc/66/07/70/1127660770.db2.gz ZVAPWSZTOXQKLX-UHFFFAOYSA-N 1 0 284.359 3.755 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1(C2CCC2)CC1 ZINC000593718504 1127664800 /nfs/dbraw/zinc/66/48/00/1127664800.db2.gz JEPPEZQNEUEYHR-ZDUSSCGKSA-N 1 0 288.391 3.838 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000603843507 1127675414 /nfs/dbraw/zinc/67/54/14/1127675414.db2.gz GFRCSGVYCPTQHQ-CYBMUJFWSA-N 1 0 262.353 3.525 20 5 CHBDRO CCC(CC)C[N@H+](CC)Cc1cc([N+](=O)[O-])ccc1OC ZINC000603849893 1127676811 /nfs/dbraw/zinc/67/68/11/1127676811.db2.gz ZNVOGNZGOQZRGU-UHFFFAOYSA-N 1 0 294.395 3.862 20 5 CHBDRO C[C@@H]1CCC[N@H+](CCCCNc2ccsc2[N+](=O)[O-])C1 ZINC000604433471 1127705493 /nfs/dbraw/zinc/70/54/93/1127705493.db2.gz JSAUWWVLFSUXJX-GFCCVEGCSA-N 1 0 297.424 3.580 20 5 CHBDRO O=[N+]([O-])c1ccc(NCCC[NH+]2CCCCC2)c(Cl)c1 ZINC000604507137 1127708783 /nfs/dbraw/zinc/70/87/83/1127708783.db2.gz ZLQPNYZCJHGEJY-UHFFFAOYSA-N 1 0 297.786 3.536 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000298250254 1127716851 /nfs/dbraw/zinc/71/68/51/1127716851.db2.gz KLFYCNRCRXPKSR-HONMWMINSA-N 1 0 296.317 3.633 20 5 CHBDRO CC1CCC([N@H+](C)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000061799066 1127718492 /nfs/dbraw/zinc/71/84/92/1127718492.db2.gz UQJKUQSJGIHUFM-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO CCc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc1 ZINC000411472374 1127862008 /nfs/dbraw/zinc/86/20/08/1127862008.db2.gz HLZFDXYASCZRLQ-ZDUSSCGKSA-N 1 0 299.374 3.711 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1occc1C ZINC000412029391 1127892100 /nfs/dbraw/zinc/89/21/00/1127892100.db2.gz UNQZKYWKDMHPOI-UHFFFAOYSA-N 1 0 288.347 3.561 20 5 CHBDRO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539827559 1127944010 /nfs/dbraw/zinc/94/40/10/1127944010.db2.gz IKYAZRWARYTEQS-SMDDNHRTSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1CCC[C@H](C)O1)c1cccc([N+](=O)[O-])c1 ZINC000595079266 1127950244 /nfs/dbraw/zinc/95/02/44/1127950244.db2.gz JHTQXYRYAJHCON-MAZHCROVSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@H](C)O1)c1cccc([N+](=O)[O-])c1 ZINC000595079268 1127950526 /nfs/dbraw/zinc/95/05/26/1127950526.db2.gz JHTQXYRYAJHCON-RCBQFDQVSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1cccc([C@H]2CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000544187840 1127961968 /nfs/dbraw/zinc/96/19/68/1127961968.db2.gz XVQAICMHSHKMFL-INIZCTEOSA-N 1 0 296.370 3.893 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC(C)(C)C1 ZINC000467283491 1127963228 /nfs/dbraw/zinc/96/32/28/1127963228.db2.gz WALBVOBYRNBQLV-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000471022907 1127982797 /nfs/dbraw/zinc/98/27/97/1127982797.db2.gz QRSIAWROHQMFIE-KBXCAEBGSA-N 1 0 296.370 3.830 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(C2CC2)CC1 ZINC000468615180 1128013244 /nfs/dbraw/zinc/01/32/44/1128013244.db2.gz KUROXPFLKSWLPG-UKTHLTGXSA-N 1 0 286.375 3.778 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC=CCC1 ZINC000468650539 1128015178 /nfs/dbraw/zinc/01/51/78/1128015178.db2.gz YUBCSTGZFDHHMP-LTBFUDJGSA-N 1 0 286.375 3.944 20 5 CHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000541701396 1128034516 /nfs/dbraw/zinc/03/45/16/1128034516.db2.gz RCMAGTIBXMYOKE-AWEZNQCLSA-N 1 0 262.353 3.749 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000541774303 1128038851 /nfs/dbraw/zinc/03/88/51/1128038851.db2.gz FKZWTQVGTAQNQK-GFCCVEGCSA-N 1 0 284.306 3.571 20 5 CHBDRO CC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C1CCC1 ZINC000470174893 1128064921 /nfs/dbraw/zinc/06/49/21/1128064921.db2.gz NPNJJMILDPMEMX-RAXLEYEMSA-N 1 0 274.364 3.873 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC1CCC1 ZINC000470176958 1128065103 /nfs/dbraw/zinc/06/51/03/1128065103.db2.gz ZHGLYWOYPBQLDB-UKTHLTGXSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000470178432 1128065486 /nfs/dbraw/zinc/06/54/86/1128065486.db2.gz YKNZYUDJEYOEDW-UKUVYACNSA-N 1 0 286.375 3.730 20 5 CHBDRO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000272018565 1128097162 /nfs/dbraw/zinc/09/71/62/1128097162.db2.gz RNEWRTOSBXKVRA-ZDUSSCGKSA-N 1 0 282.343 3.935 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000492633264 1128107410 /nfs/dbraw/zinc/10/74/10/1128107410.db2.gz UWXLCGLNNJIKJD-CYBMUJFWSA-N 1 0 292.379 3.758 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000492543309 1128102240 /nfs/dbraw/zinc/10/22/40/1128102240.db2.gz ZCCQPXOMLZKPCL-CQSZACIVSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2CCCCS2)cccc1[N+](=O)[O-] ZINC000542500338 1128195038 /nfs/dbraw/zinc/19/50/38/1128195038.db2.gz UGFYRHJXYUPVGB-OLZOCXBDSA-N 1 0 294.420 3.840 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193069588 1128206159 /nfs/dbraw/zinc/20/61/59/1128206159.db2.gz LLCMJRGKOAWHDG-DOMZBBRYSA-N 1 0 294.420 3.703 20 5 CHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1ccc([N+](=O)[O-])cc1 ZINC000301090966 1128332985 /nfs/dbraw/zinc/33/29/85/1128332985.db2.gz KPZCUVJPVRVVRZ-CQSZACIVSA-N 1 0 291.395 3.661 20 5 CHBDRO C[N@@H+]1CCCC[C@@H]1CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000915666824 1128333049 /nfs/dbraw/zinc/33/30/49/1128333049.db2.gz IZDSWOITWDYXGE-GFCCVEGCSA-N 1 0 298.770 3.501 20 5 CHBDRO CCCCC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000153734600 1128338833 /nfs/dbraw/zinc/33/88/33/1128338833.db2.gz CANMCKGFEJAUKW-MRXNPFEDSA-N 1 0 294.395 3.529 20 5 CHBDRO C[C@H]([NH2+]CC1(C2CC2)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000090724246 1128372389 /nfs/dbraw/zinc/37/23/89/1128372389.db2.gz PYWJUIFQOLUEEA-LBPRGKRZSA-N 1 0 274.364 3.826 20 5 CHBDRO Cc1ccoc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000565516746 1128527366 /nfs/dbraw/zinc/52/73/66/1128527366.db2.gz DLHCZHPEXWTPCC-LBPRGKRZSA-N 1 0 274.320 3.655 20 5 CHBDRO CC(C)[C@@H]1CC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000556893213 1128634625 /nfs/dbraw/zinc/63/46/25/1128634625.db2.gz RCCKZVUZHVKONF-KBPBESRZSA-N 1 0 296.798 3.815 20 5 CHBDRO CCSCC[C@H](C)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000556901448 1128636819 /nfs/dbraw/zinc/63/68/19/1128636819.db2.gz NMNOLZNUDUCBLB-ZDUSSCGKSA-N 1 0 296.436 3.867 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)cc1 ZINC000046089182 1128658375 /nfs/dbraw/zinc/65/83/75/1128658375.db2.gz BTURIXHEKRAKOW-OAHLLOKOSA-N 1 0 288.372 3.993 20 5 CHBDRO C[NH2+]CC1(c2ccc(-c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000600783571 1128681049 /nfs/dbraw/zinc/68/10/49/1128681049.db2.gz DXFHIJPQNNAYEU-UHFFFAOYSA-N 1 0 282.343 3.513 20 5 CHBDRO Cc1ccc(-c2ccc([C@H]3CCC[NH2+]3)cc2)cc1[N+](=O)[O-] ZINC000600791054 1128681757 /nfs/dbraw/zinc/68/17/57/1128681757.db2.gz OVUXJCDCBPQGRY-MRXNPFEDSA-N 1 0 282.343 3.995 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000601101813 1128698148 /nfs/dbraw/zinc/69/81/48/1128698148.db2.gz YHHQELDLGLZJEK-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@@H]1C[C@H]([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CCO1 ZINC000578637210 1128724740 /nfs/dbraw/zinc/72/47/40/1128724740.db2.gz PBCJQGJGSHLOQY-UMVBOHGHSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609766746 1128725708 /nfs/dbraw/zinc/72/57/08/1128725708.db2.gz MSMSSJXQGAEQKW-CYBMUJFWSA-N 1 0 262.353 3.607 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000609846173 1128728223 /nfs/dbraw/zinc/72/82/23/1128728223.db2.gz NXCFYEYUTALFMI-WXHSDQCUSA-N 1 0 280.393 3.809 20 5 CHBDRO Cc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)s1 ZINC000231883999 1117799548 /nfs/dbraw/zinc/79/95/48/1117799548.db2.gz MFFNHKPVQGZRDE-UHFFFAOYSA-N 1 0 290.388 3.871 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CCc2ccco2)cc1[N+](=O)[O-] ZINC000072726567 1117809857 /nfs/dbraw/zinc/80/98/57/1117809857.db2.gz XXBXPODIKKDHQF-UHFFFAOYSA-N 1 0 288.347 3.644 20 5 CHBDRO CC[C@H]1CC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000430203220 1117859975 /nfs/dbraw/zinc/85/99/75/1117859975.db2.gz IVZPDLMUOLOYIN-ZDUSSCGKSA-N 1 0 286.331 3.839 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC2(C1)CCCCC2 ZINC000610216199 1117880771 /nfs/dbraw/zinc/88/07/71/1117880771.db2.gz YYHCGEBRZARDTE-UHFFFAOYSA-N 1 0 292.354 3.890 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000109133977 1117919946 /nfs/dbraw/zinc/91/99/46/1117919946.db2.gz APHVWMYQUIYDBB-VHSXEESVSA-N 1 0 270.760 3.772 20 5 CHBDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705296 1118000807 /nfs/dbraw/zinc/00/08/07/1118000807.db2.gz RUCVNQXHBJLFSO-ZDUSSCGKSA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C[NH+](C)C ZINC000301332050 1118194558 /nfs/dbraw/zinc/19/45/58/1118194558.db2.gz DZSLKXMKHZNRQI-JTQLQIEISA-N 1 0 299.802 3.636 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000282222743 1118299510 /nfs/dbraw/zinc/29/95/10/1118299510.db2.gz ICBLOGGCJZCIIN-UHFFFAOYSA-N 1 0 284.306 3.508 20 5 CHBDRO CC(C)CCC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000084439799 1118355967 /nfs/dbraw/zinc/35/59/67/1118355967.db2.gz DSRJKICSDCYFBR-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)Cc2cccs2)cccc1[N+](=O)[O-] ZINC000071270532 1118459283 /nfs/dbraw/zinc/45/92/83/1118459283.db2.gz VVMILDZJNBYKOQ-NSHDSACASA-N 1 0 290.388 3.686 20 5 CHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000090910120 1118689004 /nfs/dbraw/zinc/68/90/04/1118689004.db2.gz ZIEXNOOSKXXCMW-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)C[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000090918462 1118689093 /nfs/dbraw/zinc/68/90/93/1118689093.db2.gz GRTMLPHWZDPCTE-WQVCFCJDSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580679 1118778367 /nfs/dbraw/zinc/77/83/67/1118778367.db2.gz BTRKVVWQOQEGHJ-LLVKDONJSA-N 1 0 289.335 3.501 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CC[C@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000510991650 1118907608 /nfs/dbraw/zinc/90/76/08/1118907608.db2.gz JOSPKFCZWTUESP-GJZGRUSLSA-N 1 0 274.364 3.572 20 5 CHBDRO CCC[C@](C)([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC000934179884 1118956711 /nfs/dbraw/zinc/95/67/11/1118956711.db2.gz JRVGOIMEYGQBON-KRWDZBQOSA-N 1 0 299.374 3.795 20 5 CHBDRO CC1(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000539087250 1118970194 /nfs/dbraw/zinc/97/01/94/1118970194.db2.gz GNIHMQXLGLSYNA-HIFRSBDPSA-N 1 0 288.391 3.696 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)Cc2ccncc2)cccc1[N+](=O)[O-] ZINC000361967272 1118985008 /nfs/dbraw/zinc/98/50/08/1118985008.db2.gz KALCCINIQRGSRP-JSGCOSHPSA-N 1 0 299.374 3.580 20 5 CHBDRO Cc1c(C[N@H+]2C[C@@H](C)CC2(C)C)cccc1[N+](=O)[O-] ZINC000472276874 1119280354 /nfs/dbraw/zinc/28/03/54/1119280354.db2.gz LOLLRCXQBLCTRK-NSHDSACASA-N 1 0 262.353 3.524 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CCCCCC1 ZINC000248018166 1119302336 /nfs/dbraw/zinc/30/23/36/1119302336.db2.gz DSGYXICUKWBAHY-UHFFFAOYSA-N 1 0 262.353 3.749 20 5 CHBDRO CCC[C@@H](C[NH2+][C@@H](CCC)c1cccc([N+](=O)[O-])c1)OC ZINC000378842757 1119573711 /nfs/dbraw/zinc/57/37/11/1119573711.db2.gz PYTOXEUKHMBPDY-HOTGVXAUSA-N 1 0 294.395 3.841 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000158896880 1119592128 /nfs/dbraw/zinc/59/21/28/1119592128.db2.gz MXUSNLWWMRVJSQ-ZDUSSCGKSA-N 1 0 292.379 3.662 20 5 CHBDRO C[N@H+](Cc1cccc2[nH]ccc21)Cc1ccccc1[N+](=O)[O-] ZINC000179316724 1119710292 /nfs/dbraw/zinc/71/02/92/1119710292.db2.gz NKSPBBGMHSAWMQ-UHFFFAOYSA-N 1 0 295.342 3.708 20 5 CHBDRO CC1(C)CC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000612416758 1119786068 /nfs/dbraw/zinc/78/60/68/1119786068.db2.gz FFHAGFIEGDPMLL-ZDUSSCGKSA-N 1 0 296.798 3.959 20 5 CHBDRO CC[NH+](CC)CCCCNc1ccc([N+](=O)[O-])cc1Cl ZINC000065944918 1119790125 /nfs/dbraw/zinc/79/01/25/1119790125.db2.gz WHIHDKVPLMFVCU-UHFFFAOYSA-N 1 0 299.802 3.782 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)cc1 ZINC000065967585 1119797046 /nfs/dbraw/zinc/79/70/46/1119797046.db2.gz UJWHOHROVPHOMF-KWOWKCNFSA-N 1 0 286.375 3.605 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1cccc([N+](=O)[O-])c1 ZINC000580856025 1119890065 /nfs/dbraw/zinc/89/00/65/1119890065.db2.gz BISMHVQKMQMFBM-UHFFFAOYSA-N 1 0 250.342 3.605 20 5 CHBDRO COc1cc(C[NH2+]C(C(C)C)C(C)C)c([N+](=O)[O-])cc1F ZINC000613383376 1119913749 /nfs/dbraw/zinc/91/37/49/1119913749.db2.gz GOAJHDNFELMXMO-UHFFFAOYSA-N 1 0 298.358 3.513 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000414344597 1119991346 /nfs/dbraw/zinc/99/13/46/1119991346.db2.gz RRGPDNRHJANWAQ-MRVWCRGKSA-N 1 0 286.331 3.703 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCCc1ccccc1)CC2 ZINC000472592287 1119991998 /nfs/dbraw/zinc/99/19/98/1119991998.db2.gz YUMHHZISXKDTOD-UHFFFAOYSA-N 1 0 296.370 3.586 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)ccc1Cl ZINC000694619826 1119998275 /nfs/dbraw/zinc/99/82/75/1119998275.db2.gz SVQVCCGWXHIATF-NTZNESFSSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000181261779 1120032776 /nfs/dbraw/zinc/03/27/76/1120032776.db2.gz HFTHKJWRDQXXQV-BXUZGUMPSA-N 1 0 292.379 3.592 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCC(F)(F)C1 ZINC000311841480 1120112319 /nfs/dbraw/zinc/11/23/19/1120112319.db2.gz HOVFLRHJRWIUDG-JTQLQIEISA-N 1 0 290.697 3.526 20 5 CHBDRO CCC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccnc1 ZINC000273516892 1120130788 /nfs/dbraw/zinc/13/07/88/1120130788.db2.gz STBPIEKKLWNONL-KRWDZBQOSA-N 1 0 299.374 3.663 20 5 CHBDRO CCCC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774747 1120142842 /nfs/dbraw/zinc/14/28/42/1120142842.db2.gz UCXKBSVMPRXCAY-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@@H]21 ZINC000541111790 1120148575 /nfs/dbraw/zinc/14/85/75/1120148575.db2.gz SLLAIUKFRXSVJR-DAXOMENPSA-N 1 0 274.364 3.605 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@@H]2CCCC[C@H]21 ZINC000541108996 1120149145 /nfs/dbraw/zinc/14/91/45/1120149145.db2.gz FUAOUBMWBDYHRF-DIOULYMOSA-N 1 0 292.354 3.744 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1 ZINC000062726475 1120205562 /nfs/dbraw/zinc/20/55/62/1120205562.db2.gz VPKRHRHLBGBKFX-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000062726521 1120206128 /nfs/dbraw/zinc/20/61/28/1120206128.db2.gz FFKOLDVWOMZVET-GFCCVEGCSA-N 1 0 288.347 3.698 20 5 CHBDRO CSCCCC[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000468634991 1120232002 /nfs/dbraw/zinc/23/20/02/1120232002.db2.gz KTBPJIDKFPWJAA-JLHYYAGUSA-N 1 0 294.420 3.731 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000584543427 1120233030 /nfs/dbraw/zinc/23/30/30/1120233030.db2.gz JYUWKJMSSVPAGX-LBPRGKRZSA-N 1 0 294.782 3.870 20 5 CHBDRO COc1ccc(C[N@H+](C2CC2)C2CCCC2)cc1[N+](=O)[O-] ZINC000103466177 1120252464 /nfs/dbraw/zinc/25/24/64/1120252464.db2.gz DDWIFOUVUOWGPB-UHFFFAOYSA-N 1 0 290.363 3.510 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000020087390 1120278763 /nfs/dbraw/zinc/27/87/63/1120278763.db2.gz WFSRQUQZFJOIJF-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522714116 1120310589 /nfs/dbraw/zinc/31/05/89/1120310589.db2.gz CEPVBELLHXDZJX-HNNXBMFYSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000131006109 1120438681 /nfs/dbraw/zinc/43/86/81/1120438681.db2.gz SMMWAXWGGSPCKM-WDEREUQCSA-N 1 0 250.342 3.680 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2[C@@H]3CCC[C@@H]32)o1 ZINC000566500899 1120474583 /nfs/dbraw/zinc/47/45/83/1120474583.db2.gz RRNOVJWXOPAWGE-LAQFHYBYSA-N 1 0 298.342 3.743 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000068581142 1120478918 /nfs/dbraw/zinc/47/89/18/1120478918.db2.gz MQIPGLOGXFOXFG-SGMGOOAPSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000020090636 1120493145 /nfs/dbraw/zinc/49/31/45/1120493145.db2.gz XHQDEZGPIJIZOS-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@H]1C[C@H](C)C[NH+](CCSc2cccc([N+](=O)[O-])c2)C1 ZINC001307342110 1120565897 /nfs/dbraw/zinc/56/58/97/1120565897.db2.gz RRIMPGWSFHUFGF-STQMWFEESA-N 1 0 294.420 3.665 20 5 CHBDRO CC[C@H](C)[N@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470179138 1120605930 /nfs/dbraw/zinc/60/59/30/1120605930.db2.gz SSXREKYQKCHKEE-SUIFULHWSA-N 1 0 262.353 3.728 20 5 CHBDRO Cc1cc(N2CC[C@H](C)[C@@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302102830 1120648466 /nfs/dbraw/zinc/64/84/66/1120648466.db2.gz VUQXOVDQFMGUGZ-JQWIXIFHSA-N 1 0 285.347 3.686 20 5 CHBDRO Cc1cccc(NC[C@@H](c2ccccc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000302461342 1120652219 /nfs/dbraw/zinc/65/22/19/1120652219.db2.gz ACWQTZQKJNIVCH-INIZCTEOSA-N 1 0 299.374 3.618 20 5 CHBDRO CC[C@H](C)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000215664323 1120661021 /nfs/dbraw/zinc/66/10/21/1120661021.db2.gz LADPTGRPFOEBKT-LBPRGKRZSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000466934919 1120662294 /nfs/dbraw/zinc/66/22/94/1120662294.db2.gz GRNQDRVIWPZKIE-ZWNOBZJWSA-N 1 0 282.771 3.869 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000303016968 1120662969 /nfs/dbraw/zinc/66/29/69/1120662969.db2.gz SLJTUDAGUQMWTR-KRWDZBQOSA-N 1 0 296.370 3.627 20 5 CHBDRO CC[C@]1(C)CC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001307582550 1120686123 /nfs/dbraw/zinc/68/61/23/1120686123.db2.gz HHIGDCLIZWUZAR-CQSZACIVSA-N 1 0 282.771 3.870 20 5 CHBDRO Cc1c(C[NH+](C2CCC2)C2CCC2)cccc1[N+](=O)[O-] ZINC000429162850 1120692650 /nfs/dbraw/zinc/69/26/50/1120692650.db2.gz LXXBHSIARPOLOR-UHFFFAOYSA-N 1 0 274.364 3.810 20 5 CHBDRO Cc1c(C[N@H+](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000051377682 1120817887 /nfs/dbraw/zinc/81/78/87/1120817887.db2.gz YNMJBOGVIPMMDI-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO CN(Cc1csc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000048609564 1120835474 /nfs/dbraw/zinc/83/54/74/1120835474.db2.gz QENCSOZKDOGELA-CQSZACIVSA-N 1 0 288.372 3.776 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCc3cc(F)ccc32)c1 ZINC000133828678 1121045308 /nfs/dbraw/zinc/04/53/08/1121045308.db2.gz JDDSQEKLVTURJI-INIZCTEOSA-N 1 0 286.306 3.511 20 5 CHBDRO C[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000512178394 1121141843 /nfs/dbraw/zinc/14/18/43/1121141843.db2.gz ILQNTWSNVKUJGR-LHRNQBEKSA-N 1 0 274.364 3.730 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 ZINC000040444253 1121181854 /nfs/dbraw/zinc/18/18/54/1121181854.db2.gz SZLVBOUQFOCERP-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO C[C@H]1CCCC[C@@H]1CC[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000512226838 1121210640 /nfs/dbraw/zinc/21/06/40/1121210640.db2.gz PPUZFKZKKWAZLO-DZGCQCFKSA-N 1 0 276.380 3.901 20 5 CHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000512230855 1121212954 /nfs/dbraw/zinc/21/29/54/1121212954.db2.gz VJLNWKNJRNKMRF-PLWJUESGSA-N 1 0 276.380 3.974 20 5 CHBDRO CC1(C[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000432774475 1121336502 /nfs/dbraw/zinc/33/65/02/1121336502.db2.gz CHFWEPRAWRLZLA-UHFFFAOYSA-N 1 0 274.364 3.749 20 5 CHBDRO C[NH+](C)Cc1ccc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)cc1 ZINC001175902104 1121494346 /nfs/dbraw/zinc/49/43/46/1121494346.db2.gz GUINPWCTTUBYJH-VAWYXSNFSA-N 1 0 297.358 3.739 20 5 CHBDRO C[C@@H]1CC[C@@H]([N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000433037401 1121532743 /nfs/dbraw/zinc/53/27/43/1121532743.db2.gz FACAXIAXFLZVDJ-RLWBPUTGSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000543631500 1121538736 /nfs/dbraw/zinc/53/87/36/1121538736.db2.gz NNLZYKUZOCVZCK-XJKSGUPXSA-N 1 0 274.364 3.668 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000509377977 1121559163 /nfs/dbraw/zinc/55/91/63/1121559163.db2.gz GZKWOTGRBCCWCN-BUUCAEBMSA-N 1 0 262.353 3.586 20 5 CHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccoc1 ZINC000611267949 1121633707 /nfs/dbraw/zinc/63/37/07/1121633707.db2.gz QTTNXHRXATXSAQ-ALCCZGGFSA-N 1 0 286.331 3.723 20 5 CHBDRO CS[C@@H](C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433297412 1121642474 /nfs/dbraw/zinc/64/24/74/1121642474.db2.gz LEJUUTNMUCOBDB-HZMBPMFUSA-N 1 0 294.420 3.658 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000611475898 1121651306 /nfs/dbraw/zinc/65/13/06/1121651306.db2.gz OOGYUPNFHQFALH-QWRGUYRKSA-N 1 0 284.306 3.742 20 5 CHBDRO Cc1cccc(C[NH2+]CCc2cccc([N+](=O)[O-])c2)c1C ZINC001178386578 1121781625 /nfs/dbraw/zinc/78/16/25/1121781625.db2.gz FLBYCBOBCUULLZ-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO CC[C@H]1CCC[C@@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC001178748964 1121811693 /nfs/dbraw/zinc/81/16/93/1121811693.db2.gz XYFLQBMXYSUQKW-DZGCQCFKSA-N 1 0 276.380 3.819 20 5 CHBDRO CCC([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)(C1CC1)C1CC1 ZINC001179153449 1121855923 /nfs/dbraw/zinc/85/59/23/1121855923.db2.gz KZTURWHYDYQDPT-UHFFFAOYSA-N 1 0 288.391 3.962 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCCC12CC2 ZINC001179320355 1121872019 /nfs/dbraw/zinc/87/20/19/1121872019.db2.gz DMLGLHJPQUHGHG-HNNXBMFYSA-N 1 0 274.364 3.634 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCCC12CC2 ZINC001179320358 1121872566 /nfs/dbraw/zinc/87/25/66/1121872566.db2.gz DMLGLHJPQUHGHG-OAHLLOKOSA-N 1 0 274.364 3.634 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CCC1 ZINC000168138031 1122005554 /nfs/dbraw/zinc/00/55/54/1122005554.db2.gz WQQNAFIIACVAEI-SECBINFHSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CCC1 ZINC000168137929 1122006298 /nfs/dbraw/zinc/00/62/98/1122006298.db2.gz WQQNAFIIACVAEI-VIFPVBQESA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000034995024 1122135842 /nfs/dbraw/zinc/13/58/42/1122135842.db2.gz YWUYKQPIIRRFCS-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)oc1C ZINC000502711753 1122140878 /nfs/dbraw/zinc/14/08/78/1122140878.db2.gz KLQTWJCEOUHSOJ-LBPRGKRZSA-N 1 0 288.347 3.698 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc[nH]1 ZINC000774265564 1122149610 /nfs/dbraw/zinc/14/96/10/1122149610.db2.gz FTIJCYKLIRPLTK-MEDUHNTESA-N 1 0 285.347 3.651 20 5 CHBDRO CC(C)[C@@H]1[N@H+](Cc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000430100953 1122404359 /nfs/dbraw/zinc/40/43/59/1122404359.db2.gz BPUWXLIXIYWCPZ-HNNXBMFYSA-N 1 0 274.364 3.605 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000515433677 1122499692 /nfs/dbraw/zinc/49/96/92/1122499692.db2.gz XLCAUIHHHJTAOA-MJVIPROJSA-N 1 0 262.353 3.606 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@@H]12 ZINC000515548296 1122509583 /nfs/dbraw/zinc/50/95/83/1122509583.db2.gz RHIXYHKHOLELLH-XOKHGSTOSA-N 1 0 288.391 3.995 20 5 CHBDRO CC1=CCCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000436257120 1122528210 /nfs/dbraw/zinc/52/82/10/1122528210.db2.gz CTPXHXQQGDXYKS-UHFFFAOYSA-N 1 0 290.363 3.534 20 5 CHBDRO CC[N@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505848325 1122561986 /nfs/dbraw/zinc/56/19/86/1122561986.db2.gz QFCIIFBHRQJKOL-UHFFFAOYSA-N 1 0 284.359 3.925 20 5 CHBDRO CC[C@H](C)c1ccc([C@@H]([NH2+]CC[N+](=O)[O-])C(C)C)cc1 ZINC001191961622 1122625250 /nfs/dbraw/zinc/62/52/50/1122625250.db2.gz YYFAPZZCWYCSRF-BBRMVZONSA-N 1 0 278.396 3.764 20 5 CHBDRO CC[N@H+](Cc1cccs1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506017829 1122626096 /nfs/dbraw/zinc/62/60/96/1122626096.db2.gz VMMNCCOOHVWFIP-UHFFFAOYSA-N 1 0 290.388 3.987 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001192481314 1122649323 /nfs/dbraw/zinc/64/93/23/1122649323.db2.gz LKLWKALARQQGME-CQSZACIVSA-N 1 0 276.380 3.771 20 5 CHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000506220216 1122698103 /nfs/dbraw/zinc/69/81/03/1122698103.db2.gz VAEDHLRDBZZDCI-GXTWGEPZSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)c1ccccc1 ZINC000449065415 1122748670 /nfs/dbraw/zinc/74/86/70/1122748670.db2.gz UHXKQCVLIVHNIE-HUUCEWRRSA-N 1 0 298.386 3.919 20 5 CHBDRO CCC[N@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000506498177 1122756857 /nfs/dbraw/zinc/75/68/57/1122756857.db2.gz BRJIAJFHEYETRP-UHFFFAOYSA-N 1 0 250.342 3.560 20 5 CHBDRO CC(C)C[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000506500916 1122758407 /nfs/dbraw/zinc/75/84/07/1122758407.db2.gz YBQXRPPERBNQPH-UHFFFAOYSA-N 1 0 288.347 3.943 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CC=CCC1 ZINC000518562610 1122768435 /nfs/dbraw/zinc/76/84/35/1122768435.db2.gz MQLYIFKMUZHFFU-IUODEOHRSA-N 1 0 272.348 3.528 20 5 CHBDRO CCCCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194466965 1122776492 /nfs/dbraw/zinc/77/64/92/1122776492.db2.gz MIFZRDSAPFCRGM-OAHLLOKOSA-N 1 0 276.380 3.964 20 5 CHBDRO CC(C)[C@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507187519 1122845749 /nfs/dbraw/zinc/84/57/49/1122845749.db2.gz KUCUGMFMZULRPZ-GTBONMDNSA-N 1 0 274.364 3.728 20 5 CHBDRO C[C@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000086889897 1122947041 /nfs/dbraw/zinc/94/70/41/1122947041.db2.gz OXPCZAOMMBMHBU-GXTWGEPZSA-N 1 0 262.353 3.653 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)C(C)C ZINC000520564846 1123176031 /nfs/dbraw/zinc/17/60/31/1123176031.db2.gz YLFGGMNFNQKQTE-CYBMUJFWSA-N 1 0 294.395 3.858 20 5 CHBDRO Cc1ccc(C[NH2+]CC(C)(C)C(C)(F)F)cc1[N+](=O)[O-] ZINC000696567807 1123195170 /nfs/dbraw/zinc/19/51/70/1123195170.db2.gz JOAVUCVWBIXTIG-UHFFFAOYSA-N 1 0 286.322 3.674 20 5 CHBDRO C[C@H](Nc1ccc([N+](=O)[O-])cc1)[C@H](c1ccccc1)[NH+](C)C ZINC000439129605 1123363075 /nfs/dbraw/zinc/36/30/75/1123363075.db2.gz QYDYVZDAMCEEDZ-SUMWQHHRSA-N 1 0 299.374 3.698 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@@H](C)C1 ZINC000252122427 1123385306 /nfs/dbraw/zinc/38/53/06/1123385306.db2.gz KZPULQGOPXQIOO-NHAGDIPZSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]([NH2+]CCC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000129617045 1123400230 /nfs/dbraw/zinc/40/02/30/1123400230.db2.gz BMKUNLFZCABZJH-NSHDSACASA-N 1 0 250.342 3.682 20 5 CHBDRO C[C@H](CC1CCC1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000129623424 1123461251 /nfs/dbraw/zinc/46/12/51/1123461251.db2.gz ZIGQCKDPBIQSDG-VXGBXAGGSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1ccns1 ZINC000858575788 1123663761 /nfs/dbraw/zinc/66/37/61/1123663761.db2.gz DTMMWJBKCUCJTN-WDEREUQCSA-N 1 0 291.376 3.772 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C2Cc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000184005617 1129145389 /nfs/dbraw/zinc/14/53/89/1129145389.db2.gz OPSVCDRGXMAEED-ZDUSSCGKSA-N 1 0 296.370 3.721 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193069574 1124025619 /nfs/dbraw/zinc/02/56/19/1124025619.db2.gz LLCMJRGKOAWHDG-WFASDCNBSA-N 1 0 294.420 3.703 20 5 CHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1ccsc1 ZINC000866233588 1124039523 /nfs/dbraw/zinc/03/95/23/1124039523.db2.gz WRHJHWJRPFYLIN-JTQLQIEISA-N 1 0 294.351 3.516 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000037668255 1129165826 /nfs/dbraw/zinc/16/58/26/1129165826.db2.gz OCHQUTRCQQTUFN-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000525273841 1124119608 /nfs/dbraw/zinc/11/96/08/1124119608.db2.gz ZKALKBJZKFXEEQ-XNRPHZJLSA-N 1 0 274.364 3.748 20 5 CHBDRO C[C@H]([NH2+]CC1CC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000525858906 1124476396 /nfs/dbraw/zinc/47/63/96/1124476396.db2.gz CEKVOWZMQXBGBP-NSHDSACASA-N 1 0 262.353 3.682 20 5 CHBDRO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000525996631 1124489165 /nfs/dbraw/zinc/48/91/65/1124489165.db2.gz QGZSUOFPXURLRH-RYUDHWBXSA-N 1 0 286.331 3.838 20 5 CHBDRO CSCCCCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000186777358 1124583668 /nfs/dbraw/zinc/58/36/68/1124583668.db2.gz ZXROEJHVYSBBKI-GFCCVEGCSA-N 1 0 282.409 3.779 20 5 CHBDRO Cc1c(C[NH2+]CC(C)(C)C(C)(F)F)cccc1[N+](=O)[O-] ZINC000697118276 1124645216 /nfs/dbraw/zinc/64/52/16/1124645216.db2.gz SBDBGUKPZIUYHS-UHFFFAOYSA-N 1 0 286.322 3.674 20 5 CHBDRO CC(C)OC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000871933709 1124653265 /nfs/dbraw/zinc/65/32/65/1124653265.db2.gz WTWFHORJRIOBMP-ZDUSSCGKSA-N 1 0 292.379 3.593 20 5 CHBDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038075 1124662503 /nfs/dbraw/zinc/66/25/03/1124662503.db2.gz HRWJKGBFZMNZFS-QWRGUYRKSA-N 1 0 298.358 3.588 20 5 CHBDRO CC[C@H](CCC(F)(F)F)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000872048392 1124666244 /nfs/dbraw/zinc/66/62/44/1124666244.db2.gz ZNILRQSIJCMCGO-LLVKDONJSA-N 1 0 290.285 3.806 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449183020 1124666261 /nfs/dbraw/zinc/66/62/61/1124666261.db2.gz CLFOXTYEZADGTC-CHWSQXEVSA-N 1 0 264.369 3.550 20 5 CHBDRO c1cnc2c(c1)ccc1c(C3=CCC[NH2+]CC3)ccnc12 ZINC001238951808 1131276226 /nfs/dbraw/zinc/27/62/26/1131276226.db2.gz YJKXEAXJBAZJMD-UHFFFAOYSA-N 1 0 275.355 3.550 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(C)(C)F ZINC000872094285 1124681557 /nfs/dbraw/zinc/68/15/57/1124681557.db2.gz ZNQYKAPTAOEETO-VIFPVBQESA-N 1 0 286.372 3.715 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)ccc1F ZINC000449373576 1124704311 /nfs/dbraw/zinc/70/43/11/1124704311.db2.gz SAEQZJVSGLYWCP-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]3C3CC3)o2)cc1 ZINC000449425035 1124732326 /nfs/dbraw/zinc/73/23/26/1124732326.db2.gz MAZCNTRRUWOAHP-MRXNPFEDSA-N 1 0 298.342 3.839 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H](C)CC(F)F ZINC000873134656 1124741641 /nfs/dbraw/zinc/74/16/41/1124741641.db2.gz SAPLBXSYWXCWSX-VIFPVBQESA-N 1 0 286.322 3.593 20 5 CHBDRO Cc1ccc(F)cc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000873183616 1124746713 /nfs/dbraw/zinc/74/67/13/1124746713.db2.gz WTCVHAUNSRAEKA-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC001170947867 1131290198 /nfs/dbraw/zinc/29/01/98/1131290198.db2.gz BRWOEYZHFLVHBK-ABAIWWIYSA-N 1 0 280.343 3.792 20 5 CHBDRO Cc1c(C[NH+]2CCC3(CC3(F)F)CC2)cccc1[N+](=O)[O-] ZINC000593078330 1125040417 /nfs/dbraw/zinc/04/04/17/1125040417.db2.gz ZYIGQPKKSPBGOX-UHFFFAOYSA-N 1 0 296.317 3.524 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](CC2CC2)CC2CCC2)cc1 ZINC000475677765 1125210023 /nfs/dbraw/zinc/21/00/23/1125210023.db2.gz NENAZBOXMZJILQ-UHFFFAOYSA-N 1 0 274.364 3.607 20 5 CHBDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000531441469 1125218913 /nfs/dbraw/zinc/21/89/13/1125218913.db2.gz NOXYHJJFFXODIL-KSSFIOAISA-N 1 0 296.370 3.973 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)C(C)C ZINC000532235482 1125243123 /nfs/dbraw/zinc/24/31/23/1125243123.db2.gz OGHOJATUOQJZNC-CHWSQXEVSA-N 1 0 264.369 3.846 20 5 CHBDRO Cc1cccc(C)c1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000130394888 1125360477 /nfs/dbraw/zinc/36/04/77/1125360477.db2.gz CEFIIPVPEFYTOI-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000094519603 1125385463 /nfs/dbraw/zinc/38/54/63/1125385463.db2.gz NCZCXNVBVZGPSO-UHFFFAOYSA-N 1 0 282.343 3.762 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)CCSC)c1cccc([N+](=O)[O-])c1 ZINC000131650695 1125404368 /nfs/dbraw/zinc/40/43/68/1125404368.db2.gz DFSKYSCMGKJPRB-SMDDNHRTSA-N 1 0 282.409 3.777 20 5 CHBDRO C[C@@H]([N@H+](C)CCc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000532491070 1125408034 /nfs/dbraw/zinc/40/80/34/1125408034.db2.gz WQMXURBVVLFVNA-GFCCVEGCSA-N 1 0 264.369 3.504 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000094773558 1129451836 /nfs/dbraw/zinc/45/18/36/1129451836.db2.gz MNBZXTRAHUGYLS-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094773488 1129451899 /nfs/dbraw/zinc/45/18/99/1129451899.db2.gz LGWZARFXRGKZAC-TZMCWYRMSA-N 1 0 280.343 3.792 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774883 1129452022 /nfs/dbraw/zinc/45/20/22/1129452022.db2.gz HIBFUSRWNQRCMK-GFCCVEGCSA-N 1 0 280.343 3.746 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC2(C1)CCCCC2 ZINC000741806279 1129454787 /nfs/dbraw/zinc/45/47/87/1129454787.db2.gz DZPMIZCWPHRANT-UHFFFAOYSA-N 1 0 292.354 3.890 20 5 CHBDRO Cc1ccc(C[C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000303755045 1129557449 /nfs/dbraw/zinc/55/74/49/1129557449.db2.gz MUKMBMWHXWWOQF-HNNXBMFYSA-N 1 0 298.386 3.966 20 5 CHBDRO Cc1cc([C@H](C)[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)ccc1Cl ZINC001168979899 1129686806 /nfs/dbraw/zinc/68/68/06/1129686806.db2.gz BZSKNKAKQLPCKX-SCRDCRAPSA-N 1 0 296.798 3.744 20 5 CHBDRO CC(C)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1Cl ZINC001168984288 1129686892 /nfs/dbraw/zinc/68/68/92/1129686892.db2.gz LRKHAOFMMNDMTH-RYUDHWBXSA-N 1 0 296.798 3.610 20 5 CHBDRO Cc1cc([C@H](C)[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)ccc1Cl ZINC001168979897 1129686977 /nfs/dbraw/zinc/68/69/77/1129686977.db2.gz BZSKNKAKQLPCKX-OBJOEFQTSA-N 1 0 296.798 3.744 20 5 CHBDRO CCCCc1ccc(C[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001168965961 1129687539 /nfs/dbraw/zinc/68/75/39/1129687539.db2.gz FGMVWWHPUVXZEJ-DLBZAZTESA-N 1 0 290.407 3.564 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc2ccccc2c1 ZINC001168967494 1129687699 /nfs/dbraw/zinc/68/76/99/1129687699.db2.gz QENDDRUNGZJTCV-IYOUNJFTSA-N 1 0 298.386 3.936 20 5 CHBDRO CC(C)(C)C1CCC([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168968394 1129687814 /nfs/dbraw/zinc/68/78/14/1129687814.db2.gz YRYILSXOBWFOSK-URGYJCLVSA-N 1 0 282.428 3.626 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168985906 1129687967 /nfs/dbraw/zinc/68/79/67/1129687967.db2.gz VQJALAFOUIXEFT-MAZHCROVSA-N 1 0 294.370 3.702 20 5 CHBDRO CCCCc1ccc(C[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001168965964 1129687973 /nfs/dbraw/zinc/68/79/73/1129687973.db2.gz FGMVWWHPUVXZEJ-SJORKVTESA-N 1 0 290.407 3.564 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](CC2CC2)c2ccccc2)C1 ZINC001169000938 1129688415 /nfs/dbraw/zinc/68/84/15/1129688415.db2.gz ZSCRJIXFAGWCFW-DJIMGWMZSA-N 1 0 288.391 3.563 20 5 CHBDRO CC(C)C[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168971402 1129688721 /nfs/dbraw/zinc/68/87/21/1129688721.db2.gz KDUQFNSANIUTIV-XIRDDKMYSA-N 1 0 290.407 3.809 20 5 CHBDRO CCc1ccc([C@@H](CC)[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169005893 1129689038 /nfs/dbraw/zinc/68/90/38/1129689038.db2.gz VQAAZRRNSREIOO-HYVNUMGLSA-N 1 0 290.407 3.735 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCCC[C@@H]2c2ccccc2)C1 ZINC001169006017 1129689192 /nfs/dbraw/zinc/68/91/92/1129689192.db2.gz FIPBYULVNOJYAP-DJIMGWMZSA-N 1 0 288.391 3.659 20 5 CHBDRO C[N@H+](Cc1cccc2ccccc21)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169023258 1129691153 /nfs/dbraw/zinc/69/11/53/1129691153.db2.gz DVLVVPWEWHUEEV-PBHICJAKSA-N 1 0 298.386 3.717 20 5 CHBDRO CC(C)(C)CC(C)(C)Nc1cc2c(cc1[N+](=O)[O-])C[NH2+]C2 ZINC001169053477 1129693205 /nfs/dbraw/zinc/69/32/05/1129693205.db2.gz ZHPXGKVQRXDLLU-UHFFFAOYSA-N 1 0 291.395 3.825 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC001460192359 1129851885 /nfs/dbraw/zinc/85/18/85/1129851885.db2.gz FCAJKUNRHMLBEN-LBPRGKRZSA-N 1 0 264.369 3.914 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCC23CCC3)c1 ZINC000800482708 1129877521 /nfs/dbraw/zinc/87/75/21/1129877521.db2.gz XFWNAOHMEGYOEO-CYBMUJFWSA-N 1 0 280.755 3.671 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]2CCCC[C@H]12 ZINC000801539204 1129925845 /nfs/dbraw/zinc/92/58/45/1129925845.db2.gz CXSQAJBAXYGXFR-KYOSRNDESA-N 1 0 292.354 3.744 20 5 CHBDRO COc1cc([C@@H](C)[NH2+]Cc2ccsc2)cc([N+](=O)[O-])c1 ZINC000903068439 1130107971 /nfs/dbraw/zinc/10/79/71/1130107971.db2.gz FCPCXXKSDURZQG-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO CCO[C@H]1CCC[C@@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000903086279 1130110723 /nfs/dbraw/zinc/11/07/23/1130110723.db2.gz FRPXFOOLEKAFMI-MCIONIFRSA-N 1 0 292.379 3.593 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746657358 1130136560 /nfs/dbraw/zinc/13/65/60/1130136560.db2.gz GOUDJNJHNCVYOG-SNVBAGLBSA-N 1 0 270.760 3.869 20 5 CHBDRO C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@H]21)c1c(F)cccc1[N+](=O)[O-] ZINC000903318549 1130153167 /nfs/dbraw/zinc/15/31/67/1130153167.db2.gz QGHNSNOIDSAJAL-SBFPOUOMSA-N 1 0 278.327 3.573 20 5 CHBDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000903338541 1130161614 /nfs/dbraw/zinc/16/16/14/1130161614.db2.gz IQXNDGQYVOCLBT-SJKOYZFVSA-N 1 0 297.358 3.792 20 5 CHBDRO CCCCC[C@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788499892 1130191326 /nfs/dbraw/zinc/19/13/26/1130191326.db2.gz WZPOHLYVVWNOPY-RYUDHWBXSA-N 1 0 279.384 3.796 20 5 CHBDRO CC(C)C(C)(C)C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788758908 1130206416 /nfs/dbraw/zinc/20/64/16/1130206416.db2.gz SAVJGAQXMFGGKU-LLVKDONJSA-N 1 0 279.384 3.510 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000788740267 1130207973 /nfs/dbraw/zinc/20/79/73/1130207973.db2.gz QIHYXZOXGVNQTC-QWHCGFSZSA-N 1 0 299.374 3.631 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000788740265 1130208317 /nfs/dbraw/zinc/20/83/17/1130208317.db2.gz QIHYXZOXGVNQTC-OLZOCXBDSA-N 1 0 299.374 3.631 20 5 CHBDRO CC[C@H](C)C[N@H+](CC)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748829458 1130249300 /nfs/dbraw/zinc/24/93/00/1130249300.db2.gz ZNJQKUONKMUAJH-NSHDSACASA-N 1 0 268.332 3.602 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)CSC(C)(C)C)cccc1[N+](=O)[O-] ZINC000790694142 1130326104 /nfs/dbraw/zinc/32/61/04/1130326104.db2.gz GVELSKSFVWKUMS-LLVKDONJSA-N 1 0 296.436 3.913 20 5 CHBDRO COc1ccc(C[C@H](C)[NH2+]CCC(C)(C)C)c([N+](=O)[O-])c1 ZINC001170298985 1130476465 /nfs/dbraw/zinc/47/64/65/1130476465.db2.gz OYHIKKRTUSLPEG-LBPRGKRZSA-N 1 0 294.395 3.560 20 5 CHBDRO C(c1ccnc2c1ccc1cccnc12)=C1CC[NH2+]CC1 ZINC001240877878 1130499682 /nfs/dbraw/zinc/49/96/82/1130499682.db2.gz RBSCWHZJHRTRLI-UHFFFAOYSA-N 1 0 275.355 3.550 20 5 CHBDRO CC1(CC[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000793202172 1130526458 /nfs/dbraw/zinc/52/64/58/1130526458.db2.gz UKNCDNTUSGYJCU-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO CC[NH+](CC)C[C@H](C)Oc1cc(C)c([N+](=O)[O-])c(C)c1C ZINC001234871757 1130686731 /nfs/dbraw/zinc/68/67/31/1130686731.db2.gz MPQOJDBJJSUVGL-LBPRGKRZSA-N 1 0 294.395 3.629 20 5 CHBDRO CN(Cc1c2ccccc2cc2ccccc21)C[C@H]1CC[NH2+]1 ZINC001235962455 1130818852 /nfs/dbraw/zinc/81/88/52/1130818852.db2.gz KPIHYOHDAFSWEL-QGZVFWFLSA-N 1 0 290.410 3.787 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC(F)(F)C2)cc1Cl ZINC000783649959 1130844889 /nfs/dbraw/zinc/84/48/89/1130844889.db2.gz IBYLRBSMMIPPEA-SECBINFHSA-N 1 0 290.697 3.526 20 5 CHBDRO CC(C)(C)[C@@H]1CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000784515366 1130908225 /nfs/dbraw/zinc/90/82/25/1130908225.db2.gz IXYWBDZUENTPON-GFCCVEGCSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815584270 1131003712 /nfs/dbraw/zinc/00/37/12/1131003712.db2.gz ZHQPIKZOAMREKH-RYUDHWBXSA-N 1 0 291.395 3.796 20 5 CHBDRO C[C@@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815657487 1131013148 /nfs/dbraw/zinc/01/31/48/1131013148.db2.gz ZHJGBWCWHCKMEZ-LLVKDONJSA-N 1 0 291.395 3.654 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@H]2C2CC2)c1 ZINC000797905812 1131014724 /nfs/dbraw/zinc/01/47/24/1131014724.db2.gz PTSQKPPOHHVLLL-GXTWGEPZSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000799196888 1131075482 /nfs/dbraw/zinc/07/54/82/1131075482.db2.gz ZDHHDDIRPLAPKS-HIFRSBDPSA-N 1 0 297.358 3.540 20 5 CHBDRO C[C@@H]([NH2+]CC1(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000218028758 1131105244 /nfs/dbraw/zinc/10/52/44/1131105244.db2.gz ZIIFBFPMTURRDS-CQSZACIVSA-N 1 0 296.370 3.977 20 5 CHBDRO C[C@@H](F)CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816643707 1131117369 /nfs/dbraw/zinc/11/73/69/1131117369.db2.gz NVFHZNQOOZHAKS-SSDOTTSWSA-N 1 0 295.141 3.739 20 5 CHBDRO [NH3+]CCCCCCCOc1cc(Cl)ccc1[N+](=O)[O-] ZINC000818617512 1131218491 /nfs/dbraw/zinc/21/84/91/1131218491.db2.gz FNPXLAUYEQKHCF-UHFFFAOYSA-N 1 0 286.759 3.536 20 5 CHBDRO Cc1cc(Cl)cc(Cl)c1O[C@H](C)C[N+](C)(C)C ZINC001227722944 1131728060 /nfs/dbraw/zinc/72/80/60/1131728060.db2.gz OSUUYKOQCPUTRM-SNVBAGLBSA-N 1 0 277.215 3.775 20 5 CHBDRO CC[N@@H+]1CC[C@@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001227764359 1131740375 /nfs/dbraw/zinc/74/03/75/1131740375.db2.gz NSQOLWSGTUIROC-MRXNPFEDSA-N 1 0 292.382 3.861 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccccc1-c1ccccc1O ZINC001228046158 1131795264 /nfs/dbraw/zinc/79/52/64/1131795264.db2.gz GPFOENANTZIXIP-CQSZACIVSA-O 1 0 286.395 3.533 20 5 CHBDRO CC[N@@H+]1CC[C@@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001228176774 1131823213 /nfs/dbraw/zinc/82/32/13/1131823213.db2.gz RMBHEBNKBPEYAQ-MRXNPFEDSA-N 1 0 292.382 3.861 20 5 CHBDRO Cc1cc(O[C@H](C)C[N+](C)(C)C)ccc1C(C)C ZINC001228200703 1131828914 /nfs/dbraw/zinc/82/89/14/1131828914.db2.gz IQBVPTKZEWGTJK-CQSZACIVSA-N 1 0 250.406 3.592 20 5 CHBDRO Cc1c(C[N@@H+]2CCCC3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000348168968 1131898079 /nfs/dbraw/zinc/89/80/79/1131898079.db2.gz NTEPXRYFBZMARM-UHFFFAOYSA-N 1 0 274.364 3.669 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCC1CCC1)C1CC1 ZINC000773037296 1131926271 /nfs/dbraw/zinc/92/62/71/1131926271.db2.gz SJRSMKQMHKYHIU-MRXNPFEDSA-N 1 0 288.391 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1ccc[nH]1 ZINC000773117919 1131949477 /nfs/dbraw/zinc/94/94/77/1131949477.db2.gz MHESHHIYFIQJGY-NWDGAFQWSA-N 1 0 273.336 3.643 20 5 CHBDRO CCCCCCc1ccc(O)cc1O[C@@H](C)C[N+](C)(C)C ZINC001228850323 1131965751 /nfs/dbraw/zinc/96/57/51/1131965751.db2.gz KCCBVVQTGRJKAG-HNNXBMFYSA-O 1 0 294.459 3.989 20 5 CHBDRO C[C@@H]([NH2+]CC[C@H]1CCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000715753800 1131990776 /nfs/dbraw/zinc/99/07/76/1131990776.db2.gz KOGBIXCOERWQRQ-BXUZGUMPSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)(C)C ZINC001172899996 1132347447 /nfs/dbraw/zinc/34/74/47/1132347447.db2.gz RBICNVMNICDFER-SWLSCSKDSA-N 1 0 290.407 3.866 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1C=CCCC1)CC2 ZINC001172903131 1132347482 /nfs/dbraw/zinc/34/74/82/1132347482.db2.gz FFSVROCYICKUFB-JKSUJKDBSA-N 1 0 286.375 3.541 20 5 CHBDRO CCC(CC)[N@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172920990 1132362279 /nfs/dbraw/zinc/36/22/79/1132362279.db2.gz NGGWUMRTWLJPMZ-MRXNPFEDSA-N 1 0 290.407 3.963 20 5 CHBDRO C[C@@H]1CCCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909940 1132372236 /nfs/dbraw/zinc/37/22/36/1132372236.db2.gz VWLBNXCXZGKCPF-CZUORRHYSA-N 1 0 288.391 3.717 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001173222503 1132411402 /nfs/dbraw/zinc/41/14/02/1132411402.db2.gz SMLROWCUTQZBTF-BMFZPTHFSA-N 1 0 288.391 3.648 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C/C=C/c1ccccc1 ZINC001173214895 1132411654 /nfs/dbraw/zinc/41/16/54/1132411654.db2.gz RHCVWQWNQSPQOU-PXTSUWAFSA-N 1 0 296.370 3.829 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173219218 1132411912 /nfs/dbraw/zinc/41/19/12/1132411912.db2.gz ZFGLZXMSHULSNM-CHWSQXEVSA-N 1 0 264.369 3.550 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(CC2CC2)CC1 ZINC001173225044 1132412339 /nfs/dbraw/zinc/41/23/39/1132412339.db2.gz QPWARUIJNUQDFE-CYBMUJFWSA-N 1 0 288.391 3.696 20 5 CHBDRO CC(C)[NH+](C(C)C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225283 1132412779 /nfs/dbraw/zinc/41/27/79/1132412779.db2.gz JCXMELZBQUJRHX-CYBMUJFWSA-N 1 0 264.369 3.645 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCC12CCC2 ZINC001173229443 1132413800 /nfs/dbraw/zinc/41/38/00/1132413800.db2.gz VANYKMTWTBMOJZ-BBRMVZONSA-N 1 0 288.391 3.838 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233455 1132413842 /nfs/dbraw/zinc/41/38/42/1132413842.db2.gz WSAJJNBAMKFIAF-HIFRSBDPSA-N 1 0 276.380 3.790 20 5 CHBDRO Cc1cccc([C@@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001173231991 1132413850 /nfs/dbraw/zinc/41/38/50/1132413850.db2.gz BXZDICBYTFDADM-ZIAGYGMSSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC(c2ccccc2)C1 ZINC001173233204 1132413902 /nfs/dbraw/zinc/41/39/02/1132413902.db2.gz JNZRSLWHDQWPMM-CQSZACIVSA-N 1 0 296.370 3.625 20 5 CHBDRO CCC(CC)[N@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233996 1132413962 /nfs/dbraw/zinc/41/39/62/1132413962.db2.gz NTHYSCWDRDCIIV-GFCCVEGCSA-N 1 0 264.369 3.646 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC001173233052 1132413975 /nfs/dbraw/zinc/41/39/75/1132413975.db2.gz GVIMSCXHIPLRFB-CXAGYDPISA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccsc1 ZINC001173233727 1132414022 /nfs/dbraw/zinc/41/40/22/1132414022.db2.gz MSTYIOOFCUXUNV-GFCCVEGCSA-N 1 0 290.388 3.719 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)c1cccs1 ZINC001173211923 1132416279 /nfs/dbraw/zinc/41/62/79/1132416279.db2.gz VLASKHXTFCMBHM-RYUDHWBXSA-N 1 0 290.388 3.938 20 5 CHBDRO Cc1ccccc1C[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173213011 1132416583 /nfs/dbraw/zinc/41/65/83/1132416583.db2.gz CDRUQFWLRDYNEH-AWEZNQCLSA-N 1 0 284.359 3.624 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC001173211331 1132416788 /nfs/dbraw/zinc/41/67/88/1132416788.db2.gz ROIFNQRHROMOBZ-HNNXBMFYSA-N 1 0 298.386 3.932 20 5 CHBDRO CCCCCC[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173209621 1132416797 /nfs/dbraw/zinc/41/67/97/1132416797.db2.gz DNBHAQCTZBJAKC-ZDUSSCGKSA-N 1 0 264.369 3.696 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C[N@@H+]3C[C@H]4CC[C@@H]3C4)nc12 ZINC001232223520 1132438795 /nfs/dbraw/zinc/43/87/95/1132438795.db2.gz PMYKFZUEERNKMN-SUMWQHHRSA-N 1 0 289.382 3.767 20 5 CHBDRO FC1CC[NH+](Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001232218269 1132438925 /nfs/dbraw/zinc/43/89/25/1132438925.db2.gz FGMGLXFHCXDHCU-UHFFFAOYSA-N 1 0 295.361 3.717 20 5 CHBDRO c1ccc2nc3ccc(Nc4cc[nH+]cc4)cc3cc2c1 ZINC001173884632 1132625011 /nfs/dbraw/zinc/62/50/11/1132625011.db2.gz OLINRYWTEUBSPB-UHFFFAOYSA-N 1 0 271.323 3.949 20 5 CHBDRO CC[NH2+]Cc1cccc(Nc2cc([N+](=O)[O-])ccc2F)c1 ZINC001159955776 1132928435 /nfs/dbraw/zinc/92/84/35/1132928435.db2.gz MHECWRBVOLXNNC-UHFFFAOYSA-N 1 0 289.310 3.587 20 5 CHBDRO C[NH+](C)CCCCNc1ncnc2cc3ccccc3cc21 ZINC001161728081 1133021035 /nfs/dbraw/zinc/02/10/35/1133021035.db2.gz AHOMXJVWBJEKDB-UHFFFAOYSA-N 1 0 294.402 3.537 20 5 CHBDRO C[NH+](C)CCCCNc1ccc([N+](=O)[O-])c2ccccc12 ZINC001161730845 1133022458 /nfs/dbraw/zinc/02/24/58/1133022458.db2.gz SNBIDXJSGHRQBN-UHFFFAOYSA-N 1 0 287.363 3.502 20 5 CHBDRO CC(C)(C)c1ccc(N[C@H]2CCC[C@H]([NH3+])C2)c([N+](=O)[O-])c1 ZINC001162400303 1133075450 /nfs/dbraw/zinc/07/54/50/1133075450.db2.gz GVLAYHNEEKUXQS-STQMWFEESA-N 1 0 291.395 3.574 20 5 CHBDRO C[C@@H](C[NH+](C)C)Nc1nc2ccccc2c2ccccc21 ZINC001163787163 1133175693 /nfs/dbraw/zinc/17/56/93/1133175693.db2.gz ZRKFBVJUJQTNKF-ZDUSSCGKSA-N 1 0 279.387 3.750 20 5 CHBDRO Cc1c(C[N@@H+]2CC(C)(C)[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001206117076 1133660385 /nfs/dbraw/zinc/66/03/85/1133660385.db2.gz XSFWAGLTDDSJQH-OAHLLOKOSA-N 1 0 274.364 3.524 20 5 CHBDRO C[C@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)CCN1 ZINC001206389388 1133697258 /nfs/dbraw/zinc/69/72/58/1133697258.db2.gz RVAAPSUHRFLCEE-HNNXBMFYSA-N 1 0 290.410 3.787 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC001207152173 1133772056 /nfs/dbraw/zinc/77/20/56/1133772056.db2.gz ZGFXPUGATCOLRR-CVEARBPZSA-N 1 0 288.391 3.962 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@@H]3CCC[NH2+]CC3)cc2c1 ZINC001217995661 1135038727 /nfs/dbraw/zinc/03/87/27/1135038727.db2.gz RGDLEILIQCNNMD-MRXNPFEDSA-N 1 0 292.382 3.909 20 5 CHBDRO C[C@H]1C[C@H](Oc2nccc3c4ccccc4ccc32)CC[NH2+]1 ZINC001218061324 1135052680 /nfs/dbraw/zinc/05/26/80/1135052680.db2.gz PKNDFVVHIMRFFC-DZGCQCFKSA-N 1 0 292.382 3.907 20 5 CHBDRO c1ccc2cc3cc(O[C@H]4CC[NH2+]C4)ccc3cc2c1 ZINC001218181957 1135064479 /nfs/dbraw/zinc/06/44/79/1135064479.db2.gz IUKWMEVJXHOGSG-SFHVURJKSA-N 1 0 263.340 3.734 20 5 CHBDRO Cc1cc(C)c2ccc3cccc(O[C@H]4CC[NH2+]C4)c3c2n1 ZINC001218181025 1135064618 /nfs/dbraw/zinc/06/46/18/1135064618.db2.gz GSLCTPCDLGRICL-HNNXBMFYSA-N 1 0 292.382 3.746 20 5 CHBDRO C[C@@H]1[NH2+]C[C@@H]1Oc1c2ccccc2cc2ccccc21 ZINC001218385561 1135097403 /nfs/dbraw/zinc/09/74/03/1135097403.db2.gz HPTUBWQMTCPCLC-SJCJKPOMSA-N 1 0 263.340 3.732 20 5 CHBDRO Cc1cc(C)c2ccc3cccc(O[C@H]4C[NH2+][C@H]4C)c3c2n1 ZINC001218388159 1135097465 /nfs/dbraw/zinc/09/74/65/1135097465.db2.gz RQZBPUIRBJXLDR-GUYCJALGSA-N 1 0 292.382 3.744 20 5 CHBDRO C[C@H]1[NH2+]C[C@H]1Oc1c2ccccc2cc2ccccc21 ZINC001218385562 1135097717 /nfs/dbraw/zinc/09/77/17/1135097717.db2.gz HPTUBWQMTCPCLC-SJKOYZFVSA-N 1 0 263.340 3.732 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@H]3[C@@H]4CC[C@H]3[NH2+]C4)cc2c1 ZINC001218443811 1135107093 /nfs/dbraw/zinc/10/70/93/1135107093.db2.gz DVVWGRNYTQOYRD-OGWOLHLISA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@@H]1CC[NH2+]C[C@@H]1Oc1cccc2ccc3cccnc3c21 ZINC001218480971 1135113061 /nfs/dbraw/zinc/11/30/61/1135113061.db2.gz KLORAXFMKXOIGM-DYVFJYSZSA-N 1 0 292.382 3.765 20 5 CHBDRO C[N+](C)(C)CCOC1c2ccccc2CCc2ccccc21 ZINC001224773153 1135480252 /nfs/dbraw/zinc/48/02/52/1135480252.db2.gz FESNTRYWSFEIEC-UHFFFAOYSA-N 1 0 296.434 3.597 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCCCCCc1ccccc1 ZINC001224809454 1135485333 /nfs/dbraw/zinc/48/53/33/1135485333.db2.gz JERBLTDCRSEJNQ-INIZCTEOSA-N 1 0 264.433 3.511 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc(Nc2ccccc2)c1 ZINC001225232856 1135521002 /nfs/dbraw/zinc/52/10/02/1135521002.db2.gz XMGNKPMAPBXEEB-HNNXBMFYSA-N 1 0 285.411 3.904 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccccc1Oc1ccccc1 ZINC001225508465 1135579902 /nfs/dbraw/zinc/57/99/02/1135579902.db2.gz AOJKAOKIXKXSPY-OAHLLOKOSA-N 1 0 286.395 3.952 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(OC2CC[NH+](C(C)(C)C)CC2)c1 ZINC001225682958 1135608711 /nfs/dbraw/zinc/60/87/11/1135608711.db2.gz NSHIWWBVQJAWMT-UHFFFAOYSA-N 1 0 292.379 3.545 20 5 CHBDRO Cc1ccc2ccccc2c1O[C@H](C)C[N+](C)(C)C ZINC001226816672 1135745300 /nfs/dbraw/zinc/74/53/00/1135745300.db2.gz SUTGRTRONGFNJK-CQSZACIVSA-N 1 0 258.385 3.622 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(-c2ccc(O)cc2)cc1 ZINC001226861501 1135751672 /nfs/dbraw/zinc/75/16/72/1135751672.db2.gz BVBQBXWIQNYBKV-AWEZNQCLSA-O 1 0 286.395 3.533 20 5 CHBDRO CC[N@@H+]1CC[C@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001226991569 1135771929 /nfs/dbraw/zinc/77/19/29/1135771929.db2.gz BMUXKRTZSUHHLU-AWEZNQCLSA-N 1 0 292.382 3.861 20 5 CHBDRO CCC[C@H]([NH2+]CCC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000088454661 260232784 /nfs/dbraw/zinc/23/27/84/260232784.db2.gz OPXVRNVWXSPNGL-HNNXBMFYSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@H]1CCCC[C@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000104323362 185968802 /nfs/dbraw/zinc/96/88/02/185968802.db2.gz JAAOGAJWCBSQSZ-GXFFZTMASA-N 1 0 282.771 3.917 20 5 CHBDRO CC(C)CC[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000020122975 171003403 /nfs/dbraw/zinc/00/34/03/171003403.db2.gz RNAPNFKZVZOVET-LBPRGKRZSA-N 1 0 250.342 3.509 20 5 CHBDRO Cc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000020134502 171022649 /nfs/dbraw/zinc/02/26/49/171022649.db2.gz GNTUDXUVMRLHIE-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCOCC(C)C)cc1[N+](=O)[O-] ZINC000020147378 171033899 /nfs/dbraw/zinc/03/38/99/171033899.db2.gz HNQIFNNGJNUBDB-CQSZACIVSA-N 1 0 294.395 3.617 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(Cl)cc2)c1 ZINC000020209911 171074363 /nfs/dbraw/zinc/07/43/63/171074363.db2.gz AEGCRGRQWLNPBQ-UHFFFAOYSA-N 1 0 276.723 3.538 20 5 CHBDRO CC(C)[NH+](CCNc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000021789762 171323322 /nfs/dbraw/zinc/32/33/22/171323322.db2.gz WXZDLFKZTPSBMC-UHFFFAOYSA-N 1 0 299.802 3.779 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000035307950 172120765 /nfs/dbraw/zinc/12/07/65/172120765.db2.gz XYYHGYUGJCLFFR-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000035737036 172390621 /nfs/dbraw/zinc/39/06/21/172390621.db2.gz PBCQXXIEFRUGTJ-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO C[C@@H]1C[C@H](C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000037403646 173180037 /nfs/dbraw/zinc/18/00/37/173180037.db2.gz FYBDOAZIZPKZET-PHIMTYICSA-N 1 0 282.771 3.726 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCCc2occc2C1 ZINC000344313827 225024414 /nfs/dbraw/zinc/02/44/14/225024414.db2.gz YILIBNHGSWTGNE-GFCCVEGCSA-N 1 0 286.331 3.697 20 5 CHBDRO Cc1cccc(NCCc2ccc(Cl)cc2[N+](=O)[O-])[nH+]1 ZINC000354861732 227178652 /nfs/dbraw/zinc/17/86/52/227178652.db2.gz QTSPQOSFOWZIAE-UHFFFAOYSA-N 1 0 291.738 3.606 20 5 CHBDRO CCC1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000447587886 260066379 /nfs/dbraw/zinc/06/63/79/260066379.db2.gz SGOCDOSUGUSTPA-OAHLLOKOSA-N 1 0 274.364 3.752 20 5 CHBDRO Cc1ccccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000037488632 260110156 /nfs/dbraw/zinc/11/01/56/260110156.db2.gz XPJSJEYYQLKUJQ-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](CC)[C@H](O)CC)c1cccc([N+](=O)[O-])c1 ZINC000313163686 260255529 /nfs/dbraw/zinc/25/55/29/260255529.db2.gz RSVVMODHZFYUSR-HRCADAONSA-N 1 0 294.395 3.575 20 5 CHBDRO CC(C)[N@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000158701642 261169432 /nfs/dbraw/zinc/16/94/32/261169432.db2.gz QBFKJNPJYVFKJI-UHFFFAOYSA-N 1 0 291.376 3.559 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000185942881 262072716 /nfs/dbraw/zinc/07/27/16/262072716.db2.gz BUPVSYNDVZGIKP-MRXNPFEDSA-N 1 0 285.347 3.621 20 5 CHBDRO Cc1nc(C)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000119887121 262174173 /nfs/dbraw/zinc/17/41/73/262174173.db2.gz AMRYMEHZIMZEBO-SECBINFHSA-N 1 0 291.376 3.519 20 5 CHBDRO CSCCCCC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000186781674 262323628 /nfs/dbraw/zinc/32/36/28/262323628.db2.gz SHVCUZXPFJSDIZ-GFCCVEGCSA-N 1 0 282.409 3.779 20 5 CHBDRO CC1CCC(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000058872547 262385129 /nfs/dbraw/zinc/38/51/29/262385129.db2.gz LSTILHTUQLKWEN-UHFFFAOYSA-N 1 0 262.353 3.511 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000088747817 262663441 /nfs/dbraw/zinc/66/34/41/262663441.db2.gz BMRXYPVWDAORTB-JSGCOSHPSA-N 1 0 260.337 3.663 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000280756432 263064141 /nfs/dbraw/zinc/06/41/41/263064141.db2.gz CEUCLJYDCWKKHB-GHMZBOCLSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000284047757 263085580 /nfs/dbraw/zinc/08/55/80/263085580.db2.gz KCGOVUWJIZJVNM-VXGBXAGGSA-N 1 0 285.347 3.589 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000289751787 263111901 /nfs/dbraw/zinc/11/19/01/263111901.db2.gz JECKEZZDGHNIJH-QGZVFWFLSA-N 1 0 297.358 3.635 20 5 CHBDRO CC(C)c1ccc(CNc2ccc(C[NH3+])cc2)cc1[N+](=O)[O-] ZINC000414907029 263113492 /nfs/dbraw/zinc/11/34/92/263113492.db2.gz CYSIACWGZXTJPZ-UHFFFAOYSA-N 1 0 299.374 3.789 20 5 CHBDRO CC1(C)CCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000094324584 265236898 /nfs/dbraw/zinc/23/68/98/265236898.db2.gz VNIGUHAJEWLWQE-ZDUSSCGKSA-N 1 0 282.771 3.917 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1cc(C)ccc1[N+](=O)[O-] ZINC000094659347 265248687 /nfs/dbraw/zinc/24/86/87/265248687.db2.gz GDHILRNPUUNJHM-CQSZACIVSA-N 1 0 293.411 3.826 20 5 CHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000519001674 265289167 /nfs/dbraw/zinc/28/91/67/265289167.db2.gz MOAGPHGKKHPOTJ-OCCSQVGLSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000388759627 328300583 /nfs/dbraw/zinc/30/05/83/328300583.db2.gz DLVPKPCASIBTPS-JMSVASOKSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ncc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000123698216 328305696 /nfs/dbraw/zinc/30/56/96/328305696.db2.gz QEWRSCYJCGHETG-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCc3c2cccc3F)c1 ZINC000111158734 328328264 /nfs/dbraw/zinc/32/82/64/328328264.db2.gz GYAKOHOFWSYDDO-MRXNPFEDSA-N 1 0 286.306 3.511 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000049127204 328341494 /nfs/dbraw/zinc/34/14/94/328341494.db2.gz FTHMRHNOXBBTCG-JSGCOSHPSA-N 1 0 264.369 3.988 20 5 CHBDRO Cc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000049963460 328379974 /nfs/dbraw/zinc/37/99/74/328379974.db2.gz ZXYWGKTXIAEHCR-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO C[C@@H](CC[NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000050015653 328381742 /nfs/dbraw/zinc/38/17/42/328381742.db2.gz NUDYFOAWFXQKEO-AWEZNQCLSA-N 1 0 284.359 3.878 20 5 CHBDRO CCC[C@H](CC)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000050401967 328437787 /nfs/dbraw/zinc/43/77/87/328437787.db2.gz JXGSSZKNMAKPLO-ZDUSSCGKSA-N 1 0 250.342 3.572 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(F)cc1 ZINC000584183177 327062120 /nfs/dbraw/zinc/06/21/20/327062120.db2.gz XTBXQSIUAUVMTG-HNNXBMFYSA-N 1 0 286.306 3.511 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000558423452 327093036 /nfs/dbraw/zinc/09/30/36/327093036.db2.gz KENCZLMPRQVYSE-UHFFFAOYSA-N 1 0 298.333 3.913 20 5 CHBDRO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089511930 327170676 /nfs/dbraw/zinc/17/06/76/327170676.db2.gz HGSGWBCLDCPKTA-PXAZEXFGSA-N 1 0 282.343 3.618 20 5 CHBDRO C[C@@H](C[NH+]1CCCCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000047873378 327216311 /nfs/dbraw/zinc/21/63/11/327216311.db2.gz TYOYZNUSLGGCBQ-NSHDSACASA-N 1 0 297.786 3.535 20 5 CHBDRO CC(C)(C)CC(C)(C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000043434697 328787794 /nfs/dbraw/zinc/78/77/94/328787794.db2.gz WUQSAQNBNNIJJL-UHFFFAOYSA-N 1 0 294.395 3.778 20 5 CHBDRO Cc1ccc(C[NH2+]CCC2CCCCC2)cc1[N+](=O)[O-] ZINC000037501063 328805182 /nfs/dbraw/zinc/80/51/82/328805182.db2.gz CTTSCOPVHRURBF-UHFFFAOYSA-N 1 0 276.380 3.963 20 5 CHBDRO Cc1cc(NC2CC[NH+](C(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000301080053 328826185 /nfs/dbraw/zinc/82/61/85/328826185.db2.gz JQHKJQNFPKOYDC-UHFFFAOYSA-N 1 0 291.395 3.578 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC1(C)C ZINC000582550693 329106124 /nfs/dbraw/zinc/10/61/24/329106124.db2.gz WAMCNBCCYRKXOX-WFASDCNBSA-N 1 0 276.380 3.694 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@H](F)C1)CCC2 ZINC000582785847 329195243 /nfs/dbraw/zinc/19/52/43/329195243.db2.gz RCDJLCGESUEKLR-HEHGZKQESA-N 1 0 292.354 3.843 20 5 CHBDRO CC1=C[C@@H](C)C[C@H](C[NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000583901331 329530887 /nfs/dbraw/zinc/53/08/87/329530887.db2.gz YIKQYMNAVCUTKH-HIFRSBDPSA-N 1 0 288.391 3.719 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC1CCCC1 ZINC000509617236 332875272 /nfs/dbraw/zinc/87/52/72/332875272.db2.gz JPQQLMTWYWOHFK-UHFFFAOYSA-N 1 0 292.379 3.663 20 5 CHBDRO CC(C)[C@@H]1CC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000445428460 330216091 /nfs/dbraw/zinc/21/60/91/330216091.db2.gz WJGOQIDUDYUYKD-TZMCWYRMSA-N 1 0 262.353 3.634 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000396960222 330232084 /nfs/dbraw/zinc/23/20/84/330232084.db2.gz ZBFRCUJBSYEVJV-ZJUUUORDSA-N 1 0 290.285 3.834 20 5 CHBDRO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000527238489 330240591 /nfs/dbraw/zinc/24/05/91/330240591.db2.gz FPHXHJSRIYSFKY-VXGBXAGGSA-N 1 0 286.331 3.838 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(Cl)cc2)cc1 ZINC000035677688 330249204 /nfs/dbraw/zinc/24/92/04/330249204.db2.gz CNDZMTSBGMJAIJ-UHFFFAOYSA-N 1 0 290.750 3.581 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CC1(C)C ZINC000536866045 330251637 /nfs/dbraw/zinc/25/16/37/330251637.db2.gz XLVAVVAGRBKPRM-TZMCWYRMSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]([NH2+][C@@H]1C[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000044674733 330331800 /nfs/dbraw/zinc/33/18/00/330331800.db2.gz SPORMIBUECNTQT-JCURWCKSSA-N 1 0 282.343 3.802 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424284392 330334071 /nfs/dbraw/zinc/33/40/71/330334071.db2.gz CKBJZBOXFWIVPE-RCBQFDQVSA-N 1 0 288.391 3.552 20 5 CHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CC23CC3)c2ccccc2)c1 ZINC000424325726 330341122 /nfs/dbraw/zinc/34/11/22/330341122.db2.gz OIXIOHNIDAMCOF-IAGOWNOFSA-N 1 0 294.354 3.826 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC13CC3)CCCC2 ZINC000424327440 330341614 /nfs/dbraw/zinc/34/16/14/330341614.db2.gz PXYLVVXBFRYWMU-CABCVRRESA-N 1 0 272.348 3.504 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000045628955 330347252 /nfs/dbraw/zinc/34/72/52/330347252.db2.gz UHJFSPXINQJODJ-KBPBESRZSA-N 1 0 274.364 3.910 20 5 CHBDRO CC(C)C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000533243808 330355017 /nfs/dbraw/zinc/35/50/17/330355017.db2.gz BSBNZIFFHADYRD-UHFFFAOYSA-N 1 0 264.369 3.504 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(CC)CC2)cc1[N+](=O)[O-] ZINC000536909192 330364750 /nfs/dbraw/zinc/36/47/50/330364750.db2.gz IPZROSUSVSOPKP-LBPRGKRZSA-N 1 0 292.379 3.834 20 5 CHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000123116000 330443510 /nfs/dbraw/zinc/44/35/10/330443510.db2.gz OYFDXFKDOPVVRH-NOLJZWGESA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@@H]1C[C@H]1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433161405 330618548 /nfs/dbraw/zinc/61/85/48/330618548.db2.gz RGMOXPFYIXQSRN-ZETOZRRWSA-N 1 0 274.364 3.563 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000434774853 330644884 /nfs/dbraw/zinc/64/48/84/330644884.db2.gz IOMXWKHOYRRFJN-DOMZBBRYSA-N 1 0 276.380 3.552 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC=CCC1)CCC2 ZINC000447562761 330870206 /nfs/dbraw/zinc/87/02/06/330870206.db2.gz MWGKNFNGUUWVGS-SUMWQHHRSA-N 1 0 286.375 3.918 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447597376 330872837 /nfs/dbraw/zinc/87/28/37/330872837.db2.gz FGHLPYCLBCPKIJ-AXAPSJFSSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000449189123 330905020 /nfs/dbraw/zinc/90/50/20/330905020.db2.gz OXDLRBDTLATWEU-DGCLKSJQSA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCC1(F)F ZINC000449491018 330930573 /nfs/dbraw/zinc/93/05/73/330930573.db2.gz DUSMHBOVERGBCZ-AAEUAGOBSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccncc1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000449523172 330933862 /nfs/dbraw/zinc/93/38/62/330933862.db2.gz LBVFDHCQXNFGEF-UHFFFAOYSA-N 1 0 299.374 3.711 20 5 CHBDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000163413190 331036941 /nfs/dbraw/zinc/03/69/41/331036941.db2.gz UAHWSILCRIAMCM-JTQLQIEISA-N 1 0 290.285 3.806 20 5 CHBDRO CC[C@H](C)[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)OC ZINC000453267046 331109199 /nfs/dbraw/zinc/10/91/99/331109199.db2.gz LOLADXKATPCOGW-NORZTCDRSA-N 1 0 294.395 3.615 20 5 CHBDRO CC[C@H](C)[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)OC ZINC000453267044 331109241 /nfs/dbraw/zinc/10/92/41/331109241.db2.gz LOLADXKATPCOGW-DETPVDSQSA-N 1 0 294.395 3.615 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccc(C)cn1)c1cccc([N+](=O)[O-])c1 ZINC000453427154 331131138 /nfs/dbraw/zinc/13/11/38/331131138.db2.gz OOVDQEHQVJAOSI-QGZVFWFLSA-N 1 0 299.374 3.582 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000195651200 331179421 /nfs/dbraw/zinc/17/94/21/331179421.db2.gz DFHPFJAFGUOIAS-YJBOKZPZSA-N 1 0 296.370 3.975 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463483690 331348432 /nfs/dbraw/zinc/34/84/32/331348432.db2.gz ZJSNLCGEBLJGKP-GFCCVEGCSA-N 1 0 296.342 3.507 20 5 CHBDRO C[C@@H]1CC[C@H](C)[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000464822213 331369696 /nfs/dbraw/zinc/36/96/96/331369696.db2.gz KXGIUFYLDKHJPN-MNOVXSKESA-N 1 0 282.771 3.869 20 5 CHBDRO CCC[C@@H](C)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000466463877 331397664 /nfs/dbraw/zinc/39/76/64/331397664.db2.gz PAHCNRSOQSKPPZ-SNVBAGLBSA-N 1 0 270.760 3.774 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000467997648 331426431 /nfs/dbraw/zinc/42/64/31/331426431.db2.gz DVZZNIMNSMVOOO-STQMWFEESA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H]1CC[C@@H](C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000475547651 331636297 /nfs/dbraw/zinc/63/62/97/331636297.db2.gz KODDWAYZJRHWRC-GNXSNYGWSA-N 1 0 274.364 3.634 20 5 CHBDRO COc1cc(C[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000481196789 331800749 /nfs/dbraw/zinc/80/07/49/331800749.db2.gz XOBIKZPWANICIJ-MBNYWOFBSA-N 1 0 292.379 3.518 20 5 CHBDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CS1 ZINC000488531275 332015927 /nfs/dbraw/zinc/01/59/27/332015927.db2.gz LOTIGXQWBDBPPR-JSGCOSHPSA-N 1 0 294.420 3.605 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1C[C@H](C)[C@@H](C)C1 ZINC000490036532 332077747 /nfs/dbraw/zinc/07/77/47/332077747.db2.gz FVJOFTXDIRHTCX-AVGNSLFASA-N 1 0 262.353 3.552 20 5 CHBDRO C[C@@H]([NH2+]C1CC(OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000490131095 332082358 /nfs/dbraw/zinc/08/23/58/332082358.db2.gz SQVMXNDGRYLBFK-NUYPLMSZSA-N 1 0 292.379 3.592 20 5 CHBDRO CCC1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000490383452 332087986 /nfs/dbraw/zinc/08/79/86/332087986.db2.gz ZASBXESDBLFTKX-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)C(C)C ZINC000491090291 332147792 /nfs/dbraw/zinc/14/77/92/332147792.db2.gz OJEMHNRJMYWXCI-NSHDSACASA-N 1 0 268.332 3.600 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)C(C)C ZINC000491090290 332147841 /nfs/dbraw/zinc/14/78/41/332147841.db2.gz OJEMHNRJMYWXCI-LLVKDONJSA-N 1 0 268.332 3.600 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CC(F)(F)C1 ZINC000491589209 332241776 /nfs/dbraw/zinc/24/17/76/332241776.db2.gz OUYYCFSZWQAWNW-WZUFQYTHSA-N 1 0 296.317 3.633 20 5 CHBDRO CC[C@H](C)C[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492278553 332390143 /nfs/dbraw/zinc/39/01/43/332390143.db2.gz WMIKGBCDNYFBQP-JTQLQIEISA-N 1 0 270.760 3.726 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000575790861 335115255 /nfs/dbraw/zinc/11/52/55/335115255.db2.gz SXXAANNGXMSNOE-GFCCVEGCSA-N 1 0 250.342 3.605 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1CC12CCCC2 ZINC000517173030 333094018 /nfs/dbraw/zinc/09/40/18/333094018.db2.gz POXNNIRFVXIGJW-HIFRSBDPSA-N 1 0 272.348 3.504 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CC12CCCC2 ZINC000517173031 333094120 /nfs/dbraw/zinc/09/41/20/333094120.db2.gz POXNNIRFVXIGJW-UKRRQHHQSA-N 1 0 272.348 3.504 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000182842707 333117786 /nfs/dbraw/zinc/11/77/86/333117786.db2.gz LCKGTBWBHRWFFD-MELADBBJSA-N 1 0 274.364 3.696 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC2(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000222220760 333177329 /nfs/dbraw/zinc/17/73/29/333177329.db2.gz ZQLHCSNXEBKXIF-CYBMUJFWSA-N 1 0 276.380 3.990 20 5 CHBDRO C[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000222786369 333200015 /nfs/dbraw/zinc/20/00/15/333200015.db2.gz KWPODCPXBZMVME-BDAKNGLRSA-N 1 0 276.258 3.586 20 5 CHBDRO COc1ccc(C[NH2+]C[C@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000223449309 333208072 /nfs/dbraw/zinc/20/80/72/333208072.db2.gz SZGMZCULASPXBA-STQMWFEESA-N 1 0 292.379 3.519 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCCC1CCCC1 ZINC000227435838 333282700 /nfs/dbraw/zinc/28/27/00/333282700.db2.gz ADLUIIZCIAWSBG-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000230407420 333317577 /nfs/dbraw/zinc/31/75/77/333317577.db2.gz PPAJKYDFROFXBF-JHJVBQTASA-N 1 0 262.353 3.682 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCCc3occc32)cccc1[N+](=O)[O-] ZINC000231884082 333331079 /nfs/dbraw/zinc/33/10/79/333331079.db2.gz WHXHKGLULHLJHF-AWEZNQCLSA-N 1 0 286.331 3.663 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000523701358 333339910 /nfs/dbraw/zinc/33/99/10/333339910.db2.gz GRUKMUTUIHUDSL-QGZVFWFLSA-N 1 0 296.370 3.584 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 ZINC000523701357 333340066 /nfs/dbraw/zinc/34/00/66/333340066.db2.gz GRUKMUTUIHUDSL-KRWDZBQOSA-N 1 0 296.370 3.584 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000524766732 333387293 /nfs/dbraw/zinc/38/72/93/333387293.db2.gz NKOAZLPAOGNKJN-OAHLLOKOSA-N 1 0 262.353 3.607 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000524766830 333387311 /nfs/dbraw/zinc/38/73/11/333387311.db2.gz PXHLPEOQKNFTAX-OAHLLOKOSA-N 1 0 262.353 3.607 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CS[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000397812197 333429328 /nfs/dbraw/zinc/42/93/28/333429328.db2.gz GUTQXQRWQSKCDG-LNSITVRQSA-N 1 0 294.420 3.920 20 5 CHBDRO CCC1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000037668264 333536008 /nfs/dbraw/zinc/53/60/08/333536008.db2.gz HWIWJMUEQGUOFS-UHFFFAOYSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1ccsc1CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000538116346 333574860 /nfs/dbraw/zinc/57/48/60/333574860.db2.gz LGEHRWOKAYQAOR-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000538194778 333578504 /nfs/dbraw/zinc/57/85/04/333578504.db2.gz PJEHUAZZTIVTPZ-VXGBXAGGSA-N 1 0 282.409 3.695 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1C[C@H](C)S[C@@H](C)C1 ZINC000538709414 333613078 /nfs/dbraw/zinc/61/30/78/333613078.db2.gz IFYUSMBOHYSBDO-AVGNSLFASA-N 1 0 294.420 3.790 20 5 CHBDRO C[C@@H]([NH2+]C1CCC(F)(F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000540153868 333713820 /nfs/dbraw/zinc/71/38/20/333713820.db2.gz IJQNJQXPEKIOME-SNVBAGLBSA-N 1 0 284.306 3.823 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000540165118 333716722 /nfs/dbraw/zinc/71/67/22/333716722.db2.gz VPZQEOCOCHIWCW-PWSUYJOCSA-N 1 0 284.306 3.823 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000129469872 333767524 /nfs/dbraw/zinc/76/75/24/333767524.db2.gz KRRXVKMXHRNBSN-YPMHNXCESA-N 1 0 262.353 3.824 20 5 CHBDRO CSCCCC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000131497235 333944291 /nfs/dbraw/zinc/94/42/91/333944291.db2.gz QFZTZVGLVGFYDW-GFCCVEGCSA-N 1 0 282.409 3.697 20 5 CHBDRO CCC[C@@H](C)C[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000547284848 334076055 /nfs/dbraw/zinc/07/60/55/334076055.db2.gz OJBNCNGACYXDDE-GFCCVEGCSA-N 1 0 264.369 3.856 20 5 CHBDRO C[C@@H]1CCCCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000547931336 334129782 /nfs/dbraw/zinc/12/97/82/334129782.db2.gz JZHYRYDFUNLXLB-DNGMOHDESA-N 1 0 274.364 3.873 20 5 CHBDRO CCSCC[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000135471871 334131028 /nfs/dbraw/zinc/13/10/28/334131028.db2.gz YKOUMWREMDSQEG-RYUDHWBXSA-N 1 0 282.409 3.777 20 5 CHBDRO CC1(C)CCC([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000079654063 334159405 /nfs/dbraw/zinc/15/94/05/334159405.db2.gz AFIDAQZBQQHHDN-UHFFFAOYSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H](c1ccccc1)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549169003 334186888 /nfs/dbraw/zinc/18/68/88/334186888.db2.gz RHAQRJOAGARZML-AWEZNQCLSA-N 1 0 284.359 3.830 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCC[C@H](C2CC2)C1 ZINC000081638240 334201605 /nfs/dbraw/zinc/20/16/05/334201605.db2.gz BDBXVWQFIOGXBO-DZGCQCFKSA-N 1 0 274.364 3.653 20 5 CHBDRO C[N@@H+]1CCCC[C@@H]1CCSc1cccc([N+](=O)[O-])c1 ZINC000551462279 334250987 /nfs/dbraw/zinc/25/09/87/334250987.db2.gz ZZSSFOJSBSTPHH-GFCCVEGCSA-N 1 0 280.393 3.561 20 5 CHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000551825325 334263676 /nfs/dbraw/zinc/26/36/76/334263676.db2.gz FBRMESFVOCPZFW-VQHVLOKHSA-N 1 0 274.364 3.873 20 5 CHBDRO CC(C)[C@H]1CC[C@@H]1[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000552275333 334311481 /nfs/dbraw/zinc/31/14/81/334311481.db2.gz RTDHVHWBAIQMOM-SCRDCRAPSA-N 1 0 262.353 3.680 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCSC[C@@H](C)C1 ZINC000248943687 334322264 /nfs/dbraw/zinc/32/22/64/334322264.db2.gz AEEIOIUADBJOLX-WCQYABFASA-N 1 0 294.420 3.649 20 5 CHBDRO CC(C)C(C)(C)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000553434250 334384938 /nfs/dbraw/zinc/38/49/38/334384938.db2.gz SCPIDILESGBFNQ-VQHVLOKHSA-N 1 0 262.353 3.632 20 5 CHBDRO CC[C@H]1CC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000554108437 334412634 /nfs/dbraw/zinc/41/26/34/334412634.db2.gz FAKBHJSPWUMVMS-HOCLYGCPSA-N 1 0 276.380 3.696 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)CC2CC2)cc1[N+](=O)[O-] ZINC000153764196 334679069 /nfs/dbraw/zinc/67/90/69/334679069.db2.gz ICFPZCFQEITOSU-VXGBXAGGSA-N 1 0 292.379 3.833 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000271462850 334743788 /nfs/dbraw/zinc/74/37/88/334743788.db2.gz HQONWEZNRXQCCG-INWMFGNUSA-N 1 0 292.379 3.593 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000575010873 334826009 /nfs/dbraw/zinc/82/60/09/334826009.db2.gz DXGKCDLXVHPPNF-DGCLKSJQSA-N 1 0 292.379 3.690 20 5 CHBDRO CC[C@H](C)[C@H](C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)OC ZINC000381185874 336053944 /nfs/dbraw/zinc/05/39/44/336053944.db2.gz SBVYXXBSMHGDBY-RBOXIYTFSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000387189696 336187731 /nfs/dbraw/zinc/18/77/31/336187731.db2.gz WFFZHIIMXKJSHC-FZMZJTMJSA-N 1 0 260.337 3.578 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C1CCCCCCC1 ZINC000020046422 518203177 /nfs/dbraw/zinc/20/31/77/518203177.db2.gz YZUBKEXQTDGYPR-UHFFFAOYSA-N 1 0 262.353 3.797 20 5 CHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353878479 533823576 /nfs/dbraw/zinc/82/35/76/533823576.db2.gz DEXKCVKVDVTXOY-WDEREUQCSA-N 1 0 268.382 3.667 20 5 CHBDRO Cc1cc2cc(C[NH2+]Cc3cccc([N+](=O)[O-])c3)ccc2[nH]1 ZINC000353123256 534091047 /nfs/dbraw/zinc/09/10/47/534091047.db2.gz HYUKBTZCWYEADK-UHFFFAOYSA-N 1 0 295.342 3.674 20 5 CHBDRO CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H](C)c1cccnc1 ZINC000290535798 521304501 /nfs/dbraw/zinc/30/45/01/521304501.db2.gz QWUDSMCHOUCRLM-CQSZACIVSA-N 1 0 299.374 3.881 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000051626676 522657481 /nfs/dbraw/zinc/65/74/81/522657481.db2.gz RQIUJOSSWKRVRA-INIZCTEOSA-N 1 0 270.332 3.836 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1cccnc1 ZINC000158576835 524251621 /nfs/dbraw/zinc/25/16/21/524251621.db2.gz ZLMMTSKEGLKHAI-KGLIPLIRSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000357006221 524295379 /nfs/dbraw/zinc/29/53/79/524295379.db2.gz AHFBUULOSYVOJV-ZDUSSCGKSA-N 1 0 274.364 3.607 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000357006219 524512945 /nfs/dbraw/zinc/51/29/45/524512945.db2.gz AHFBUULOSYVOJV-CYBMUJFWSA-N 1 0 274.364 3.607 20 5 CHBDRO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1CCCCC1 ZINC000052334117 525482286 /nfs/dbraw/zinc/48/22/86/525482286.db2.gz QTACDCUOTGTXFV-JTQLQIEISA-N 1 0 268.382 3.715 20 5 CHBDRO CSC[C@H]1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000292453505 525708428 /nfs/dbraw/zinc/70/84/28/525708428.db2.gz PQTBXNRCVVKRHP-OLZOCXBDSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)s1 ZINC000049161766 525735677 /nfs/dbraw/zinc/73/56/77/525735677.db2.gz LLQMXDDYLFIPBN-SECBINFHSA-N 1 0 282.390 3.877 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCCCF)cc1[N+](=O)[O-] ZINC000284268550 525918964 /nfs/dbraw/zinc/91/89/64/525918964.db2.gz XIXBCPWWGSEQQS-LBPRGKRZSA-N 1 0 268.332 3.694 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCC(F)(F)F)cc1[N+](=O)[O-] ZINC000063099219 525920886 /nfs/dbraw/zinc/92/08/86/525920886.db2.gz LNWYCBQNUAIKKP-VIFPVBQESA-N 1 0 276.258 3.506 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000037668233 525927388 /nfs/dbraw/zinc/92/73/88/525927388.db2.gz AVXHZZRLEGPVBV-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCc2sccc21 ZINC000061329262 527400773 /nfs/dbraw/zinc/40/07/73/527400773.db2.gz SDHFXHUIEQTZJE-ZDUSSCGKSA-N 1 0 288.372 3.824 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccccn1 ZINC000347382315 527529328 /nfs/dbraw/zinc/52/93/28/527529328.db2.gz UYVHGUYXPAFLBP-GXDHUFHOSA-N 1 0 297.358 3.525 20 5 CHBDRO CC1(C)CCC[C@H]1[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000149210264 1125462245 /nfs/dbraw/zinc/46/22/45/1125462245.db2.gz XRASEZZYRBPYKV-CYBMUJFWSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1c(C[N@H+]2C[C@H](C)CC2(C)C)cccc1[N+](=O)[O-] ZINC000472276854 1119280280 /nfs/dbraw/zinc/28/02/80/1119280280.db2.gz LOLLRCXQBLCTRK-LLVKDONJSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113312363 1125494142 /nfs/dbraw/zinc/49/41/42/1125494142.db2.gz BUYOFCSPIKMGHI-SNVBAGLBSA-N 1 0 291.376 3.606 20 5 CHBDRO CC[C@H]([NH2+]CCc1ncccc1C)c1cccc([N+](=O)[O-])c1 ZINC000296415598 1125585651 /nfs/dbraw/zinc/58/56/51/1125585651.db2.gz LCSGCMMRWJGXKC-INIZCTEOSA-N 1 0 299.374 3.582 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[NH2+][C@H](CC1CC1)c1ccccc1 ZINC000886112406 1125651481 /nfs/dbraw/zinc/65/14/81/1125651481.db2.gz XKLMWFPCCFETHY-MRXNPFEDSA-N 1 0 297.358 3.621 20 5 CHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1(C2CC2)CCC1 ZINC000886824553 1125721249 /nfs/dbraw/zinc/72/12/49/1125721249.db2.gz BODRMJQUNNEMSW-LLVKDONJSA-N 1 0 292.354 3.587 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]CCC2CCCCCCC2)C1 ZINC001168976993 1129686266 /nfs/dbraw/zinc/68/62/66/1129686266.db2.gz GQEDNBXQJZGGMY-CVEARBPZSA-N 1 0 282.428 3.772 20 5 CHBDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000482489457 1126760743 /nfs/dbraw/zinc/76/07/43/1126760743.db2.gz KJWJYVJZIUHWQI-IAQYHMDHSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@H]([NH2+]CCCOC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000178651557 1126818092 /nfs/dbraw/zinc/81/80/92/1126818092.db2.gz QIZXBCBHXAOKSV-ZDUSSCGKSA-N 1 0 292.379 3.595 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000037176952 1126923270 /nfs/dbraw/zinc/92/32/70/1126923270.db2.gz KCQYIGXVCWPTAP-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO COc1cc(C[N@H+](C)C2CCCCCC2)ccc1[N+](=O)[O-] ZINC000485788825 1126953393 /nfs/dbraw/zinc/95/33/93/1126953393.db2.gz GPZLQFWYJVWWPP-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO Cc1cncc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000274360531 1127114753 /nfs/dbraw/zinc/11/47/53/1127114753.db2.gz IFPPIXHECATJFA-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000348927316 1127134553 /nfs/dbraw/zinc/13/45/53/1127134553.db2.gz ZXDFKHFBSSWZDA-QGZVFWFLSA-N 1 0 297.358 3.635 20 5 CHBDRO Cc1c(C[NH+]2CCC3(CCC3)CC2)cccc1[N+](=O)[O-] ZINC000586783401 1127140402 /nfs/dbraw/zinc/14/04/02/1127140402.db2.gz WMIKXDFKLIUOHV-UHFFFAOYSA-N 1 0 274.364 3.669 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2C[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000816646776 1131118483 /nfs/dbraw/zinc/11/84/83/1131118483.db2.gz IYCGQDQGAPHAPP-NWDGAFQWSA-N 1 0 262.353 3.558 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CC(C4CC4)C3)o2)cc1 ZINC000589736747 1127235081 /nfs/dbraw/zinc/23/50/81/1127235081.db2.gz GFWYUZBOGLGSAJ-UHFFFAOYSA-N 1 0 298.342 3.697 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(C3CC3)CC2)c(Cl)c1 ZINC000590006719 1127242722 /nfs/dbraw/zinc/24/27/22/1127242722.db2.gz QMOQVKQXFKSOPX-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO CS[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000223989966 1127247512 /nfs/dbraw/zinc/24/75/12/1127247512.db2.gz APPGJCCYEMTLIO-NILFDRSVSA-N 1 0 294.420 3.920 20 5 CHBDRO Cc1cccc(CCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000287616624 1127310904 /nfs/dbraw/zinc/31/09/04/1127310904.db2.gz SSVCLRXQSFXGPN-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C(C1CC1)C1CC1 ZINC000157545029 1127328784 /nfs/dbraw/zinc/32/87/84/1127328784.db2.gz DAORVTMUSXIGRA-NSHDSACASA-N 1 0 274.364 3.742 20 5 CHBDRO CC(C)O[C@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000593056117 1127370364 /nfs/dbraw/zinc/37/03/64/1127370364.db2.gz YHKSOAUMOWQJOS-KBPBESRZSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H]([NH2+]C1(C2CCC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000593080962 1127372638 /nfs/dbraw/zinc/37/26/38/1127372638.db2.gz NPPZOOVPULCNAP-NSHDSACASA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761045774 1127408206 /nfs/dbraw/zinc/40/82/06/1127408206.db2.gz QZLYSMHFCFWEBS-ZJUUUORDSA-N 1 0 288.269 3.540 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000594490224 1127418380 /nfs/dbraw/zinc/41/83/80/1127418380.db2.gz ISVIIDYGCMTVQL-BLLLJJGKSA-N 1 0 282.343 3.933 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C)SC1)c1cccc([N+](=O)[O-])c1 ZINC000594503201 1127418888 /nfs/dbraw/zinc/41/88/88/1127418888.db2.gz GRTDYOPTBACICH-NTZNESFSSA-N 1 0 280.393 3.530 20 5 CHBDRO Cc1cc2c(c(C)c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC000594502519 1127419207 /nfs/dbraw/zinc/41/92/07/1127419207.db2.gz JUOJDPQHIGIIDK-KRWDZBQOSA-N 1 0 296.370 3.989 20 5 CHBDRO C[C@H]([NH2+][C@H]1C[C@H](OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000594515835 1127420231 /nfs/dbraw/zinc/42/02/31/1127420231.db2.gz SQVMXNDGRYLBFK-WHOFXGATSA-N 1 0 292.379 3.592 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000594516959 1127420875 /nfs/dbraw/zinc/42/08/75/1127420875.db2.gz ZRRMQHANBHGQGQ-CXAGYDPISA-N 1 0 299.374 3.662 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCO1 ZINC000594518675 1127420987 /nfs/dbraw/zinc/42/09/87/1127420987.db2.gz IXHNHLRPVLAYJV-KCXAZCMYSA-N 1 0 292.379 3.593 20 5 CHBDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000358513767 1127425282 /nfs/dbraw/zinc/42/52/82/1127425282.db2.gz WGKBDYYGBBVMQA-ZDUSSCGKSA-N 1 0 299.374 3.711 20 5 CHBDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000594970546 1127437584 /nfs/dbraw/zinc/43/75/84/1127437584.db2.gz XKEJYLPELBIVHH-SECBINFHSA-N 1 0 256.371 3.571 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@]1(C)CC1(F)F ZINC000594976368 1127438245 /nfs/dbraw/zinc/43/82/45/1127438245.db2.gz BGOZHYUJLYOTEL-KGBIHWOQSA-N 1 0 296.317 3.633 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CC[C@@H]2c2ccccc2)c1 ZINC000594996428 1127444408 /nfs/dbraw/zinc/44/44/08/1127444408.db2.gz ZYAFFHIUWIBWDL-IAGOWNOFSA-N 1 0 282.343 3.631 20 5 CHBDRO C[C@]1(CC[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1(F)F ZINC000595081650 1127453429 /nfs/dbraw/zinc/45/34/29/1127453429.db2.gz TXSSTPFPXLNOHR-OCCSQVGLSA-N 1 0 296.317 3.607 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(C)(C)F)cc1[N+](=O)[O-] ZINC000595083956 1127453504 /nfs/dbraw/zinc/45/35/04/1127453504.db2.gz GTRYRYUPQVIXNN-LLVKDONJSA-N 1 0 268.332 3.692 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@]1(C)CC1(F)F ZINC000595082708 1127453553 /nfs/dbraw/zinc/45/35/53/1127453553.db2.gz VMABZTXRWYPNMS-SMDDNHRTSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@]1(C)CC1(F)F ZINC000595081570 1127453622 /nfs/dbraw/zinc/45/36/22/1127453622.db2.gz SDLSIFDAGSEGRF-SMDDNHRTSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2CCC[C@H](C)O2)cccc1[N+](=O)[O-] ZINC000595081997 1127453708 /nfs/dbraw/zinc/45/37/08/1127453708.db2.gz VKENFWAXILVDSA-FPMFFAJLSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@]1(C)CC1(F)F ZINC000595081292 1127453774 /nfs/dbraw/zinc/45/37/74/1127453774.db2.gz QYOIWGQQQMFTBH-ZWNOBZJWSA-N 1 0 284.306 3.599 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000595093330 1127454784 /nfs/dbraw/zinc/45/47/84/1127454784.db2.gz ZVPFKKXPOPJZKO-PIGZYNQJSA-N 1 0 298.342 3.639 20 5 CHBDRO CC(C)CC1([NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000595094821 1127455403 /nfs/dbraw/zinc/45/54/03/1127455403.db2.gz JMJRBSCMTSVRQL-AWEZNQCLSA-N 1 0 274.364 3.750 20 5 CHBDRO CCSC1(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000595097649 1127456077 /nfs/dbraw/zinc/45/60/77/1127456077.db2.gz AZJXPNZYKASGKP-LBPRGKRZSA-N 1 0 294.420 3.840 20 5 CHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000359303805 1127457539 /nfs/dbraw/zinc/45/75/39/1127457539.db2.gz PTNWVJMWCGBYRL-BXUZGUMPSA-N 1 0 280.393 3.668 20 5 CHBDRO CC[C@H](C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])CC(F)F ZINC000595423310 1127462309 /nfs/dbraw/zinc/46/23/09/1127462309.db2.gz NFJHIDPSRXAJST-QWRGUYRKSA-N 1 0 286.322 3.927 20 5 CHBDRO CCCC[N@H+](Cc1onc(C)c1[N+](=O)[O-])C1CCCCC1 ZINC000595296470 1127457452 /nfs/dbraw/zinc/45/74/52/1127457452.db2.gz DOROTCBJPBVEOP-UHFFFAOYSA-N 1 0 295.383 3.826 20 5 CHBDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000359541038 1127467008 /nfs/dbraw/zinc/46/70/08/1127467008.db2.gz CYVQNYJDXHYYAS-LRDDRELGSA-N 1 0 292.354 3.746 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000361922465 1127599403 /nfs/dbraw/zinc/59/94/03/1127599403.db2.gz IXTUJTIYGDQQOK-MLGOLLRUSA-N 1 0 288.347 3.860 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CCF)CC1 ZINC000602948166 1127622485 /nfs/dbraw/zinc/62/24/85/1127622485.db2.gz AUFFGXVPPAICIV-LBPRGKRZSA-N 1 0 280.343 3.727 20 5 CHBDRO Cc1c(C[NH2+]Cc2cccc3c2CCC3)cccc1[N+](=O)[O-] ZINC000593622776 1127636552 /nfs/dbraw/zinc/63/65/52/1127636552.db2.gz RTFLUYYMKNUXEB-UHFFFAOYSA-N 1 0 296.370 3.682 20 5 CHBDRO CCC(CC)[C@@H](CNc1ccc(F)cc1[N+](=O)[O-])[NH+](C)C ZINC000603438382 1127649432 /nfs/dbraw/zinc/64/94/32/1127649432.db2.gz BVNPRXBYVGALQH-OAHLLOKOSA-N 1 0 297.374 3.512 20 5 CHBDRO CCC[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)OCC ZINC000599057957 1127653780 /nfs/dbraw/zinc/65/37/80/1127653780.db2.gz DGHSZYKQCUJJSX-UONOGXRCSA-N 1 0 294.395 3.759 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000593677262 1127657186 /nfs/dbraw/zinc/65/71/86/1127657186.db2.gz WHALLUWFNNMVKE-GOSISDBHSA-N 1 0 296.370 3.989 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000603582122 1127660732 /nfs/dbraw/zinc/66/07/32/1127660732.db2.gz UMHVGIFGUIUMGN-JSGCOSHPSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000603662028 1127664922 /nfs/dbraw/zinc/66/49/22/1127664922.db2.gz BDADJFSWWDQPBG-COXVUDFISA-N 1 0 288.391 3.995 20 5 CHBDRO Cc1cccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000603860173 1127679913 /nfs/dbraw/zinc/67/99/13/1127679913.db2.gz YIEKFXJMQJHSHF-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2C2CCCC2)cc1 ZINC000604013222 1127689571 /nfs/dbraw/zinc/68/95/71/1127689571.db2.gz SVKDGXINSYSIRK-MRXNPFEDSA-N 1 0 274.364 3.749 20 5 CHBDRO CC1(C)C[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000608836556 1127889732 /nfs/dbraw/zinc/88/97/32/1127889732.db2.gz SBQCICMPBGEJLR-HNNXBMFYSA-N 1 0 286.331 3.743 20 5 CHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000076068575 1127933120 /nfs/dbraw/zinc/93/31/20/1127933120.db2.gz GTAYCWJYTPOKQW-HIFRSBDPSA-N 1 0 294.420 3.701 20 5 CHBDRO Cc1cc(NCCC[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000035277334 1127934835 /nfs/dbraw/zinc/93/48/35/1127934835.db2.gz YTVTVJUGBOSUPZ-CQSZACIVSA-N 1 0 291.395 3.580 20 5 CHBDRO Cc1ccc(C[N@@H+]2C[C@H](C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000539824826 1127940759 /nfs/dbraw/zinc/94/07/59/1127940759.db2.gz LGHUFINXMASNRK-DGCLKSJQSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1c(C[N@H+]2[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000466924113 1127950133 /nfs/dbraw/zinc/95/01/33/1127950133.db2.gz OVSNFMIKUPJWHI-TXEJJXNPSA-N 1 0 262.353 3.666 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@H]1CC=CCC1 ZINC000544116846 1127959319 /nfs/dbraw/zinc/95/93/19/1127959319.db2.gz KKGCFDFTKBKRJQ-KBPBESRZSA-N 1 0 274.364 3.944 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCC(C)(C)C)cccc1[N+](=O)[O-] ZINC000540194198 1127968633 /nfs/dbraw/zinc/96/86/33/1127968633.db2.gz FGHHPCWPXMXRLG-LBPRGKRZSA-N 1 0 264.369 3.990 20 5 CHBDRO C[C@@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000544405093 1127972090 /nfs/dbraw/zinc/97/20/90/1127972090.db2.gz ULDKUWBJYPXDRT-OAHLLOKOSA-N 1 0 298.386 3.606 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H]1Cc1ccccc1 ZINC000544610840 1127978653 /nfs/dbraw/zinc/97/86/53/1127978653.db2.gz AYARAMPNEKWKJS-QGZVFWFLSA-N 1 0 296.370 3.720 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000468044372 1127989780 /nfs/dbraw/zinc/98/97/80/1127989780.db2.gz HLKREVCOIUKOLK-PSASIEDQSA-N 1 0 290.285 3.895 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000324061641 1128005431 /nfs/dbraw/zinc/00/54/31/1128005431.db2.gz BVPCYXPBWQOHJU-XHDPSFHLSA-N 1 0 262.353 3.680 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC=CCC1 ZINC000468640195 1128015202 /nfs/dbraw/zinc/01/52/02/1128015202.db2.gz VRROCMNIAXJZTD-VSKPTYQZSA-N 1 0 272.348 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCCCS1 ZINC000541568352 1128028480 /nfs/dbraw/zinc/02/84/80/1128028480.db2.gz NDMGTCGTOASTIL-OCCSQVGLSA-N 1 0 294.420 3.840 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H](C)C(C)C ZINC000470169060 1128064440 /nfs/dbraw/zinc/06/44/40/1128064440.db2.gz BCJHJOKMTWWYTF-RNQWEJQRSA-N 1 0 276.380 3.974 20 5 CHBDRO CC[C@H](C)[N@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470179137 1128064768 /nfs/dbraw/zinc/06/47/68/1128064768.db2.gz SSXREKYQKCHKEE-SRXBQZRASA-N 1 0 262.353 3.728 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000492785040 1128113064 /nfs/dbraw/zinc/11/30/64/1128113064.db2.gz RWKPQAQALHQXDJ-TZMCWYRMSA-N 1 0 274.364 3.696 20 5 CHBDRO CCOc1cc(C[N@H+](C)[C@H](C)C2(C)CC2)ccc1[N+](=O)[O-] ZINC000492793593 1128113806 /nfs/dbraw/zinc/11/38/06/1128113806.db2.gz VSQWVWFOFXTAPR-GFCCVEGCSA-N 1 0 292.379 3.614 20 5 CHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC1CCCC1 ZINC000761506018 1128132258 /nfs/dbraw/zinc/13/22/58/1128132258.db2.gz MBYWNDOWEOMQQV-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761523768 1128132370 /nfs/dbraw/zinc/13/23/70/1128132370.db2.gz XHQNPDGIKIZIOW-ZYHUDNBSSA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519538 1128132987 /nfs/dbraw/zinc/13/29/87/1128132987.db2.gz BILLYDYJKVYZNX-CABZTGNLSA-N 1 0 268.744 3.526 20 5 CHBDRO CC(C)C[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761527490 1128133435 /nfs/dbraw/zinc/13/34/35/1128133435.db2.gz HSVLMSQXQYUMGB-JTQLQIEISA-N 1 0 270.760 3.772 20 5 CHBDRO C[C@@H]1CC[C@@H](C)[NH+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493354103 1128138931 /nfs/dbraw/zinc/13/89/31/1128138931.db2.gz BBEKFCKXHFUIIH-NXEZZACHSA-N 1 0 268.744 3.621 20 5 CHBDRO C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC1CCCC1 ZINC000493704223 1128147259 /nfs/dbraw/zinc/14/72/59/1128147259.db2.gz GGRLDLXWXILNOZ-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO Cc1cscc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000094877192 1128246214 /nfs/dbraw/zinc/24/62/14/1128246214.db2.gz VNEACNVXBODKTJ-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000495068724 1128228114 /nfs/dbraw/zinc/22/81/14/1128228114.db2.gz KUZYLJPEZMJVDO-XJKCOSOUSA-N 1 0 276.380 3.552 20 5 CHBDRO CSC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000193326294 1128272091 /nfs/dbraw/zinc/27/20/91/1128272091.db2.gz HNRFBKSIZRUTAC-NSHDSACASA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1cc(NCCC[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000035277331 1128276634 /nfs/dbraw/zinc/27/66/34/1128276634.db2.gz YTVTVJUGBOSUPZ-AWEZNQCLSA-N 1 0 291.395 3.580 20 5 CHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000915683661 1128334064 /nfs/dbraw/zinc/33/40/64/1128334064.db2.gz XRYNHKZQHKXUPB-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO CC1(C)CCC[C@H]1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000388871311 1128335742 /nfs/dbraw/zinc/33/57/42/1128335742.db2.gz INXFTSYAEVDWBS-NSHDSACASA-N 1 0 268.382 3.572 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000562058753 1128374603 /nfs/dbraw/zinc/37/46/03/1128374603.db2.gz QFFGWLMOZZKLGK-LBPRGKRZSA-N 1 0 280.368 3.614 20 5 CHBDRO CO[C@@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C(C)(C)C ZINC000154944324 1128599596 /nfs/dbraw/zinc/59/95/96/1128599596.db2.gz REMLDHDTTHWHPM-WFASDCNBSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1scc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)c1C ZINC000601144864 1128701157 /nfs/dbraw/zinc/70/11/57/1128701157.db2.gz XNRXWTBANYMBSS-UHFFFAOYSA-N 1 0 290.388 3.871 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2ncccc21)c1cccc([N+](=O)[O-])c1 ZINC000601264620 1128707313 /nfs/dbraw/zinc/70/73/13/1128707313.db2.gz BJOCVMGZSAVZHJ-YVEFUNNKSA-N 1 0 297.358 3.718 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCCC12CC2 ZINC000601289366 1128709017 /nfs/dbraw/zinc/70/90/17/1128709017.db2.gz MFZFCWPQSATVRH-DZGCQCFKSA-N 1 0 272.348 3.504 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000609766777 1128724274 /nfs/dbraw/zinc/72/42/74/1128724274.db2.gz PWDOEMJEMXGKRA-CYBMUJFWSA-N 1 0 262.353 3.607 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609766668 1128725494 /nfs/dbraw/zinc/72/54/94/1128725494.db2.gz AEJKBDZHCUQNDT-GFCCVEGCSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@H](CC[NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000578952417 1128734396 /nfs/dbraw/zinc/73/43/96/1128734396.db2.gz QNOMOZWQSRNJBT-OAHLLOKOSA-N 1 0 298.386 3.921 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000131464058 1118278852 /nfs/dbraw/zinc/27/88/52/1118278852.db2.gz HMMINBGHRDUHKW-UHFFFAOYSA-N 1 0 295.342 3.674 20 5 CHBDRO CCC1(Nc2nc3ccccc3c3ccccc32)C[NH2+]C1 ZINC001168586640 1118312636 /nfs/dbraw/zinc/31/26/36/1118312636.db2.gz KRSCSZHVVXQVPA-UHFFFAOYSA-N 1 0 277.371 3.552 20 5 CHBDRO Cc1c(CN(C)Cc2ccccc2F)cccc1[N+](=O)[O-] ZINC000051213059 1118690112 /nfs/dbraw/zinc/69/01/12/1118690112.db2.gz FELCOZDYCJJTDY-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO COc1ccc(C[N@H+](CCC(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000047911833 1118708204 /nfs/dbraw/zinc/70/82/04/1118708204.db2.gz CXSLOTJRXJZPIA-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000178316994 1118758873 /nfs/dbraw/zinc/75/88/73/1118758873.db2.gz GLUFAYXRGBHPLQ-XHDPSFHLSA-N 1 0 274.320 3.990 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CC1=CCCCC1 ZINC000449374869 1118811109 /nfs/dbraw/zinc/81/11/09/1118811109.db2.gz CRKVUKGPYQOEFK-UXBLZVDNSA-N 1 0 272.348 3.698 20 5 CHBDRO CC[C@@H]1CCC[C@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510793870 1118817851 /nfs/dbraw/zinc/81/78/51/1118817851.db2.gz DPCDAUSSYOJSCI-YMTOWFKASA-N 1 0 284.306 3.541 20 5 CHBDRO CC[C@H]1CCC[C@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510793867 1118817958 /nfs/dbraw/zinc/81/79/58/1118817958.db2.gz DPCDAUSSYOJSCI-LKFCYVNXSA-N 1 0 284.306 3.541 20 5 CHBDRO Cc1occc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000610805277 1118893042 /nfs/dbraw/zinc/89/30/42/1118893042.db2.gz PSNYXMHDALZNQM-NSHDSACASA-N 1 0 274.320 3.655 20 5 CHBDRO COCC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000511052604 1118983754 /nfs/dbraw/zinc/98/37/54/1118983754.db2.gz YPZHRBZFTLEYHF-SWLSCSKDSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1c(C[NH2+]C(C)(C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000263689104 1119033094 /nfs/dbraw/zinc/03/30/94/1119033094.db2.gz JMJAVTUQNNCJTQ-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO CC(C)c1ccc(C[N@@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000158722988 1119152708 /nfs/dbraw/zinc/15/27/08/1119152708.db2.gz ROLGBYNFBUECBP-UHFFFAOYSA-N 1 0 250.342 3.558 20 5 CHBDRO CC[C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000409456816 1119287438 /nfs/dbraw/zinc/28/74/38/1119287438.db2.gz KXKGYVVVFQULKZ-LLVKDONJSA-N 1 0 274.320 3.743 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCCCC2(C)C)cc1[N+](=O)[O-] ZINC000094323620 1128839994 /nfs/dbraw/zinc/83/99/94/1128839994.db2.gz ROJHKVAKAWZRBI-HNNXBMFYSA-N 1 0 276.380 3.962 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC001307660724 1128840176 /nfs/dbraw/zinc/84/01/76/1128840176.db2.gz SFDXKINVFSPGBB-CZUORRHYSA-N 1 0 292.379 3.532 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC3)CC2)c(Cl)c1 ZINC000611794057 1119434661 /nfs/dbraw/zinc/43/46/61/1119434661.db2.gz RLJNAKUILRNPCA-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000219697842 1119511284 /nfs/dbraw/zinc/51/12/84/1119511284.db2.gz GMUQKTQWFUGXJU-IUODEOHRSA-N 1 0 262.353 3.605 20 5 CHBDRO CC(C)(C)[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000612177724 1119744339 /nfs/dbraw/zinc/74/43/39/1119744339.db2.gz WOECVAQDCSOWES-LLVKDONJSA-N 1 0 280.343 3.602 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000612803937 1119827929 /nfs/dbraw/zinc/82/79/29/1119827929.db2.gz NEDGNCVKCPZNGS-SECBINFHSA-N 1 0 294.248 3.555 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CC)C1CCCC1 ZINC000580720294 1119884785 /nfs/dbraw/zinc/88/47/85/1119884785.db2.gz XOVJLXJUSNYTRP-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)nc1C ZINC000414165992 1119923414 /nfs/dbraw/zinc/92/34/14/1119923414.db2.gz MTRQNGZLYIPZJI-CQSZACIVSA-N 1 0 299.374 3.766 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000180261511 1119965805 /nfs/dbraw/zinc/96/58/05/1119965805.db2.gz GWGCLDAFIPMSEB-ZFWWWQNUSA-N 1 0 292.379 3.513 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)C1(OC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000414300578 1119971181 /nfs/dbraw/zinc/97/11/81/1119971181.db2.gz AOXTVVHVQKBWGO-SWLSCSKDSA-N 1 0 292.379 3.593 20 5 CHBDRO COC1([C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000414325758 1119984109 /nfs/dbraw/zinc/98/41/09/1119984109.db2.gz XORIDAMZKSQKNS-STQMWFEESA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000694620176 1119998285 /nfs/dbraw/zinc/99/82/85/1119998285.db2.gz VWUGORIFLCPZBX-JIMOISOXSA-N 1 0 280.755 3.526 20 5 CHBDRO CSC[C@H](C)[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417307192 1120424419 /nfs/dbraw/zinc/42/44/19/1120424419.db2.gz GTPPRIRFMNHMNC-NHYWBVRUSA-N 1 0 294.420 3.703 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]3CCC[C@H]32)c(Cl)c1 ZINC000426525046 1120472713 /nfs/dbraw/zinc/47/27/13/1120472713.db2.gz QCDTYULCFMMBKH-QMTHXVAHSA-N 1 0 280.755 3.623 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(C(F)F)CC1 ZINC000530364040 1120477949 /nfs/dbraw/zinc/47/79/49/1120477949.db2.gz KXJIWTKKDAFCGP-SNVBAGLBSA-N 1 0 284.306 3.599 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000020091227 1120493166 /nfs/dbraw/zinc/49/31/66/1120493166.db2.gz WKZCMPGETCZZPU-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2F)cc1[N+](=O)[O-] ZINC000020091211 1120493362 /nfs/dbraw/zinc/49/33/62/1120493362.db2.gz ZOYYYMJCKJMFAV-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000020090652 1120493636 /nfs/dbraw/zinc/49/36/36/1120493636.db2.gz YQBJVMMZIYBROF-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)CCC(C)C)cccc1[N+](=O)[O-] ZINC000069234315 1120497347 /nfs/dbraw/zinc/49/73/47/1120497347.db2.gz TXTUHFVJAWVKOH-GFCCVEGCSA-N 1 0 264.369 3.818 20 5 CHBDRO C[C@@H]1CCC[N@H+](CCCCNc2sccc2[N+](=O)[O-])C1 ZINC000301984653 1120523961 /nfs/dbraw/zinc/52/39/61/1120523961.db2.gz IZHSLCCVUDMPLD-GFCCVEGCSA-N 1 0 297.424 3.580 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000070112495 1120528692 /nfs/dbraw/zinc/52/86/92/1120528692.db2.gz XOXSDEGMCHOOOO-LALPHHSUSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]1C[C@H](C)C[N@@H+](CCSc2cccc([N+](=O)[O-])c2)C1 ZINC001307342106 1120537779 /nfs/dbraw/zinc/53/77/79/1120537779.db2.gz RRIMPGWSFHUFGF-BETUJISGSA-N 1 0 294.420 3.665 20 5 CHBDRO CC[N@H+](CCC(F)(F)F)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000092737706 1120562026 /nfs/dbraw/zinc/56/20/26/1120562026.db2.gz SHEJDUDJTNCSMV-UHFFFAOYSA-N 1 0 290.285 3.678 20 5 CHBDRO CC(C)CCC[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000019999465 1120579014 /nfs/dbraw/zinc/57/90/14/1120579014.db2.gz BFRXECCLACEDPU-CYBMUJFWSA-N 1 0 264.369 3.899 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000508993743 1120579814 /nfs/dbraw/zinc/57/98/14/1120579814.db2.gz YKMGSKBONIBLLU-OTYXRUKQSA-N 1 0 284.306 3.541 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@@H]1C ZINC000020055208 1120581530 /nfs/dbraw/zinc/58/15/30/1120581530.db2.gz BQVYUJCANMICJI-BZPMIXESSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1c(C[N@@H+](Cc2cccnc2)C(C)C)cccc1[N+](=O)[O-] ZINC000125681821 1120621905 /nfs/dbraw/zinc/62/19/05/1120621905.db2.gz OJVVWXPVKPLHJW-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO CC[C@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000302073637 1120648455 /nfs/dbraw/zinc/64/84/55/1120648455.db2.gz HTKLLEXQPBTZGR-LBPRGKRZSA-N 1 0 285.347 3.688 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH+](C1CCC1)C1CCC1 ZINC000429114927 1120666335 /nfs/dbraw/zinc/66/63/35/1120666335.db2.gz MCORPHQQXCQRJR-UHFFFAOYSA-N 1 0 290.363 3.510 20 5 CHBDRO CCCCOCCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000132025968 1120679881 /nfs/dbraw/zinc/67/98/81/1120679881.db2.gz VEZKQSGHGGZQGP-AWEZNQCLSA-N 1 0 294.395 3.761 20 5 CHBDRO CCSCC[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000132281277 1120686282 /nfs/dbraw/zinc/68/62/82/1120686282.db2.gz YCJAYJWAEOCNPS-VXGBXAGGSA-N 1 0 282.409 3.777 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000313457387 1120730179 /nfs/dbraw/zinc/73/01/79/1120730179.db2.gz CNYTULXQNDTNGV-PWSUYJOCSA-N 1 0 284.306 3.742 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCS[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000313502734 1120741890 /nfs/dbraw/zinc/74/18/90/1120741890.db2.gz JGCITYDAXMIDAQ-CQDKDKBSSA-N 1 0 294.420 3.920 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000045628925 1120764491 /nfs/dbraw/zinc/76/44/91/1120764491.db2.gz QEKGOSMBTWPCKP-CZUORRHYSA-N 1 0 274.364 3.992 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)Cc2ccsc2)cccc1[N+](=O)[O-] ZINC000049181933 1120852764 /nfs/dbraw/zinc/85/27/64/1120852764.db2.gz DYDJTPCNKAPQDQ-LLVKDONJSA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)CCc2ccco2)cccc1[N+](=O)[O-] ZINC000049566358 1120860404 /nfs/dbraw/zinc/86/04/04/1120860404.db2.gz WIZIPYMGNQYYLC-LBPRGKRZSA-N 1 0 288.347 3.607 20 5 CHBDRO C[N@@H+]1CCCC[C@H]1CCSc1ccc([N+](=O)[O-])cc1F ZINC000585732541 1121022019 /nfs/dbraw/zinc/02/20/19/1121022019.db2.gz SSMPMHUHPNPPHS-NSHDSACASA-N 1 0 298.383 3.700 20 5 CHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000585754374 1121029632 /nfs/dbraw/zinc/02/96/32/1121029632.db2.gz KNXKXEBNFNNXHZ-UHFFFAOYSA-N 1 0 284.359 3.962 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)CC2 ZINC000113310570 1121111282 /nfs/dbraw/zinc/11/12/82/1121111282.db2.gz UJIQSLXFOXOLBE-KRWDZBQOSA-N 1 0 282.343 3.680 20 5 CHBDRO CC(C)SCC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429239012 1121173359 /nfs/dbraw/zinc/17/33/59/1121173359.db2.gz SKPJNDYZGWBIIV-UHFFFAOYSA-N 1 0 282.409 3.561 20 5 CHBDRO CC1(C)CC(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000701965901 1121176093 /nfs/dbraw/zinc/17/60/93/1121176093.db2.gz ITOHOARUWAMQIT-UHFFFAOYSA-N 1 0 282.771 3.774 20 5 CHBDRO CS[C@@H]1CCCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246577416 1121310917 /nfs/dbraw/zinc/31/09/17/1121310917.db2.gz LUTILWQSUCVTOI-IUODEOHRSA-N 1 0 294.420 3.873 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2C2CC2)ccc1Cl ZINC000706685038 1121434280 /nfs/dbraw/zinc/43/42/80/1121434280.db2.gz PBMMDCXTXADJEV-CYBMUJFWSA-N 1 0 280.755 3.623 20 5 CHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC1CCCC1 ZINC000512672049 1121522853 /nfs/dbraw/zinc/52/28/53/1121522853.db2.gz FNCOXQVVTJOFJW-UXBLZVDNSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(F)(F)CC1 ZINC000619434102 1128991371 /nfs/dbraw/zinc/99/13/71/1128991371.db2.gz NLSUUTWXYNXSNS-FMIVXFBMSA-N 1 0 296.317 3.729 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CC[C@@H](C)C1 ZINC000433038369 1121528254 /nfs/dbraw/zinc/52/82/54/1121528254.db2.gz JRPPGAYJAUCADH-RISCZKNCSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CC(C)C)C(C)C ZINC000543631557 1121538327 /nfs/dbraw/zinc/53/83/27/1121538327.db2.gz KTGZEXCBNMYUAT-UHFFFAOYSA-N 1 0 264.369 3.770 20 5 CHBDRO CC(C)(C)[C@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000542320753 1121566907 /nfs/dbraw/zinc/56/69/07/1121566907.db2.gz UUEOBMUBNARSEZ-NSHDSACASA-N 1 0 268.382 3.524 20 5 CHBDRO Cc1ccc(C[N@@H+](CC(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000509403386 1121573412 /nfs/dbraw/zinc/57/34/12/1121573412.db2.gz ZUTAJNOIBOGASM-UHFFFAOYSA-N 1 0 264.369 3.770 20 5 CHBDRO CSCCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433254916 1121630117 /nfs/dbraw/zinc/63/01/17/1121630117.db2.gz DIOWURYRAWOJFG-CQSZACIVSA-N 1 0 294.420 3.660 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000611408976 1121645057 /nfs/dbraw/zinc/64/50/57/1121645057.db2.gz PUGGAUVNYQYYHJ-GHMZBOCLSA-N 1 0 280.343 3.648 20 5 CHBDRO CC(C)=CCC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000397744841 1121695165 /nfs/dbraw/zinc/69/51/65/1121695165.db2.gz BUFBZSHVVBBXQR-ZDUSSCGKSA-N 1 0 262.353 3.910 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCc1ccccc1 ZINC001177108529 1121714014 /nfs/dbraw/zinc/71/40/14/1121714014.db2.gz DYCZHHJPPCBNEL-UHFFFAOYSA-N 1 0 298.386 3.934 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000501788000 1122008763 /nfs/dbraw/zinc/00/87/63/1122008763.db2.gz BWMXTCVJPCFJPS-JHJVBQTASA-N 1 0 262.353 3.634 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000501792208 1122010303 /nfs/dbraw/zinc/01/03/03/1122010303.db2.gz CWLNPQCGLYWFAN-FRRDWIJNSA-N 1 0 262.353 3.634 20 5 CHBDRO CC[N@H+](Cc1c(C)ccc([N+](=O)[O-])c1C)C1CCCC1 ZINC001181657237 1122067712 /nfs/dbraw/zinc/06/77/12/1122067712.db2.gz XPQMYCBZGVDTEW-UHFFFAOYSA-N 1 0 276.380 3.976 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)C1(C)CC1 ZINC000183391773 1129051955 /nfs/dbraw/zinc/05/19/55/1129051955.db2.gz DHYPFHWFRPOHND-GFCCVEGCSA-N 1 0 262.353 3.524 20 5 CHBDRO CC(C)[C@H]1[N@H+](Cc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000430100954 1122404449 /nfs/dbraw/zinc/40/44/49/1122404449.db2.gz BPUWXLIXIYWCPZ-OAHLLOKOSA-N 1 0 274.364 3.605 20 5 CHBDRO CC1CCC([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000505585377 1122425491 /nfs/dbraw/zinc/42/54/91/1122425491.db2.gz MTYLHMWMMQTWRY-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC[C@H](F)C1 ZINC000515059398 1122473380 /nfs/dbraw/zinc/47/33/80/1122473380.db2.gz NLKFMKROESKHEV-AVGNSLFASA-N 1 0 280.343 3.835 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2CC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000436470418 1122553443 /nfs/dbraw/zinc/55/34/43/1122553443.db2.gz LDDUACUNBATCQP-LBPRGKRZSA-N 1 0 274.364 3.887 20 5 CHBDRO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@H+](C)CC[N+](=O)[O-] ZINC001191290032 1122589479 /nfs/dbraw/zinc/58/94/79/1122589479.db2.gz YLBGXTRMBSNWNE-AWEZNQCLSA-N 1 0 284.359 3.623 20 5 CHBDRO CC(C)[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000775450716 1122592109 /nfs/dbraw/zinc/59/21/09/1122592109.db2.gz VNAKDONIPSULPL-QGZVFWFLSA-N 1 0 299.374 3.519 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)c(Cl)c1 ZINC000712413893 1122604423 /nfs/dbraw/zinc/60/44/23/1122604423.db2.gz NBZBAHOJBYJOGD-VZJVUDMVSA-N 1 0 294.782 3.917 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001192499593 1122648363 /nfs/dbraw/zinc/64/83/63/1122648363.db2.gz CSSFMAHOSBTQFP-NSHDSACASA-N 1 0 280.343 3.602 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCC2(CCCC2)C1 ZINC000438348477 1122693703 /nfs/dbraw/zinc/69/37/03/1122693703.db2.gz XVNRGTLPRNXDAG-UHFFFAOYSA-N 1 0 274.364 3.751 20 5 CHBDRO C[C@@H]1CC[C@H]([N@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429600739 1122726588 /nfs/dbraw/zinc/72/65/88/1122726588.db2.gz WTRKEGVAQLQQQM-MNOVXSKESA-N 1 0 282.771 3.869 20 5 CHBDRO CC(C)([NH2+]CC1CC2(CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC001194682433 1122790886 /nfs/dbraw/zinc/79/08/86/1122790886.db2.gz BHWMHRPACXGIJJ-UHFFFAOYSA-N 1 0 288.391 4.000 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426488823 1122804934 /nfs/dbraw/zinc/80/49/34/1122804934.db2.gz XYWRPEXWKYCUAJ-GWCFXTLKSA-N 1 0 280.755 3.623 20 5 CHBDRO CCC(CC)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000151293398 1122867060 /nfs/dbraw/zinc/86/70/60/1122867060.db2.gz SNJDCYSDQQZCTK-LLVKDONJSA-N 1 0 250.342 3.742 20 5 CHBDRO Cc1cc(F)ccc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000507145164 1122929899 /nfs/dbraw/zinc/92/98/99/1122929899.db2.gz REZFHOKSRDSQCM-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO CC(C)c1ccc(C[N@H+](C)[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000507439652 1122955045 /nfs/dbraw/zinc/95/50/45/1122955045.db2.gz DXAJTHWYSFHUOQ-LBPRGKRZSA-N 1 0 276.380 3.949 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC12CCCC2)c1ccccc1[N+](=O)[O-] ZINC000474042295 1123041139 /nfs/dbraw/zinc/04/11/39/1123041139.db2.gz DKINFOVNNLEIEP-SWLSCSKDSA-N 1 0 274.364 3.968 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC23CCCC3)cc1[N+](=O)[O-] ZINC000428637807 1123071031 /nfs/dbraw/zinc/07/10/31/1123071031.db2.gz FTPSZKXPSRGQLW-OAHLLOKOSA-N 1 0 274.364 3.716 20 5 CHBDRO Cc1c(C[NH2+]C2(C)Cc3ccccc3C2)cccc1[N+](=O)[O-] ZINC001201513186 1123113997 /nfs/dbraw/zinc/11/39/97/1123113997.db2.gz XBNRCBSGLOJGJY-UHFFFAOYSA-N 1 0 296.370 3.550 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])s1 ZINC000049183100 1123142698 /nfs/dbraw/zinc/14/26/98/1123142698.db2.gz JTJCHFXUAOWYHF-SNVBAGLBSA-N 1 0 294.351 3.955 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])s1 ZINC000049183102 1123143991 /nfs/dbraw/zinc/14/39/91/1123143991.db2.gz JTJCHFXUAOWYHF-JTQLQIEISA-N 1 0 294.351 3.955 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCCc2ccco2)c1 ZINC000850407591 1123263329 /nfs/dbraw/zinc/26/33/29/1123263329.db2.gz KJKIAYXXZQQYSB-UHFFFAOYSA-N 1 0 294.738 3.564 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000776884012 1123559726 /nfs/dbraw/zinc/55/97/26/1123559726.db2.gz VRHCGPQFWREJRM-NEPJUHHUSA-N 1 0 292.379 3.833 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CCC1 ZINC000119610957 1123896151 /nfs/dbraw/zinc/89/61/51/1123896151.db2.gz ZAJWXYBCKUWIMM-SECBINFHSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1sccc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000865787296 1124014741 /nfs/dbraw/zinc/01/47/41/1124014741.db2.gz KQDVQMKESLXRLB-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO C[C@H]1CCCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000088507312 1124061588 /nfs/dbraw/zinc/06/15/88/1124061588.db2.gz HKYHIRVTPWDDHJ-SWLSCSKDSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000525637136 1124450528 /nfs/dbraw/zinc/45/05/28/1124450528.db2.gz ZVKMQFGYLFLHPB-QWHCGFSZSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@H](CSC(C)(C)C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123224208 1124575727 /nfs/dbraw/zinc/57/57/27/1124575727.db2.gz YIVPDPHBOXQATJ-GFCCVEGCSA-N 1 0 296.436 3.647 20 5 CHBDRO C[C@@H](CSC(C)(C)C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123223988 1124576457 /nfs/dbraw/zinc/57/64/57/1124576457.db2.gz YIVPDPHBOXQATJ-LBPRGKRZSA-N 1 0 296.436 3.647 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000449058650 1124639632 /nfs/dbraw/zinc/63/96/32/1124639632.db2.gz LAEPCUOFTIRLRV-AAEUAGOBSA-N 1 0 288.347 3.778 20 5 CHBDRO C[C@H]([NH2+]CCc1ccsc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872021544 1124659203 /nfs/dbraw/zinc/65/92/03/1124659203.db2.gz RXQUKIORPMWNOA-JTQLQIEISA-N 1 0 294.351 3.689 20 5 CHBDRO C[C@H]([NH2+]C[C@@]1(C)CCCS1)c1c(F)cccc1[N+](=O)[O-] ZINC000872042905 1124664330 /nfs/dbraw/zinc/66/43/30/1124664330.db2.gz FHJCUDDFQKDAES-IINYFYTJSA-N 1 0 298.383 3.670 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])C1(C)CC1 ZINC000872055124 1124667728 /nfs/dbraw/zinc/66/77/28/1124667728.db2.gz DZJLGGBZYKLESP-VHSXEESVSA-N 1 0 266.316 3.573 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC(F)(F)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872057985 1124669000 /nfs/dbraw/zinc/66/90/00/1124669000.db2.gz LTBROGDPBZFILL-IUCAKERBSA-N 1 0 288.269 3.572 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000872081606 1124677681 /nfs/dbraw/zinc/67/76/81/1124677681.db2.gz IGGSKPJFNIHBJM-WISYIIOYSA-N 1 0 292.404 3.766 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)nc1C ZINC000873131540 1124739878 /nfs/dbraw/zinc/73/98/78/1124739878.db2.gz VLCSJMLTNNFUKR-UHFFFAOYSA-N 1 0 299.374 3.513 20 5 CHBDRO Cc1ccc(F)cc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000873183997 1124747213 /nfs/dbraw/zinc/74/72/13/1124747213.db2.gz WTCVHAUNSRAEKA-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCC1(F)F ZINC000449491021 1124760653 /nfs/dbraw/zinc/76/06/53/1124760653.db2.gz DUSMHBOVERGBCZ-YPMHNXCESA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1c[nH+]ccc1N1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000450755408 1125102110 /nfs/dbraw/zinc/10/21/10/1125102110.db2.gz JHIMTRLWONQOKT-HNNXBMFYSA-N 1 0 297.358 3.682 20 5 CHBDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000531202531 1125200324 /nfs/dbraw/zinc/20/03/24/1125200324.db2.gz QSGLMCHWFXHFGL-KSSFIOAISA-N 1 0 296.370 3.973 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532326596 1125249236 /nfs/dbraw/zinc/24/92/36/1125249236.db2.gz LDHFUSZSSGRDEK-ZDUSSCGKSA-N 1 0 262.353 3.607 20 5 CHBDRO C[C@H](C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])CC(F)F ZINC000697353683 1125306326 /nfs/dbraw/zinc/30/63/26/1125306326.db2.gz ZZNXPLPRIIRNMP-QMMMGPOBSA-N 1 0 292.713 3.629 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC(C(C)C)C1 ZINC000619431102 1125358630 /nfs/dbraw/zinc/35/86/30/1125358630.db2.gz CLABOEUMMSUNNH-NTUHNPAUSA-N 1 0 274.364 3.586 20 5 CHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)CC(F)F ZINC000883251864 1125385413 /nfs/dbraw/zinc/38/54/13/1125385413.db2.gz GZAVLNSSNAINKA-UHFFFAOYSA-N 1 0 290.285 3.505 20 5 CHBDRO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000883461975 1125411907 /nfs/dbraw/zinc/41/19/07/1125411907.db2.gz HEVKUVXFTTXILD-INIZCTEOSA-N 1 0 297.358 3.630 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)C1CC(F)(F)C1)c1ccccc1[N+](=O)[O-] ZINC000897461886 1125424054 /nfs/dbraw/zinc/42/40/54/1125424054.db2.gz ZUEFBJPMXFFOQN-WDEREUQCSA-N 1 0 298.333 3.722 20 5 CHBDRO OC1C[NH+](Cc2ccc3ccc4cccc5ccc2c3c45)C1 ZINC001204002789 1125437531 /nfs/dbraw/zinc/43/75/31/1125437531.db2.gz ZBUAHNFJRMVPNG-UHFFFAOYSA-N 1 0 287.362 3.761 20 5 CHBDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000766194756 1129282565 /nfs/dbraw/zinc/28/25/65/1129282565.db2.gz WXIDFYAKNZBPJC-KRWDZBQOSA-N 1 0 296.370 3.723 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1)C(C)(C)C ZINC000094774686 1129451607 /nfs/dbraw/zinc/45/16/07/1129451607.db2.gz XYZKWOVZBDANSF-SNVBAGLBSA-N 1 0 268.332 3.600 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]1C ZINC000252207411 1129557179 /nfs/dbraw/zinc/55/71/79/1129557179.db2.gz VJZVKMFTMJWIEU-UHIISALHSA-N 1 0 280.343 3.648 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)o1 ZINC000746046627 1129623457 /nfs/dbraw/zinc/62/34/57/1129623457.db2.gz CIBDUBWZEYSRJA-NSHDSACASA-N 1 0 274.320 3.655 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1F ZINC001168981824 1129687008 /nfs/dbraw/zinc/68/70/08/1129687008.db2.gz HPJFWGDRYHXHSB-IOASZLSFSA-N 1 0 294.370 3.702 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C)cc1C ZINC001168991545 1129688527 /nfs/dbraw/zinc/68/85/27/1129688527.db2.gz HHNOTUXQVYWQSN-ZMSDIMECSA-N 1 0 290.407 3.790 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cc(C)cc(C)c1 ZINC001169001888 1129689025 /nfs/dbraw/zinc/68/90/25/1129689025.db2.gz IHXIAIMNCGBEDG-XIRDDKMYSA-N 1 0 290.407 3.790 20 5 CHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001169006248 1129689396 /nfs/dbraw/zinc/68/93/96/1129689396.db2.gz GJVDZTSIKNPVIS-OIISXLGYSA-N 1 0 288.391 3.577 20 5 CHBDRO CC(C)C[N@H+](Cc1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011217 1129690104 /nfs/dbraw/zinc/69/01/04/1129690104.db2.gz ILVYCMZQMZDTIA-IRXDYDNUSA-N 1 0 290.407 3.590 20 5 CHBDRO C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C1CCC(C(C)(C)C)CC1 ZINC001169036359 1129690609 /nfs/dbraw/zinc/69/06/09/1129690609.db2.gz FRBHNRGECUFPBK-SLTXQBBLSA-N 1 0 296.455 3.969 20 5 CHBDRO CC[C@H](c1ccccc1)[N@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169040123 1129690747 /nfs/dbraw/zinc/69/07/47/1129690747.db2.gz YAXHZEHYVCNEAN-FVQBIDKESA-N 1 0 276.380 3.515 20 5 CHBDRO C[C@H](c1ccc(Cl)cc1)[N@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035131 1129690810 /nfs/dbraw/zinc/69/08/10/1129690810.db2.gz AJWRXJWHXMXWQL-TYNCELHUSA-N 1 0 296.798 3.778 20 5 CHBDRO Cc1ccc([C@@H]2CCC[N@@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169025018 1129691394 /nfs/dbraw/zinc/69/13/94/1129691394.db2.gz ILURVVJBSNOLED-UAGQMJEPSA-N 1 0 288.391 3.577 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001169334340 1129719012 /nfs/dbraw/zinc/71/90/12/1129719012.db2.gz XTJLEUXQTPSSMD-ZBFHGGJFSA-N 1 0 276.380 3.995 20 5 CHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)CC1CCC1 ZINC000801551662 1129926631 /nfs/dbraw/zinc/92/66/31/1129926631.db2.gz WZXMFXJBTIZHBT-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746657356 1130136008 /nfs/dbraw/zinc/13/60/08/1130136008.db2.gz GOUDJNJHNCVYOG-JTQLQIEISA-N 1 0 270.760 3.869 20 5 CHBDRO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC1CCCC1 ZINC000746662488 1130138036 /nfs/dbraw/zinc/13/80/36/1130138036.db2.gz AWVGQPLEROJVMG-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC(C)(C)C ZINC000746666808 1130143377 /nfs/dbraw/zinc/14/33/77/1130143377.db2.gz RASOYSIWVDLRSX-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCC(C)(C)CC1 ZINC001254558343 1130264961 /nfs/dbraw/zinc/26/49/61/1130264961.db2.gz AAJAHOLDSMHQCR-ZDUSSCGKSA-N 1 0 276.380 3.648 20 5 CHBDRO COc1ccc(C[C@@H](C)[NH2+]CCC(C)(C)C)c([N+](=O)[O-])c1 ZINC001170298983 1130476604 /nfs/dbraw/zinc/47/66/04/1130476604.db2.gz OYHIKKRTUSLPEG-GFCCVEGCSA-N 1 0 294.395 3.560 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000781982670 1130750767 /nfs/dbraw/zinc/75/07/67/1130750767.db2.gz PQWDDMHULVXSIT-GFCCVEGCSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC000782502356 1130779775 /nfs/dbraw/zinc/77/97/75/1130779775.db2.gz FQYSQQLOPCQYIP-DIOULYMOSA-N 1 0 292.354 3.744 20 5 CHBDRO CC(C)[NH+](Cc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000778959950 1131093242 /nfs/dbraw/zinc/09/32/42/1131093242.db2.gz FXGGATYKRGEXBE-UHFFFAOYSA-N 1 0 270.760 3.867 20 5 CHBDRO CC[C@@H](CNc1ccc(Cl)cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC001115843986 1131120980 /nfs/dbraw/zinc/12/09/80/1131120980.db2.gz ZQJYSFNXSMAKKG-LBPRGKRZSA-N 1 0 297.786 3.535 20 5 CHBDRO CC[C@H](CNc1ccc(Cl)cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC001115843983 1131121437 /nfs/dbraw/zinc/12/14/37/1131121437.db2.gz ZQJYSFNXSMAKKG-GFCCVEGCSA-N 1 0 297.786 3.535 20 5 CHBDRO C[C@@H](C[N@@H+]1Cc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC001116823613 1131165481 /nfs/dbraw/zinc/16/54/81/1131165481.db2.gz GPSNCCRYIPTFRZ-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO CCC[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C1CCC1 ZINC001171037238 1131448759 /nfs/dbraw/zinc/44/87/59/1131448759.db2.gz XXXSYVQVPHNKRY-CQSZACIVSA-N 1 0 292.379 3.532 20 5 CHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C/C=C\Cl)C2)cc1 ZINC000831534532 1131489399 /nfs/dbraw/zinc/48/93/99/1131489399.db2.gz PCRWKCZFSMNRGS-ZUNOPDERSA-N 1 0 280.755 3.527 20 5 CHBDRO CCC[NH+]1CCC(Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000036970446 1131982913 /nfs/dbraw/zinc/98/29/13/1131982913.db2.gz MZPAZDGSBIUCBG-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO C[NH+](C)[C@@H]1CCC[C@H](Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000715573263 1131989385 /nfs/dbraw/zinc/98/93/85/1131989385.db2.gz OODDTVGWXPNXAW-NWDGAFQWSA-N 1 0 297.786 3.533 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCc1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000037177119 1132006741 /nfs/dbraw/zinc/00/67/41/1132006741.db2.gz DDFUMHACGGFHNJ-QWHCGFSZSA-N 1 0 288.347 3.860 20 5 CHBDRO O=[N+]([O-])c1ccccc1Nc1ccc(C[NH+]2CCCC2)cc1 ZINC001206164306 1132197026 /nfs/dbraw/zinc/19/70/26/1132197026.db2.gz GPIOJHHJGKGHOL-UHFFFAOYSA-N 1 0 297.358 3.934 20 5 CHBDRO CC1CC([N@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172908783 1132349666 /nfs/dbraw/zinc/34/96/66/1132349666.db2.gz OEISUUWBPLMLAG-YAJUMTOWSA-N 1 0 288.391 3.573 20 5 CHBDRO CCCCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895479 1132360506 /nfs/dbraw/zinc/36/05/06/1132360506.db2.gz FEILTAWXKLGJMS-OAHLLOKOSA-N 1 0 276.380 3.622 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[C@H](C)CC1 ZINC001173220576 1132411098 /nfs/dbraw/zinc/41/10/98/1132411098.db2.gz FYXUJCJVPFZYHP-KCQAQPDRSA-N 1 0 276.380 3.694 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173219219 1132411173 /nfs/dbraw/zinc/41/11/73/1132411173.db2.gz ZFGLZXMSHULSNM-OLZOCXBDSA-N 1 0 264.369 3.550 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC(F)(F)C1 ZINC001173220460 1132411573 /nfs/dbraw/zinc/41/15/73/1132411573.db2.gz AKBVIOQUGSXMLG-WCQYABFASA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)CC1 ZINC001173221561 1132411638 /nfs/dbraw/zinc/41/16/38/1132411638.db2.gz KHHGTMAHLPDEOL-KGLIPLIRSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCC(F)(F)C1 ZINC001173220463 1132411690 /nfs/dbraw/zinc/41/16/90/1132411690.db2.gz AKBVIOQUGSXMLG-YPMHNXCESA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC001173226047 1132412460 /nfs/dbraw/zinc/41/24/60/1132412460.db2.gz KWCVOGBIKPLOLL-CQSZACIVSA-N 1 0 296.370 3.584 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1[C@H](C)CCC[C@@H]1C ZINC001173224441 1132412933 /nfs/dbraw/zinc/41/29/33/1132412933.db2.gz FVQKGZHDZZNVPK-MJBXVCDLSA-N 1 0 276.380 3.789 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@](C)(F)CC1 ZINC001173229116 1132413633 /nfs/dbraw/zinc/41/36/33/1132413633.db2.gz PZRCPOGRUSSVTJ-XJKSGUPXSA-N 1 0 294.370 3.740 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001173233974 1132414071 /nfs/dbraw/zinc/41/40/71/1132414071.db2.gz NKEMCYFJAOZGFC-MCIONIFRSA-N 1 0 276.380 3.504 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC001173229648 1132414120 /nfs/dbraw/zinc/41/41/20/1132414120.db2.gz OPGCNEBKICAMRM-BBRMVZONSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC1CCCC1 ZINC001173212653 1132416302 /nfs/dbraw/zinc/41/63/02/1132416302.db2.gz CBKQQUISVXAJBC-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232218688 1132438847 /nfs/dbraw/zinc/43/88/47/1132438847.db2.gz JYSKWHCTAVUUQV-ZDUSSCGKSA-N 1 0 277.371 3.625 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2c[nH+]ccc2N2CCCCC2)cc1 ZINC001174477800 1132881384 /nfs/dbraw/zinc/88/13/84/1132881384.db2.gz WZIBOZDKOLPLLT-UHFFFAOYSA-N 1 0 298.346 3.724 20 5 CHBDRO Cc1cc(Nc2cc3cccnc3c3ncccc23)cc[nH+]1 ZINC001174657039 1132951972 /nfs/dbraw/zinc/95/19/72/1132951972.db2.gz ZXCMFHQENNIMAA-UHFFFAOYSA-N 1 0 286.338 3.652 20 5 CHBDRO CC1(C)C[NH2+]Cc2cc(Nc3cccc([N+](=O)[O-])c3)ccc21 ZINC001160286398 1132958543 /nfs/dbraw/zinc/95/85/43/1132958543.db2.gz JYSIKNHDHNWSSG-UHFFFAOYSA-N 1 0 297.358 3.719 20 5 CHBDRO Nc1cc(Nc2cccc3nc4ccccc4nc32)cc[nH+]1 ZINC001206569049 1133719670 /nfs/dbraw/zinc/71/96/70/1133719670.db2.gz VASDFMJJRUCEQN-UHFFFAOYSA-N 1 0 287.326 3.504 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2C[C@@H]2C2CCCC2)c(F)c1 ZINC001207837867 1133851372 /nfs/dbraw/zinc/85/13/72/1133851372.db2.gz USUGBZCDBMSGBT-DZGCQCFKSA-N 1 0 292.354 3.650 20 5 CHBDRO Nc1ccc(Nc2cc[nH+]c(C3CCC3)c2)cc1[N+](=O)[O-] ZINC001209933876 1134103534 /nfs/dbraw/zinc/10/35/34/1134103534.db2.gz DBSKJQHTMYVWBF-UHFFFAOYSA-N 1 0 284.319 3.583 20 5 CHBDRO O=[N+]([O-])c1cc(Nc2cc[nH+]c(C3CC3)c2)ccc1F ZINC001211190561 1134387462 /nfs/dbraw/zinc/38/74/62/1134387462.db2.gz DTXDNJVQOQTXPI-UHFFFAOYSA-N 1 0 273.267 3.750 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1ccc2c(c1)C[N@H+](C)CC2 ZINC001211290416 1134404820 /nfs/dbraw/zinc/40/48/20/1134404820.db2.gz DZEPYGWYGBIAJM-UHFFFAOYSA-N 1 0 297.358 3.635 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000403591540 1134808779 /nfs/dbraw/zinc/80/87/79/1134808779.db2.gz FCEIPIVWJPDJGF-ZIEJDFEHSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)cc1[N+](=O)[O-] ZINC000403672306 1134831722 /nfs/dbraw/zinc/83/17/22/1134831722.db2.gz VGBQUIKAZGGFBV-ZGKBOVNRSA-N 1 0 274.364 3.742 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)c(Cl)c1 ZINC000403686521 1134836562 /nfs/dbraw/zinc/83/65/62/1134836562.db2.gz RFBKFJDIKRBCFG-YUSALJHKSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@@H]1C[C@@H](Oc2c3ccccc3c(O)c3ccccc32)C[NH2+]1 ZINC001218039810 1135049528 /nfs/dbraw/zinc/04/95/28/1135049528.db2.gz XTEDFWMFBMBSAS-CHWSQXEVSA-N 1 0 293.366 3.828 20 5 CHBDRO c1ccc2c(c1)nc(O[C@@H]1C[C@H]3C[C@@H]1C[NH2+]3)c1ccccc21 ZINC001218113120 1135060413 /nfs/dbraw/zinc/06/04/13/1135060413.db2.gz YYLHLRSOXKACJO-SNUQEOBHSA-N 1 0 290.366 3.517 20 5 CHBDRO c1ccc2c(c1)nc(O[C@H]1CCC13C[NH2+]C3)c1ccccc21 ZINC001218239509 1135073095 /nfs/dbraw/zinc/07/30/95/1135073095.db2.gz HEGMOBKYGYRLHE-KRWDZBQOSA-N 1 0 290.366 3.519 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1OC1CC2(CC[NH2+]2)C1 ZINC001218246773 1135073954 /nfs/dbraw/zinc/07/39/54/1135073954.db2.gz VLYZQIRQYAEZSP-UHFFFAOYSA-N 1 0 290.366 3.661 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@H]3CCC[NH2+]C3)cc2c1 ZINC001218282906 1135078752 /nfs/dbraw/zinc/07/87/52/1135078752.db2.gz FHCSIAJCBDOWRL-HNNXBMFYSA-N 1 0 278.355 3.519 20 5 CHBDRO c1ccc2cc3cc(O[C@@H]4C[C@H]5C[NH2+]C[C@@H]54)ccc3cc2c1 ZINC001218332968 1135089433 /nfs/dbraw/zinc/08/94/33/1135089433.db2.gz XOMSHUJRTYKFQK-YSIASYRMSA-N 1 0 289.378 3.980 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCc1csc2ccccc12 ZINC001223978858 1135404499 /nfs/dbraw/zinc/40/44/99/1135404499.db2.gz JPYJNYGXQPDRKU-LBPRGKRZSA-N 1 0 264.414 3.513 20 5 CHBDRO CC(C)[N@@H+]1CCC[C@@H](O[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001224024713 1135411979 /nfs/dbraw/zinc/41/19/79/1135411979.db2.gz KTKVZOWWGQXVPR-XJKSGUPXSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCCCCC1CCCCC1 ZINC001224766171 1135479557 /nfs/dbraw/zinc/47/95/57/1135479557.db2.gz DLVRDJNYUPJZRW-HNNXBMFYSA-N 1 0 256.454 3.848 20 5 CHBDRO C[N+](C)(C)CCOC1c2ccccc2Oc2ccccc21 ZINC001224775431 1135480455 /nfs/dbraw/zinc/48/04/55/1135480455.db2.gz KMMAKACPVUJWBD-UHFFFAOYSA-N 1 0 284.379 3.605 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(Cc2ccccc2)cc1 ZINC001225264294 1135530111 /nfs/dbraw/zinc/53/01/11/1135530111.db2.gz PIJGIKIFLAMSOV-MRXNPFEDSA-N 1 0 284.423 3.751 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1c(Cl)cc(F)cc1Cl ZINC001226006677 1135651969 /nfs/dbraw/zinc/65/19/69/1135651969.db2.gz XVVCPGUYJUQARH-QMMMGPOBSA-N 1 0 281.178 3.606 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1nc2ccccc2c2ccccc21 ZINC001226992651 1135772040 /nfs/dbraw/zinc/77/20/40/1135772040.db2.gz NEJMDSOAEALLEV-CQSZACIVSA-N 1 0 295.406 3.862 20 5 CHBDRO CC[N@@H+]1CC[C@@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001226991570 1135772133 /nfs/dbraw/zinc/77/21/33/1135772133.db2.gz BMUXKRTZSUHHLU-CQSZACIVSA-N 1 0 292.382 3.861 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccccc1-c1ccccc1 ZINC001227472809 1135838155 /nfs/dbraw/zinc/83/81/55/1135838155.db2.gz OXFNXKOIKJDSDY-OAHLLOKOSA-N 1 0 270.396 3.827 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1c(N=O)ccc2ccccc21 ZINC001227494280 1135840951 /nfs/dbraw/zinc/84/09/51/1135840951.db2.gz VXEJEHQRVNMDNN-GFCCVEGCSA-N 1 0 273.356 3.711 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000161632240 261103190 /nfs/dbraw/zinc/10/31/90/261103190.db2.gz TUDXVXNTSVVLIP-BXKDBHETSA-N 1 0 290.285 3.976 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525784842 262234897 /nfs/dbraw/zinc/23/48/97/262234897.db2.gz XOLCVEQWIZTOIR-CQSZACIVSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000020121807 171001042 /nfs/dbraw/zinc/00/10/42/171001042.db2.gz VABTXFSOKRWXAG-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000020123926 171005593 /nfs/dbraw/zinc/00/55/93/171005593.db2.gz YBTGRIZLUOSPLI-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccccc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000020126331 171010207 /nfs/dbraw/zinc/01/02/07/171010207.db2.gz HGZVTJLLORQUGV-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000020126330 171010664 /nfs/dbraw/zinc/01/06/64/171010664.db2.gz HGZVTJLLORQUGV-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000020134498 171022884 /nfs/dbraw/zinc/02/28/84/171022884.db2.gz GNTUDXUVMRLHIE-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO CCC[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035368075 172159974 /nfs/dbraw/zinc/15/99/74/172159974.db2.gz NZUSDTVLTPTVFM-SECBINFHSA-N 1 0 256.733 3.526 20 5 CHBDRO CCC[C@@H]([NH2+][C@H](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000035732862 172383807 /nfs/dbraw/zinc/38/38/07/172383807.db2.gz QJOBKCIXKCLJFN-IAQYHMDHSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000037031326 172898987 /nfs/dbraw/zinc/89/89/87/172898987.db2.gz YUMWEYSVLWTPSS-GXTWGEPZSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000346978217 226003329 /nfs/dbraw/zinc/00/33/29/226003329.db2.gz IQHMAMPRQZPNGC-KRWDZBQOSA-N 1 0 297.358 3.635 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CC23CC3)o1 ZINC000418104717 228052687 /nfs/dbraw/zinc/05/26/87/228052687.db2.gz XKTDIKCYOFZMMT-GFCCVEGCSA-N 1 0 298.342 3.745 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000035661471 260033294 /nfs/dbraw/zinc/03/32/94/260033294.db2.gz AUSWVDCIYMKRPB-MRXNPFEDSA-N 1 0 288.347 3.861 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C(CC)CC)cc1[N+](=O)[O-] ZINC000179391087 260045797 /nfs/dbraw/zinc/04/57/97/260045797.db2.gz CCVVJOWHSXXAEB-NSHDSACASA-N 1 0 280.368 3.833 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000037176991 260072572 /nfs/dbraw/zinc/07/25/72/260072572.db2.gz PCCCNXVZABDPGI-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccc([N+](=O)[O-])cc1 ZINC000037177171 260072630 /nfs/dbraw/zinc/07/26/30/260072630.db2.gz KBRQMMBKYFZHAB-XHDPSFHLSA-N 1 0 286.331 3.916 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]CCSc2ccccc2)cs1 ZINC000037904252 260120296 /nfs/dbraw/zinc/12/02/96/260120296.db2.gz BOUACMUMADHIEF-UHFFFAOYSA-N 1 0 294.401 3.538 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC2CCC1CC2)c1ccccc1[N+](=O)[O-] ZINC000312896521 260219432 /nfs/dbraw/zinc/21/94/32/260219432.db2.gz XRPHIOVZYSILBD-CLTVBZQCSA-N 1 0 274.364 3.824 20 5 CHBDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C1 ZINC000085064648 260370227 /nfs/dbraw/zinc/37/02/27/260370227.db2.gz KJUKOJUBVQURJW-PWSUYJOCSA-N 1 0 268.382 3.715 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000518562274 260454120 /nfs/dbraw/zinc/45/41/20/260454120.db2.gz DLUZQHFVDYDIOT-MRXNPFEDSA-N 1 0 282.343 3.680 20 5 CHBDRO CC(C)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000410068380 260459182 /nfs/dbraw/zinc/45/91/82/260459182.db2.gz FVDMWYLTTIYARI-UHFFFAOYSA-N 1 0 288.347 3.991 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1cncs1)c1cccc([N+](=O)[O-])c1 ZINC000161604815 261253788 /nfs/dbraw/zinc/25/37/88/261253788.db2.gz CCSAHKDIIHPGOX-GXFFZTMASA-N 1 0 291.376 3.853 20 5 CHBDRO CC(C)C1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000176960563 261322134 /nfs/dbraw/zinc/32/21/34/261322134.db2.gz CHMQMLCHSUSGKN-GFCCVEGCSA-N 1 0 262.353 3.682 20 5 CHBDRO CC[C@H]([NH2+]CC[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000180266635 261423319 /nfs/dbraw/zinc/42/33/19/261423319.db2.gz BGBQBRFHGWCAQR-CVEARBPZSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1ccc([N+](=O)[O-])cc1 ZINC000020558007 262250751 /nfs/dbraw/zinc/25/07/51/262250751.db2.gz VMPOBFRCDBZGPZ-ZDUSSCGKSA-N 1 0 279.384 3.517 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000216306533 262275443 /nfs/dbraw/zinc/27/54/43/262275443.db2.gz MFPWQQYHXPRTDF-UXIGCNINSA-N 1 0 276.380 3.818 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000094423902 262369817 /nfs/dbraw/zinc/36/98/17/262369817.db2.gz RYCJRMISXBOMPG-BXUZGUMPSA-N 1 0 292.379 3.592 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2)cccc1[N+](=O)[O-] ZINC000414146330 262810379 /nfs/dbraw/zinc/81/03/79/262810379.db2.gz PCENZJJHSYLPEJ-MELADBBJSA-N 1 0 292.379 3.510 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)c1cncc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000155811445 263016465 /nfs/dbraw/zinc/01/64/65/263016465.db2.gz WONKOLAWUZWOQD-GHMZBOCLSA-N 1 0 289.310 3.541 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2CC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000425952744 264070944 /nfs/dbraw/zinc/07/09/44/264070944.db2.gz ILCRMJOSRARJPF-SNVBAGLBSA-N 1 0 284.306 3.599 20 5 CHBDRO CCOC[C@H]([NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000189357848 264293642 /nfs/dbraw/zinc/29/36/42/264293642.db2.gz MHEAANUMRMUEAL-CVEARBPZSA-N 1 0 294.395 3.697 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000094279281 265232477 /nfs/dbraw/zinc/23/24/77/265232477.db2.gz ODPHHACLZIVXNF-CQSZACIVSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCCC2(C)C)cccc1[N+](=O)[O-] ZINC000094324519 265236642 /nfs/dbraw/zinc/23/66/42/265236642.db2.gz YCENMUSJXRFFBL-AWEZNQCLSA-N 1 0 262.353 3.572 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccncc1C)c1cccc([N+](=O)[O-])c1 ZINC000228661620 267258710 /nfs/dbraw/zinc/25/87/10/267258710.db2.gz IITDLXYNYDIEJA-INIZCTEOSA-N 1 0 285.347 3.539 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000040675864 328015545 /nfs/dbraw/zinc/01/55/45/328015545.db2.gz ACBYBWTZGRROQS-STQMWFEESA-N 1 0 276.380 3.552 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC(C)(C)C1 ZINC000563443257 328066888 /nfs/dbraw/zinc/06/68/88/328066888.db2.gz RAGAYDJSILMFCK-GHXNOFRVSA-N 1 0 274.364 3.776 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC(C2CCC2)C1 ZINC000571448199 328122575 /nfs/dbraw/zinc/12/25/75/328122575.db2.gz WMTZVBDDSGWHFU-JYRVWZFOSA-N 1 0 286.375 3.730 20 5 CHBDRO CCc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)s1 ZINC000048348786 328130495 /nfs/dbraw/zinc/13/04/95/328130495.db2.gz VIGMTZUTZMZPNL-UHFFFAOYSA-N 1 0 276.361 3.509 20 5 CHBDRO CC(C)[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000110789463 328319085 /nfs/dbraw/zinc/31/90/85/328319085.db2.gz RDPDQSIWXGTLEW-UHFFFAOYSA-N 1 0 276.380 3.790 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCc3c2cccc3F)c1 ZINC000111158738 328328269 /nfs/dbraw/zinc/32/82/69/328328269.db2.gz GYAKOHOFWSYDDO-INIZCTEOSA-N 1 0 286.306 3.511 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000049092605 328336628 /nfs/dbraw/zinc/33/66/28/328336628.db2.gz NSSYBWRYOPKLFK-DRZSPHRISA-N 1 0 264.369 3.988 20 5 CHBDRO C[C@H](Cc1ccsc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000049156011 328350847 /nfs/dbraw/zinc/35/08/47/328350847.db2.gz BKAHGWRHTHAKNB-NEPJUHHUSA-N 1 0 290.388 3.938 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H](c2cccs2)C2CC2)c1 ZINC000049956810 328379648 /nfs/dbraw/zinc/37/96/48/328379648.db2.gz BUDMQIKYOSCIDN-OAHLLOKOSA-N 1 0 288.372 3.897 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3C4CCC3CC4)o2)cc1 ZINC000535067171 328382700 /nfs/dbraw/zinc/38/27/00/328382700.db2.gz KKMZAIWJDPISNK-UHFFFAOYSA-N 1 0 298.342 3.982 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)Cc1ccncc1 ZINC000531993919 328386280 /nfs/dbraw/zinc/38/62/80/328386280.db2.gz LTGNZJCURDDEPB-KBPBESRZSA-N 1 0 299.374 3.580 20 5 CHBDRO CC[C@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000112466755 328439837 /nfs/dbraw/zinc/43/98/37/328439837.db2.gz SZVTVURUTMNMTR-MRXNPFEDSA-N 1 0 284.359 3.706 20 5 CHBDRO CCOC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000530491327 326818050 /nfs/dbraw/zinc/81/80/50/326818050.db2.gz WWSSQOMRUJNYOV-CJNGLKHVSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000037565766 326856070 /nfs/dbraw/zinc/85/60/70/326856070.db2.gz LIKXQHFDMUCFSC-WFASDCNBSA-N 1 0 282.343 3.585 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2coc3ccccc23)cc1 ZINC000083601906 326936991 /nfs/dbraw/zinc/93/69/91/326936991.db2.gz IEXWVANJYBVGIM-UHFFFAOYSA-N 1 0 282.299 3.631 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CC[C@@H]2C2CC2)cc1 ZINC000558268930 327084056 /nfs/dbraw/zinc/08/40/56/327084056.db2.gz MYHYJWUYLFSWID-SJORKVTESA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1N(C)C ZINC000089511957 327170814 /nfs/dbraw/zinc/17/08/14/327170814.db2.gz TXADTGVTCJJBTL-CYBMUJFWSA-N 1 0 299.374 3.512 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000559418269 327244600 /nfs/dbraw/zinc/24/46/00/327244600.db2.gz PQXHUHAVCRLIRI-TZMCWYRMSA-N 1 0 274.364 3.778 20 5 CHBDRO CC[C@H](C)[C@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)OC ZINC000560348529 327301679 /nfs/dbraw/zinc/30/16/79/327301679.db2.gz OECVJIAIGODADN-GHJWDPDVSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000583432955 327361798 /nfs/dbraw/zinc/36/17/98/327361798.db2.gz IXBYXEJCCDWZRB-FZKQIMNGSA-N 1 0 296.370 3.975 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@H]2C[C@@H]2C(F)F)c2cc([N+](=O)[O-])ccc21 ZINC000562056564 327444768 /nfs/dbraw/zinc/44/47/68/327444768.db2.gz AGOXUZMOTXOUNN-DRZSPHRISA-N 1 0 296.317 3.560 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000051634368 328626386 /nfs/dbraw/zinc/62/63/86/328626386.db2.gz NWHHXKPBASGHCD-VXGBXAGGSA-N 1 0 262.353 3.509 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)CCC2 ZINC000582785848 329195306 /nfs/dbraw/zinc/19/53/06/329195306.db2.gz RCDJLCGESUEKLR-WOSRLPQWSA-N 1 0 292.354 3.843 20 5 CHBDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000395180871 329278608 /nfs/dbraw/zinc/27/86/08/329278608.db2.gz FCYKJFDDISJWDH-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CC(F)(F)C1)CCCC2 ZINC000584458992 329490872 /nfs/dbraw/zinc/49/08/72/329490872.db2.gz MSPGWLMTQSVVKO-CQSZACIVSA-N 1 0 296.317 3.750 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000302754089 332883816 /nfs/dbraw/zinc/88/38/16/332883816.db2.gz ZNOODGQOSSLVAM-UPJWGTAASA-N 1 0 262.353 3.634 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000421874295 330100955 /nfs/dbraw/zinc/10/09/55/330100955.db2.gz ICYXIGZOBZLPFH-ZYHUDNBSSA-N 1 0 250.342 3.600 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(C2CC2)CC1 ZINC000536833827 330229770 /nfs/dbraw/zinc/22/97/70/330229770.db2.gz PBAHNACFAAGQGQ-LBPRGKRZSA-N 1 0 274.364 3.744 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000035257092 330244935 /nfs/dbraw/zinc/24/49/35/330244935.db2.gz VMHGXDZQCHLLAS-GJZGRUSLSA-N 1 0 276.380 3.962 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000035677659 330249114 /nfs/dbraw/zinc/24/91/14/330249114.db2.gz FXGRPIWSWBQPTA-IOASZLSFSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC1(C)C ZINC000536866042 330251611 /nfs/dbraw/zinc/25/16/11/330251611.db2.gz XLVAVVAGRBKPRM-JSGCOSHPSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CC1(C)C ZINC000536865477 330253592 /nfs/dbraw/zinc/25/35/92/330253592.db2.gz UGIVAWVADJAJOT-RYUDHWBXSA-N 1 0 262.353 3.600 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)cs1 ZINC000424210309 330328205 /nfs/dbraw/zinc/32/82/05/330328205.db2.gz VSJOWZZMERAMGN-QWHCGFSZSA-N 1 0 280.393 3.715 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC12CC2 ZINC000424332529 330342638 /nfs/dbraw/zinc/34/26/38/330342638.db2.gz WTLGBFBTRCNERC-FZMZJTMJSA-N 1 0 292.404 3.608 20 5 CHBDRO Cc1ccc(C[NH2+]C2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000084461553 330485761 /nfs/dbraw/zinc/48/57/61/330485761.db2.gz ABHNGAMRMJGVDQ-VXGBXAGGSA-N 1 0 276.380 3.818 20 5 CHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000516301045 330491220 /nfs/dbraw/zinc/49/12/20/330491220.db2.gz ICQPNXHDHZZPOT-MRZGDXHCSA-N 1 0 282.343 3.959 20 5 CHBDRO CCC(C)(C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000429430960 330546361 /nfs/dbraw/zinc/54/63/61/330546361.db2.gz MAPKWMQVKPRHRT-GFCCVEGCSA-N 1 0 264.369 3.990 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC(C)(C)C(C)C ZINC000438358870 330722934 /nfs/dbraw/zinc/72/29/34/330722934.db2.gz RBQSVTBFJRCAQE-UHFFFAOYSA-N 1 0 264.369 3.675 20 5 CHBDRO Cc1cc(NC[C@@H]2C[C@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000159447629 330848011 /nfs/dbraw/zinc/84/80/11/330848011.db2.gz OFBIAKZBAUIACP-KOLCDFICSA-N 1 0 271.320 3.519 20 5 CHBDRO Cc1ccccc1CC[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449057026 330895858 /nfs/dbraw/zinc/89/58/58/330895858.db2.gz AGKPHLLAGGRBSK-OAHLLOKOSA-N 1 0 298.386 3.667 20 5 CHBDRO Cc1cscc1C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449288660 330912106 /nfs/dbraw/zinc/91/21/06/330912106.db2.gz NRPQDGYPVLRSIQ-LBPRGKRZSA-N 1 0 290.388 3.686 20 5 CHBDRO CC[C@@H]1C[C@H]1C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000449483737 330929736 /nfs/dbraw/zinc/92/97/36/330929736.db2.gz KCPOJFHRNLFJBB-NFAWXSAZSA-N 1 0 276.380 3.552 20 5 CHBDRO CCC[C@H]([NH2+]C1CCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000163258391 331010609 /nfs/dbraw/zinc/01/06/09/331010609.db2.gz HPDHGTWYGGUYMG-HNNXBMFYSA-N 1 0 294.420 3.921 20 5 CHBDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000452037512 331051299 /nfs/dbraw/zinc/05/12/99/331051299.db2.gz VBARJEALLIPJNU-DAXOMENPSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@@H]([NH2+]C1CC(C)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000453253502 331107963 /nfs/dbraw/zinc/10/79/63/331107963.db2.gz PWXDWSIXCDEEMQ-HRDQMINSSA-N 1 0 266.316 3.526 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C1CC1)C1CCC1 ZINC000453600798 331135826 /nfs/dbraw/zinc/13/58/26/331135826.db2.gz CICYEJBJFXQXMO-MRXNPFEDSA-N 1 0 274.364 3.572 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H](C1CC1)C1CCC1 ZINC000453627165 331137079 /nfs/dbraw/zinc/13/70/79/331137079.db2.gz UUNYJKIIGDQWHR-AUNFYEFLSA-N 1 0 286.375 3.776 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000164091239 331161185 /nfs/dbraw/zinc/16/11/85/331161185.db2.gz NQEQKODHDWNNEK-DGCLKSJQSA-N 1 0 282.409 3.695 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2Cc3ccccc32)cc1[N+](=O)[O-] ZINC000195651197 331179464 /nfs/dbraw/zinc/17/94/64/331179464.db2.gz KPXASUYBFSHBSV-CZUORRHYSA-N 1 0 296.370 3.894 20 5 CHBDRO C[C@H]([NH2+]C1CC2(CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000459455990 331282163 /nfs/dbraw/zinc/28/21/63/331282163.db2.gz DLTVRLCNYYSZOQ-NSHDSACASA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2C[C@@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000462768153 331328078 /nfs/dbraw/zinc/32/80/78/331328078.db2.gz XMSSKBYSJWCHQV-HZPDHXFCSA-N 1 0 288.391 3.962 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@H]1c1ccccc1 ZINC000463074644 331339533 /nfs/dbraw/zinc/33/95/33/331339533.db2.gz UANIIZGPPHEXKL-IRXDYDNUSA-N 1 0 296.370 3.830 20 5 CHBDRO CCC1(CC)C[N@H+](Cc2ccccc2[N+](=O)[O-])CCS1 ZINC000464588293 331363388 /nfs/dbraw/zinc/36/33/88/331363388.db2.gz OKFHHZRWBZMHKN-UHFFFAOYSA-N 1 0 294.420 3.702 20 5 CHBDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000464743418 331365814 /nfs/dbraw/zinc/36/58/14/331365814.db2.gz YJGBKONLDFYXLW-ZFWWWQNUSA-N 1 0 276.380 3.995 20 5 CHBDRO CC(C)[C@H]1C[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CCS1 ZINC000464779745 331367859 /nfs/dbraw/zinc/36/78/59/331367859.db2.gz ZJZHMMDEWFFGRY-SWLSCSKDSA-N 1 0 294.420 3.729 20 5 CHBDRO CC/C=C\CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000466235019 331391371 /nfs/dbraw/zinc/39/13/71/331391371.db2.gz KKOAAYZJGFUAIW-ARJAWSKDSA-N 1 0 274.364 3.916 20 5 CHBDRO CCc1ccc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])o1 ZINC000467982637 331426276 /nfs/dbraw/zinc/42/62/76/331426276.db2.gz KEVPTXUKCVUDKF-GFCCVEGCSA-N 1 0 288.347 3.644 20 5 CHBDRO CC(C)[C@H]1CCC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000468443897 331435026 /nfs/dbraw/zinc/43/50/26/331435026.db2.gz HIMSLCQQOAVBBW-HZPDHXFCSA-N 1 0 276.380 3.552 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC(F)(F)F ZINC000468622159 331437481 /nfs/dbraw/zinc/43/74/81/331437481.db2.gz PURLBCWCYOCRJA-YFHOEESVSA-N 1 0 288.269 3.540 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC[C@H]1C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000510688134 332911662 /nfs/dbraw/zinc/91/16/62/332911662.db2.gz QNLBESCUZXVSKF-UVBJJODRSA-N 1 0 274.364 3.824 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000471233908 331504382 /nfs/dbraw/zinc/50/43/82/331504382.db2.gz GMVAFKGHGCOMOR-UHFFFAOYSA-N 1 0 268.332 3.792 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]CCCc2ccccc2F)cs1 ZINC000475576005 331638003 /nfs/dbraw/zinc/63/80/03/331638003.db2.gz RFXIXVDLYMLVFJ-UHFFFAOYSA-N 1 0 294.351 3.518 20 5 CHBDRO CCc1cccnc1[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000478497909 331707514 /nfs/dbraw/zinc/70/75/14/331707514.db2.gz LETXCIPNYBAMLP-CYBMUJFWSA-N 1 0 299.374 3.711 20 5 CHBDRO CC(C)=CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000480283615 331766143 /nfs/dbraw/zinc/76/61/43/331766143.db2.gz KIYDTZGNAJJVLI-UHFFFAOYSA-N 1 0 286.331 3.911 20 5 CHBDRO C[C@@H]([NH2+]C1CCC2(CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000488417788 332005682 /nfs/dbraw/zinc/00/56/82/332005682.db2.gz MMXUZDXLFDTLSU-GFCCVEGCSA-N 1 0 274.364 3.968 20 5 CHBDRO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CS1 ZINC000488425022 332006590 /nfs/dbraw/zinc/00/65/90/332006590.db2.gz YZOMJIVVYXIWPB-NJZAAPMLSA-N 1 0 294.420 3.776 20 5 CHBDRO Cc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000489073901 332040451 /nfs/dbraw/zinc/04/04/51/332040451.db2.gz LRLYYCIBOBXYSC-OAHLLOKOSA-N 1 0 298.386 3.966 20 5 CHBDRO C[C@@H]1C[C@H]1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000490164319 332083265 /nfs/dbraw/zinc/08/32/65/332083265.db2.gz LKIZKZXANGLYGQ-RPVQJOFSSA-N 1 0 296.370 3.930 20 5 CHBDRO C[C@@H](C1CCC1)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492174176 332385773 /nfs/dbraw/zinc/38/57/73/332385773.db2.gz AEPZBBXFRNSXGQ-JTQLQIEISA-N 1 0 282.771 3.869 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000495440167 332519069 /nfs/dbraw/zinc/51/90/69/332519069.db2.gz PNPGOUSHQQXXTA-QWRGUYRKSA-N 1 0 284.787 3.815 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000505640164 332747820 /nfs/dbraw/zinc/74/78/20/332747820.db2.gz YEFHRARDNQWLFF-CJNGLKHVSA-N 1 0 296.370 3.975 20 5 CHBDRO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000513682575 333032034 /nfs/dbraw/zinc/03/20/34/333032034.db2.gz APUVQHIPPBOCKB-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO CCCC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000222298251 333180484 /nfs/dbraw/zinc/18/04/84/333180484.db2.gz XXDPUMJTJVNRCM-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO CCC[C@H]([NH2+]C[C@](C)(O)CCC)c1cccc([N+](=O)[O-])c1 ZINC000223508296 333208866 /nfs/dbraw/zinc/20/88/66/333208866.db2.gz RJXKLOKIEUIVBP-JKSUJKDBSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000522046691 333231557 /nfs/dbraw/zinc/23/15/57/333231557.db2.gz DWXOHDHFIUCIPT-YPMHNXCESA-N 1 0 262.353 3.524 20 5 CHBDRO CCCC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000230145497 333314887 /nfs/dbraw/zinc/31/48/87/333314887.db2.gz LPLVSVACXTVFOO-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@@H](OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000231692791 333328485 /nfs/dbraw/zinc/32/84/85/333328485.db2.gz FPAVGILOVANMNA-BMFZPTHFSA-N 1 0 292.379 3.593 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523841154 333347728 /nfs/dbraw/zinc/34/77/28/333347728.db2.gz OPEJOOKXMAGDLK-SNVBAGLBSA-N 1 0 270.760 3.725 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CSC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000338776871 335138427 /nfs/dbraw/zinc/13/84/27/335138427.db2.gz VUDBJZKDHYECDG-KGLIPLIRSA-N 1 0 294.420 3.920 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)[C@@H]1CC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000397796455 333428767 /nfs/dbraw/zinc/42/87/67/333428767.db2.gz QWVBWVYPMULKLA-MJVIPROJSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)[C@@H]1C ZINC000037562521 333534833 /nfs/dbraw/zinc/53/48/33/333534833.db2.gz YZDZCUFAZBCMCC-FOGDFJRCSA-N 1 0 268.382 3.571 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000538280493 333582660 /nfs/dbraw/zinc/58/26/60/333582660.db2.gz SYYQYGCTRRPGMV-NXEZZACHSA-N 1 0 290.285 3.752 20 5 CHBDRO CCCCOCCC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000128024483 333640314 /nfs/dbraw/zinc/64/03/14/333640314.db2.gz AZOMZLCSIFFXKU-AWEZNQCLSA-N 1 0 294.395 3.761 20 5 CHBDRO C[C@@H]([NH2+]CCCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000539067880 333654538 /nfs/dbraw/zinc/65/45/38/333654538.db2.gz WZINAWYOIOZBFG-GFCCVEGCSA-N 1 0 290.388 3.940 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](CC)C(C)(C)O)c1cccc([N+](=O)[O-])c1 ZINC000340503820 335156973 /nfs/dbraw/zinc/15/69/73/335156973.db2.gz NUYUBUKYAADSDI-GJZGRUSLSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1c(C[NH2+]Cc2ccc(Cl)s2)cccc1[N+](=O)[O-] ZINC000071308853 333853307 /nfs/dbraw/zinc/85/33/07/333853307.db2.gz BKSGFSOFSABQRS-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000543979974 333907732 /nfs/dbraw/zinc/90/77/32/333907732.db2.gz BCIUSASXWDJJEY-STQMWFEESA-N 1 0 299.374 3.964 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000546172652 334018135 /nfs/dbraw/zinc/01/81/35/334018135.db2.gz PBCLJJUHMVQHSM-LLVKDONJSA-N 1 0 290.285 3.724 20 5 CHBDRO CC[N@H+](CCC1CC1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000546227425 334020887 /nfs/dbraw/zinc/02/08/87/334020887.db2.gz WWDYSRBNMFDMFQ-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1c(C[N@H+](C)CCc2cccs2)cccc1[N+](=O)[O-] ZINC000075966657 334063408 /nfs/dbraw/zinc/06/34/08/334063408.db2.gz PVKYBXULKRUQDF-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000135171159 334118759 /nfs/dbraw/zinc/11/87/59/334118759.db2.gz VIIABGWGWKQPBE-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1ccc(C[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000078003607 334120249 /nfs/dbraw/zinc/12/02/49/334120249.db2.gz FGWKDYUHQXPWAX-NSHDSACASA-N 1 0 290.388 3.686 20 5 CHBDRO CC1(C)CCC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000079978475 334164931 /nfs/dbraw/zinc/16/49/31/334164931.db2.gz QGVRZRXFMIROTI-AWEZNQCLSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000081045980 334177260 /nfs/dbraw/zinc/17/72/60/334177260.db2.gz XUTODIQKGJXKIH-QWHCGFSZSA-N 1 0 264.369 3.846 20 5 CHBDRO CC(C)[C@H]1CC[C@H]1[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000552275332 334311377 /nfs/dbraw/zinc/31/13/77/334311377.db2.gz RTDHVHWBAIQMOM-OUCADQQQSA-N 1 0 262.353 3.680 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000251287222 334359384 /nfs/dbraw/zinc/35/93/84/334359384.db2.gz RAXHZAWITMDASI-BYCMXARLSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000251828321 334370521 /nfs/dbraw/zinc/37/05/21/334370521.db2.gz NGYKTDFHMOIXOS-YRGRVCCFSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccs1 ZINC000156512625 334743557 /nfs/dbraw/zinc/74/35/57/334743557.db2.gz OLWOJCPPPMRJPE-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000271462853 334743831 /nfs/dbraw/zinc/74/38/31/334743831.db2.gz HQONWEZNRXQCCG-XPKDYRNWSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)CC2CC2)cccc1[N+](=O)[O-] ZINC000164305347 334880024 /nfs/dbraw/zinc/88/00/24/334880024.db2.gz YYDAKQGVANBHOD-PWSUYJOCSA-N 1 0 262.353 3.742 20 5 CHBDRO CCC1([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CCC1 ZINC000177713087 335380860 /nfs/dbraw/zinc/38/08/60/335380860.db2.gz FSKDIPSPDUEXGL-VMPITWQZSA-N 1 0 260.337 3.530 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccccc3)CCC2)cs1 ZINC000195422798 336053360 /nfs/dbraw/zinc/05/33/60/336053360.db2.gz HEDDKKJONHYBDB-UHFFFAOYSA-N 1 0 288.372 3.825 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000381386862 336061055 /nfs/dbraw/zinc/06/10/55/336061055.db2.gz LVAUVDLMQIQQPN-IAQYHMDHSA-N 1 0 280.343 3.744 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000382081938 336081463 /nfs/dbraw/zinc/08/14/63/336081463.db2.gz FOKGVJRRMCTOIM-HNNXBMFYSA-N 1 0 290.388 3.940 20 5 CHBDRO C[C@@H](CC(C)(C)C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000384717480 336129779 /nfs/dbraw/zinc/12/97/79/336129779.db2.gz HPUIEGFYYFLFIR-NSHDSACASA-N 1 0 250.342 3.509 20 5 CHBDRO CC(C)(C[NH2+]Cc1csc([N+](=O)[O-])c1)C1CCC1 ZINC000385108904 336138941 /nfs/dbraw/zinc/13/89/41/336138941.db2.gz COHFREISYNBEDZ-UHFFFAOYSA-N 1 0 268.382 3.572 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CC23CCCC3)cc1[N+](=O)[O-] ZINC000387101051 336185309 /nfs/dbraw/zinc/18/53/09/336185309.db2.gz HGQPYUPNLFIQKP-IUODEOHRSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1c(C[N@@H+]2CCC=C(c3ccco3)C2)cccc1[N+](=O)[O-] ZINC000352550547 533843931 /nfs/dbraw/zinc/84/39/31/533843931.db2.gz OOCRRCLSZRMMPR-UHFFFAOYSA-N 1 0 298.342 3.786 20 5 CHBDRO CC(C)([NH2+]CCCCCF)c1ccccc1[N+](=O)[O-] ZINC000292162775 519321197 /nfs/dbraw/zinc/32/11/97/519321197.db2.gz ORXQKEPKVQCNRF-UHFFFAOYSA-N 1 0 268.332 3.559 20 5 CHBDRO CCO[C@@H](CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000155684266 520302280 /nfs/dbraw/zinc/30/22/80/520302280.db2.gz SCJNNRDUZSLQHO-CJNGLKHVSA-N 1 0 294.395 3.697 20 5 CHBDRO CCC[C@@H](CC)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000050401380 520688727 /nfs/dbraw/zinc/68/87/27/520688727.db2.gz PJHSNCVNOAQCME-WCQYABFASA-N 1 0 250.342 3.824 20 5 CHBDRO COC1(CC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000294546336 522594482 /nfs/dbraw/zinc/59/44/82/522594482.db2.gz KPMMMEALBYJATM-CYBMUJFWSA-N 1 0 292.379 3.513 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000070160261 524605654 /nfs/dbraw/zinc/60/56/54/524605654.db2.gz HPQJDSZWESAIMP-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293245170 525361721 /nfs/dbraw/zinc/36/17/21/525361721.db2.gz BHHRPGRDTDHECD-QWHCGFSZSA-N 1 0 299.374 3.897 20 5 CHBDRO CSC[C@@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000292353683 525652643 /nfs/dbraw/zinc/65/26/43/525652643.db2.gz HONKQYYCTMDVFB-QWHCGFSZSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000125460112 525704764 /nfs/dbraw/zinc/70/47/64/525704764.db2.gz BLFULHNQTSYILY-KRWDZBQOSA-N 1 0 297.358 3.635 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000125459918 525705626 /nfs/dbraw/zinc/70/56/26/525705626.db2.gz BLFULHNQTSYILY-QGZVFWFLSA-N 1 0 297.358 3.635 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000037668232 525733424 /nfs/dbraw/zinc/73/34/24/525733424.db2.gz AVXHZZRLEGPVBV-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000036959970 525942264 /nfs/dbraw/zinc/94/22/64/525942264.db2.gz PWWPUWRYPQGLQO-NEPJUHHUSA-N 1 0 274.320 3.908 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289647972 526107429 /nfs/dbraw/zinc/10/74/29/526107429.db2.gz DPNWYLLAMMMXHU-QWRGUYRKSA-N 1 0 284.306 3.633 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)cs1 ZINC000111397933 527330900 /nfs/dbraw/zinc/33/09/00/527330900.db2.gz CNLPYIXZEVMALS-UONOGXRCSA-N 1 0 288.372 3.550 20 5 CHBDRO O=[N+]([O-])c1ccc2oc(C[NH+]3CCCCCCC3)nc2c1 ZINC000083127495 527381747 /nfs/dbraw/zinc/38/17/47/527381747.db2.gz OCZBKMSGIYIIEP-UHFFFAOYSA-N 1 0 289.335 3.502 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2CC23CC3)cc1[N+](=O)[O-] ZINC000418090566 528099641 /nfs/dbraw/zinc/09/96/41/528099641.db2.gz DSAURJIYQJDTKX-CYBMUJFWSA-N 1 0 274.364 3.608 20 5 CHBDRO C[C@H](CCc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000013726100 567942093 /nfs/dbraw/zinc/94/20/93/567942093.db2.gz NFIKIFDXHCHXMU-CQSZACIVSA-N 1 0 284.359 3.706 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000348304010 1125505582 /nfs/dbraw/zinc/50/55/82/1125505582.db2.gz NOZZOBZPQRLWFU-HUUCEWRRSA-N 1 0 274.364 3.750 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]CC[C@H]2CCCC2(F)F)cs1 ZINC000883266853 1125389463 /nfs/dbraw/zinc/38/94/63/1125389463.db2.gz MARAWJHJZWEDGT-SNVBAGLBSA-N 1 0 290.335 3.571 20 5 CHBDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000885962919 1125631758 /nfs/dbraw/zinc/63/17/58/1125631758.db2.gz IPZUBCPQVJVRQM-MRXNPFEDSA-N 1 0 297.358 3.635 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000886105222 1125650221 /nfs/dbraw/zinc/65/02/21/1125650221.db2.gz UZYJOZMGKBNSPZ-HNNXBMFYSA-N 1 0 285.347 3.539 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000886105223 1125650337 /nfs/dbraw/zinc/65/03/37/1125650337.db2.gz UZYJOZMGKBNSPZ-OAHLLOKOSA-N 1 0 285.347 3.539 20 5 CHBDRO C[C@]1(C2CCCCC2)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886312164 1125669139 /nfs/dbraw/zinc/66/91/39/1125669139.db2.gz VIPAVMSPVARUGN-MRXNPFEDSA-N 1 0 289.379 3.535 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000037494524 1125680358 /nfs/dbraw/zinc/68/03/58/1125680358.db2.gz SHZVTYZWXBCZDX-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CCC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1CCC1 ZINC000324945034 1125728353 /nfs/dbraw/zinc/72/83/53/1125728353.db2.gz RTZYEUSBDZPUAO-LBPRGKRZSA-N 1 0 268.382 3.715 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[N@H+](CCCc1ccccc1)C2 ZINC000533801095 1125784474 /nfs/dbraw/zinc/78/44/74/1125784474.db2.gz RDAPYTFTWDJHME-UHFFFAOYSA-N 1 0 296.370 3.586 20 5 CHBDRO C[C@@H]1CCCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000482314367 1126750813 /nfs/dbraw/zinc/75/08/13/1126750813.db2.gz WIIWIRSVNUCTJB-DEBLGDTFSA-N 1 0 274.364 3.730 20 5 CHBDRO C[C@@H]([NH2+]CCCOC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000178651570 1126818387 /nfs/dbraw/zinc/81/83/87/1126818387.db2.gz QIZXBCBHXAOKSV-CYBMUJFWSA-N 1 0 292.379 3.595 20 5 CHBDRO COCCC(C)(C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000183928120 1126893481 /nfs/dbraw/zinc/89/34/81/1126893481.db2.gz CRKBDDHCSRZLBA-ZDUSSCGKSA-N 1 0 294.395 3.617 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000037176908 1126923326 /nfs/dbraw/zinc/92/33/26/1126923326.db2.gz HACKUDKWBFROIA-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO COc1cc(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000485733616 1126948578 /nfs/dbraw/zinc/94/85/78/1126948578.db2.gz BMBCJBQFKPEEOI-OCCSQVGLSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccccc2)C2CC2)cc1 ZINC000043643050 1127005393 /nfs/dbraw/zinc/00/53/93/1127005393.db2.gz ZHENJUSDTBBNRF-UHFFFAOYSA-N 1 0 282.343 3.759 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000487235835 1127026855 /nfs/dbraw/zinc/02/68/55/1127026855.db2.gz UYCMCJMQXOEEIX-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000487291787 1127030786 /nfs/dbraw/zinc/03/07/86/1127030786.db2.gz RZMRUPQBBCPLQX-VXGBXAGGSA-N 1 0 250.342 3.634 20 5 CHBDRO Cc1ccncc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000269539815 1127041548 /nfs/dbraw/zinc/04/15/48/1127041548.db2.gz AJVGATXVKMVGDC-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(C3CC3)CCC2)c(Cl)c1 ZINC000717854100 1127107267 /nfs/dbraw/zinc/10/72/67/1127107267.db2.gz JCMSKXNFTZURIT-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1CN1CC[C@H]1c1ccccc1 ZINC000348541386 1127121544 /nfs/dbraw/zinc/12/15/44/1127121544.db2.gz WTENIOCTGZRILN-HNNXBMFYSA-N 1 0 286.306 3.681 20 5 CHBDRO Cc1ccc(C[N@@H+](Cc2ccco2)C(C)C)cc1[N+](=O)[O-] ZINC000349840164 1127164847 /nfs/dbraw/zinc/16/48/47/1127164847.db2.gz OZCFWLGKCNMPBG-UHFFFAOYSA-N 1 0 288.347 3.907 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1C=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000698194858 1127189201 /nfs/dbraw/zinc/18/92/01/1127189201.db2.gz HJSRWVVVRPQWRQ-HIFRSBDPSA-N 1 0 260.337 3.744 20 5 CHBDRO CC[C@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000590067857 1127247559 /nfs/dbraw/zinc/24/75/59/1127247559.db2.gz GXHCXCWMCOPAHT-AULYBMBSSA-N 1 0 280.343 3.792 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@@H](SC)C1)c1cccc([N+](=O)[O-])c1 ZINC000224288062 1127257969 /nfs/dbraw/zinc/25/79/69/1127257969.db2.gz YMXYNKRRJGCSHJ-YUELXQCFSA-N 1 0 294.420 3.920 20 5 CHBDRO Cc1ccc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2C)cn1 ZINC000353164559 1127263223 /nfs/dbraw/zinc/26/32/23/1127263223.db2.gz ICZURTRNTUSELU-UHFFFAOYSA-N 1 0 299.374 3.632 20 5 CHBDRO CC/C=C/CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000466813193 1127269385 /nfs/dbraw/zinc/26/93/85/1127269385.db2.gz OXZMPPLQIZKADO-ONEGZZNKSA-N 1 0 274.364 3.916 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCCC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000355216007 1127326175 /nfs/dbraw/zinc/32/61/75/1127326175.db2.gz IQZPKXUUGSHHFB-UHFFFAOYSA-N 1 0 274.364 3.669 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)CC(F)F)cc1[N+](=O)[O-] ZINC000592392238 1127344643 /nfs/dbraw/zinc/34/46/43/1127344643.db2.gz JYZVUIMSPOKIGV-MWLCHTKSSA-N 1 0 286.322 3.845 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)CC(F)F)cc1[N+](=O)[O-] ZINC000592392237 1127344824 /nfs/dbraw/zinc/34/48/24/1127344824.db2.gz JYZVUIMSPOKIGV-KOLCDFICSA-N 1 0 286.322 3.845 20 5 CHBDRO CC[N@H+](CCc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000058506493 1127355835 /nfs/dbraw/zinc/35/58/35/1127355835.db2.gz QXRSERJIDYWTGQ-UHFFFAOYSA-N 1 0 284.359 3.659 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCC23CCCC3)ccc1[N+](=O)[O-] ZINC000593037887 1127369337 /nfs/dbraw/zinc/36/93/37/1127369337.db2.gz DJVZIFVETOOUGB-UHFFFAOYSA-N 1 0 290.363 3.512 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594499286 1127418426 /nfs/dbraw/zinc/41/84/26/1127418426.db2.gz BYPWOVXROGIBRL-RISCZKNCSA-N 1 0 262.353 3.606 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000594515396 1127421054 /nfs/dbraw/zinc/42/10/54/1127421054.db2.gz PPHCTDKFIAUEPD-GXTWGEPZSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCSCC1)c1ccccc1[N+](=O)[O-] ZINC000595024826 1127442869 /nfs/dbraw/zinc/44/28/69/1127442869.db2.gz CCXAXFIHXLQUBV-NWDGAFQWSA-N 1 0 280.393 3.531 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1F ZINC000595051257 1127451192 /nfs/dbraw/zinc/45/11/92/1127451192.db2.gz MQLQLPGWPFZPFZ-ZLKJLUDKSA-N 1 0 296.342 3.535 20 5 CHBDRO CC[C@H]([NH2+]CCc1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000595075168 1127452973 /nfs/dbraw/zinc/45/29/73/1127452973.db2.gz WPCALVGCEADOLX-KRWDZBQOSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)cccc1[N+](=O)[O-] ZINC000595082277 1127453512 /nfs/dbraw/zinc/45/35/12/1127453512.db2.gz XNDWHBWBQWOTQP-RISCZKNCSA-N 1 0 298.333 3.989 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000595078828 1127453663 /nfs/dbraw/zinc/45/36/63/1127453663.db2.gz BGIHOLBBEHFYNR-BXUZGUMPSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)cccc1[N+](=O)[O-] ZINC000595095014 1127455471 /nfs/dbraw/zinc/45/54/71/1127455471.db2.gz SVBTUVWBWKMKNN-ZWNOBZJWSA-N 1 0 298.333 3.845 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CC1=CCCC1)C1CC1 ZINC000595096864 1127455919 /nfs/dbraw/zinc/45/59/19/1127455919.db2.gz NEOIEHJHGYPAOB-INIZCTEOSA-N 1 0 286.375 3.616 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000227152032 1127458170 /nfs/dbraw/zinc/45/81/70/1127458170.db2.gz DCRBHKBIAOVQFO-YWPYICTPSA-N 1 0 276.380 3.818 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1CCCC1)CCC2 ZINC000574956395 1127459743 /nfs/dbraw/zinc/45/97/43/1127459743.db2.gz SDOHUKINFCITFH-INIZCTEOSA-N 1 0 274.364 3.752 20 5 CHBDRO C[N@H+](CCCc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000046784017 1127459939 /nfs/dbraw/zinc/45/99/39/1127459939.db2.gz DMZPOOURZHNJLY-UHFFFAOYSA-N 1 0 284.359 3.659 20 5 CHBDRO Cc1noc(C[NH2+][C@@H]2CCCC[C@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595364511 1127461532 /nfs/dbraw/zinc/46/15/32/1127461532.db2.gz SMTBPKHUYUEWQG-VXGBXAGGSA-N 1 0 295.383 3.586 20 5 CHBDRO Cc1noc(C[NH2+][C@@H](CCC(C)C)C(C)(C)C)c1[N+](=O)[O-] ZINC000595420506 1127462245 /nfs/dbraw/zinc/46/22/45/1127462245.db2.gz GUHWNUCFJOPMHW-ZDUSSCGKSA-N 1 0 297.399 3.832 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCC23CC3)cc1[N+](=O)[O-] ZINC000597059368 1127526068 /nfs/dbraw/zinc/52/60/68/1127526068.db2.gz JTPJIEZLOMQVIE-DOMZBBRYSA-N 1 0 274.364 3.887 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCCF)o2)cc1 ZINC000361062700 1127534979 /nfs/dbraw/zinc/53/49/79/1127534979.db2.gz WEWLBHPCVHUHQG-UHFFFAOYSA-N 1 0 292.310 3.694 20 5 CHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC1(F)F ZINC000602560636 1127592824 /nfs/dbraw/zinc/59/28/24/1127592824.db2.gz ODBFJCVENKCRMK-FZMZJTMJSA-N 1 0 298.333 3.551 20 5 CHBDRO CC[C@@H](C)C[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602559562 1127593044 /nfs/dbraw/zinc/59/30/44/1127593044.db2.gz FIUBBRQNSHKXJP-MNOVXSKESA-N 1 0 291.351 3.650 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000598680112 1127631181 /nfs/dbraw/zinc/63/11/81/1127631181.db2.gz UJFWBQGRIPZHQV-ZYHUDNBSSA-N 1 0 284.306 3.599 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)cc1 ZINC000598992955 1127650686 /nfs/dbraw/zinc/65/06/86/1127650686.db2.gz FAEBGHSWVFKUTR-QGZVFWFLSA-N 1 0 297.358 3.621 20 5 CHBDRO CCC[C@H](C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)OCC ZINC000599057940 1127653481 /nfs/dbraw/zinc/65/34/81/1127653481.db2.gz CUJYMZIBXZLICT-DZGCQCFKSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1C[C@@H](C)C(F)(F)[C@H](C)C1 ZINC000599059222 1127653658 /nfs/dbraw/zinc/65/36/58/1127653658.db2.gz PXEAYSYBZQJZGI-IJLUTSLNSA-N 1 0 298.333 3.879 20 5 CHBDRO Cc1ccnc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000295963449 1127658963 /nfs/dbraw/zinc/65/89/63/1127658963.db2.gz IAQMNVYPDUCKRX-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccncc1CCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000295981668 1127659678 /nfs/dbraw/zinc/65/96/78/1127659678.db2.gz JMQOMWFYOZCYLL-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1cccnc1CCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000296464451 1127672170 /nfs/dbraw/zinc/67/21/70/1127672170.db2.gz NLSJSMSKRFKVLS-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000229394863 1127679833 /nfs/dbraw/zinc/67/98/33/1127679833.db2.gz GIAQQCOBQCJSQC-GRYCIOLGSA-N 1 0 280.343 3.600 20 5 CHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1ccsc1[N+](=O)[O-] ZINC000604433515 1127705893 /nfs/dbraw/zinc/70/58/93/1127705893.db2.gz SWXRDDQBUULGPO-GFCCVEGCSA-N 1 0 297.424 3.723 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]Cc1ccc(Cl)o1 ZINC000608835473 1127889756 /nfs/dbraw/zinc/88/97/56/1127889756.db2.gz KMGMIDJHZULZHQ-HWKANZROSA-N 1 0 292.722 3.644 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000539500751 1127925918 /nfs/dbraw/zinc/92/59/18/1127925918.db2.gz OZOFEJZYCHAHQZ-GZBFAFLISA-N 1 0 274.364 3.653 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@]1(C)CC1(F)F ZINC000594976370 1127936014 /nfs/dbraw/zinc/93/60/14/1127936014.db2.gz BGOZHYUJLYOTEL-RQWJFSOLSA-N 1 0 296.317 3.633 20 5 CHBDRO C[C@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2)CCCc2ccccc21 ZINC000539798214 1127940094 /nfs/dbraw/zinc/94/00/94/1127940094.db2.gz CAMWHXHLAPQXPX-SFHVURJKSA-N 1 0 296.370 3.936 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000540165116 1127966583 /nfs/dbraw/zinc/96/65/83/1127966583.db2.gz VPZQEOCOCHIWCW-CMPLNLGQSA-N 1 0 284.306 3.823 20 5 CHBDRO Cc1ccc(C[N@H+](C)C[C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000544368200 1127970655 /nfs/dbraw/zinc/97/06/55/1127970655.db2.gz IZOFTHMRDMUWNE-CQSZACIVSA-N 1 0 274.364 3.691 20 5 CHBDRO CS[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1C)C(C)(C)C ZINC000544597554 1127978358 /nfs/dbraw/zinc/97/83/58/1127978358.db2.gz HJAYEESFAKHALW-AWEZNQCLSA-N 1 0 296.436 3.771 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1C(C)C ZINC000544603739 1127978010 /nfs/dbraw/zinc/97/80/10/1127978010.db2.gz DCGSPJJOCHFKTB-HNNXBMFYSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000544610926 1127978584 /nfs/dbraw/zinc/97/85/84/1127978584.db2.gz FOEKJJCZEODVTK-GJZGRUSLSA-N 1 0 274.364 3.525 20 5 CHBDRO C[C@H]1Cc2ccccc2[C@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000467985162 1127986817 /nfs/dbraw/zinc/98/68/17/1127986817.db2.gz RCYXJBNSPCDPSG-UGSOOPFHSA-N 1 0 296.370 3.660 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CC=CCC1 ZINC000468640193 1128014957 /nfs/dbraw/zinc/01/49/57/1128014957.db2.gz VRROCMNIAXJZTD-VOMSXAGXSA-N 1 0 272.348 3.696 20 5 CHBDRO CCC1(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000468749004 1128019947 /nfs/dbraw/zinc/01/99/47/1128019947.db2.gz YXCNRUHQVJIMJQ-UKTHLTGXSA-N 1 0 274.364 3.778 20 5 CHBDRO CC[C@]1(C)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000541773664 1128038231 /nfs/dbraw/zinc/03/82/31/1128038231.db2.gz HSMJCVFDTBCAFY-OAHLLOKOSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@H]2CCCC[C@H]12 ZINC000542040500 1128049004 /nfs/dbraw/zinc/04/90/04/1128049004.db2.gz LCIRLVLNHXGBGD-RTXFEEFZSA-N 1 0 280.393 3.667 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H](C)C(C)C ZINC000470169061 1128064319 /nfs/dbraw/zinc/06/43/19/1128064319.db2.gz BCJHJOKMTWWYTF-SSUFTNFISA-N 1 0 276.380 3.974 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C)CC1 ZINC000470176936 1128064618 /nfs/dbraw/zinc/06/46/18/1128064618.db2.gz OFSIPJJQVWVTHZ-UVTDQMKNSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)C[C@H]1C ZINC000470178877 1128064646 /nfs/dbraw/zinc/06/46/46/1128064646.db2.gz PDVKLXBYYFDULY-ZMCCTTKHSA-N 1 0 274.364 3.728 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C1CCCC1 ZINC000470176211 1128064775 /nfs/dbraw/zinc/06/47/75/1128064775.db2.gz JHOLCZZHTBWPNP-RAXLEYEMSA-N 1 0 274.364 3.873 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C)[C@H]1C ZINC000470180544 1128065342 /nfs/dbraw/zinc/06/53/42/1128065342.db2.gz OQZOPUGEGPPXTC-UYEGUDHTSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000271941517 1128081931 /nfs/dbraw/zinc/08/19/31/1128081931.db2.gz UGRSRUKOZFMXOK-ZENOOKHLSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000471022909 1128085453 /nfs/dbraw/zinc/08/54/53/1128085453.db2.gz QRSIAWROHQMFIE-KSSFIOAISA-N 1 0 296.370 3.830 20 5 CHBDRO CC(C)[NH+](Cc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000492935282 1128116877 /nfs/dbraw/zinc/11/68/77/1128116877.db2.gz FXRNLQLPHYRDJZ-UHFFFAOYSA-N 1 0 270.760 3.867 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761507757 1128131960 /nfs/dbraw/zinc/13/19/60/1128131960.db2.gz VXKFNMQSBFABNS-SNVBAGLBSA-N 1 0 270.760 3.725 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524280 1128132328 /nfs/dbraw/zinc/13/23/28/1128132328.db2.gz ZNQMZTONZNJEKX-NXEZZACHSA-N 1 0 270.760 3.772 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761521070 1128132859 /nfs/dbraw/zinc/13/28/59/1128132859.db2.gz IUEUJEYMVVOZEM-MFKMUULPSA-N 1 0 282.771 3.917 20 5 CHBDRO CCC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC1CC1 ZINC000494177392 1128158106 /nfs/dbraw/zinc/15/81/06/1128158106.db2.gz WVSXDZHBGDSXBO-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO Cc1cscc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000094880994 1128274565 /nfs/dbraw/zinc/27/45/65/1128274565.db2.gz CBGDPDBLLGRHEA-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000035648792 1128323528 /nfs/dbraw/zinc/32/35/28/1128323528.db2.gz DCRBHKBIAOVQFO-SLEUVZQESA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000089551605 1128329382 /nfs/dbraw/zinc/32/93/82/1128329382.db2.gz DHORFPWWKZENPN-JKOKRWQUSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1ccc([N+](=O)[O-])cc1 ZINC000301090964 1128332944 /nfs/dbraw/zinc/33/29/44/1128332944.db2.gz KPZCUVJPVRVVRZ-AWEZNQCLSA-N 1 0 291.395 3.661 20 5 CHBDRO C[C@@H]([NH2+]CC1(C2CC2)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000090724247 1128372285 /nfs/dbraw/zinc/37/22/85/1128372285.db2.gz PYWJUIFQOLUEEA-GFCCVEGCSA-N 1 0 274.364 3.826 20 5 CHBDRO CSCC1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000932592282 1128416966 /nfs/dbraw/zinc/41/69/66/1128416966.db2.gz SIVZJEZOUINXNY-LBPRGKRZSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1cc(C)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)n1 ZINC000932177209 1128398826 /nfs/dbraw/zinc/39/88/26/1128398826.db2.gz SQNKAQKDUVJIBG-CYBMUJFWSA-N 1 0 299.374 3.766 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1cncs1 ZINC000934194813 1128454067 /nfs/dbraw/zinc/45/40/67/1128454067.db2.gz HPPMIMUIMVJBTI-GHMZBOCLSA-N 1 0 291.376 3.772 20 5 CHBDRO C[C@@H](F)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000563297198 1128459229 /nfs/dbraw/zinc/45/92/29/1128459229.db2.gz ZEYKKPLWABLIDW-LLVKDONJSA-N 1 0 292.310 3.693 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@@H]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000917096888 1128480985 /nfs/dbraw/zinc/48/09/85/1128480985.db2.gz HKIPXWYTNBDCGR-SWLSCSKDSA-N 1 0 276.380 3.914 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC3(CCC3)C2)ccc1Cl ZINC000154313193 1128490913 /nfs/dbraw/zinc/49/09/13/1128490913.db2.gz JPBBXEZGLYEAEV-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccccc1F ZINC000565216073 1128521346 /nfs/dbraw/zinc/52/13/46/1128521346.db2.gz JANGQSKWQONGCZ-HNNXBMFYSA-N 1 0 286.306 3.511 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000556958663 1128651843 /nfs/dbraw/zinc/65/18/43/1128651843.db2.gz JZJFWKVQMFEKTO-QTLSWZBMSA-N 1 0 286.375 3.730 20 5 CHBDRO CC(C)[NH+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C(C)C ZINC000778956661 1128671439 /nfs/dbraw/zinc/67/14/39/1128671439.db2.gz OLWYYDCNMKFHAA-UHFFFAOYSA-N 1 0 270.760 3.867 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000601307236 1128709556 /nfs/dbraw/zinc/70/95/56/1128709556.db2.gz XOUOTRIMVJRPPJ-JMJZKYOTSA-N 1 0 288.269 3.505 20 5 CHBDRO CC(C)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350011 1128713967 /nfs/dbraw/zinc/71/39/67/1128713967.db2.gz XZNAQXRKXGMLMD-UHFFFAOYSA-N 1 0 264.369 3.851 20 5 CHBDRO O=[N+]([O-])c1ccc(NCCCCC[NH+]2CCCCC2)s1 ZINC000609517183 1128716496 /nfs/dbraw/zinc/71/64/96/1128716496.db2.gz WYISJPOJBVQAIX-UHFFFAOYSA-N 1 0 297.424 3.724 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705380 1128723069 /nfs/dbraw/zinc/72/30/69/1128723069.db2.gz XTALTLVWLRGYFA-LLVKDONJSA-N 1 0 282.771 3.870 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1C1CC1 ZINC000609705066 1128723238 /nfs/dbraw/zinc/72/32/38/1128723238.db2.gz MOXUZTWYHLEEOT-ZDUSSCGKSA-N 1 0 280.755 3.623 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000609766760 1128724600 /nfs/dbraw/zinc/72/46/00/1128724600.db2.gz OGRRFVRODVCYKG-CQSZACIVSA-N 1 0 276.380 3.915 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000430193998 1117840405 /nfs/dbraw/zinc/84/04/05/1117840405.db2.gz HSARYLYYBFSMDN-GXTWGEPZSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610215372 1117881832 /nfs/dbraw/zinc/88/18/32/1117881832.db2.gz JETLCCMMILJNBH-QWHCGFSZSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1cc(NC[C@@H](C)[N@@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000510096001 1117882294 /nfs/dbraw/zinc/88/22/94/1117882294.db2.gz VQUJWRPEDIFWKW-UONOGXRCSA-N 1 0 291.395 3.578 20 5 CHBDRO CC[C@@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000109133980 1117920026 /nfs/dbraw/zinc/92/00/26/1117920026.db2.gz APHVWMYQUIYDBB-ZJUUUORDSA-N 1 0 270.760 3.772 20 5 CHBDRO COc1cc(C[N@H+](CC2CCC2)C(C)C)ccc1[N+](=O)[O-] ZINC000444776569 1117930349 /nfs/dbraw/zinc/93/03/49/1117930349.db2.gz MEPLSSQCVZBSED-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@H](Cc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000112466748 1118059909 /nfs/dbraw/zinc/05/99/09/1118059909.db2.gz MSLSHSNQWKNHSH-MRXNPFEDSA-N 1 0 284.359 3.706 20 5 CHBDRO O=[N+]([O-])c1cccc(Nc2ccccc2C[NH+]2CCCC2)c1 ZINC001204456584 1118087156 /nfs/dbraw/zinc/08/71/56/1118087156.db2.gz PQVBVIIUPBRUBL-UHFFFAOYSA-N 1 0 297.358 3.934 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000610369520 1118362104 /nfs/dbraw/zinc/36/21/04/1118362104.db2.gz KUFNWEVDXSFLNZ-CHWSQXEVSA-N 1 0 286.331 3.738 20 5 CHBDRO CC[C@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000071117710 1118436574 /nfs/dbraw/zinc/43/65/74/1118436574.db2.gz ACUCVNYASBUGFW-JSGCOSHPSA-N 1 0 262.353 3.653 20 5 CHBDRO CC[C@H]([NH2+]CCSC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000311833272 1118532443 /nfs/dbraw/zinc/53/24/43/1118532443.db2.gz KVSRDMSRYFJVQH-AWEZNQCLSA-N 1 0 282.409 3.777 20 5 CHBDRO OC1(C[NH2+]Cc2c3ccccc3cc3ccccc32)CCC1 ZINC000238156979 1128788440 /nfs/dbraw/zinc/78/84/40/1128788440.db2.gz BFPCENHJOADWBE-UHFFFAOYSA-N 1 0 291.394 3.998 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC000090856346 1118646628 /nfs/dbraw/zinc/64/66/28/1118646628.db2.gz FVGLRIRSFYSJSF-VXGBXAGGSA-N 1 0 292.379 3.833 20 5 CHBDRO Cc1c(C[N@@H+]2CC[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000477222125 1118655785 /nfs/dbraw/zinc/65/57/85/1118655785.db2.gz MKTMLIHRTNBVQB-KRWDZBQOSA-N 1 0 296.370 3.893 20 5 CHBDRO CCc1ccccc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000084200404 1118680506 /nfs/dbraw/zinc/68/05/06/1118680506.db2.gz CYJDUGJHNIAGMR-UHFFFAOYSA-N 1 0 284.359 3.755 20 5 CHBDRO CC(C)[C@H]1CC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000796837519 1118723874 /nfs/dbraw/zinc/72/38/74/1118723874.db2.gz DFBDGDMSTVNOJY-TZMCWYRMSA-N 1 0 282.771 3.772 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C2CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000395309746 1118762245 /nfs/dbraw/zinc/76/22/45/1118762245.db2.gz XQGLQMFJKDASAR-LLVKDONJSA-N 1 0 262.353 3.742 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000610787688 1118869137 /nfs/dbraw/zinc/86/91/37/1118869137.db2.gz BBLNXMJBTASKCR-GFCCVEGCSA-N 1 0 298.333 3.996 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CC1CC1)C(C)C ZINC000535786477 1118886446 /nfs/dbraw/zinc/88/64/46/1118886446.db2.gz CSFDJUVFPSMSPV-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](C)c2ccncc2)cccc1[N+](=O)[O-] ZINC000610831193 1118897701 /nfs/dbraw/zinc/89/77/01/1118897701.db2.gz JLBWDVJZDNZFSK-TZMCWYRMSA-N 1 0 299.374 3.753 20 5 CHBDRO C[C@@H](CCO)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000119629283 1118956936 /nfs/dbraw/zinc/95/69/36/1118956936.db2.gz FAHPHFOFWHISFL-AWEZNQCLSA-N 1 0 279.383 3.854 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)c(Cl)c1 ZINC000511044552 1118973257 /nfs/dbraw/zinc/97/32/57/1118973257.db2.gz BXZTXLYYYCPMKB-UKRRQHHQSA-N 1 0 294.782 3.917 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)Cc1cccnc1 ZINC000934234772 1118985418 /nfs/dbraw/zinc/98/54/18/1118985418.db2.gz QOMDWMUODUMWJR-UONOGXRCSA-N 1 0 299.374 3.580 20 5 CHBDRO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CCC1 ZINC000127456148 1119055947 /nfs/dbraw/zinc/05/59/47/1119055947.db2.gz IEOHCZKDZNLFPW-UHFFFAOYSA-N 1 0 286.331 3.839 20 5 CHBDRO C[C@@H](C[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511105280 1119062607 /nfs/dbraw/zinc/06/26/07/1119062607.db2.gz IPWOJOIHKJRQOX-HNNXBMFYSA-N 1 0 298.386 3.873 20 5 CHBDRO CC1(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000479441392 1119116398 /nfs/dbraw/zinc/11/63/98/1119116398.db2.gz VPOCCGYKJCRTOW-HNNXBMFYSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2ncccc21)c1ccccc1[N+](=O)[O-] ZINC000601272258 1119376587 /nfs/dbraw/zinc/37/65/87/1119376587.db2.gz AEVAKIOBBSLJOO-MLGOLLRUSA-N 1 0 297.358 3.718 20 5 CHBDRO CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000052873204 1119486232 /nfs/dbraw/zinc/48/62/32/1119486232.db2.gz RVHKJJGTMCQIGO-UHFFFAOYSA-N 1 0 262.353 3.749 20 5 CHBDRO Cc1c(C[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000250893055 1119536063 /nfs/dbraw/zinc/53/60/63/1119536063.db2.gz QQADEAKDIOIZLQ-JYAVWHMHSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1c(C[NH2+]Cc2coc3ccccc23)cccc1[N+](=O)[O-] ZINC000318271431 1119559693 /nfs/dbraw/zinc/55/96/93/1119559693.db2.gz LQCNBDAEEJCVHW-UHFFFAOYSA-N 1 0 296.326 3.939 20 5 CHBDRO Cc1c(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000480489771 1119589348 /nfs/dbraw/zinc/58/93/48/1119589348.db2.gz XFMPPYVZRNSNNJ-IAGOWNOFSA-N 1 0 296.370 3.797 20 5 CHBDRO CCCC[NH+](CCCC)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000062351405 1119779143 /nfs/dbraw/zinc/77/91/43/1119779143.db2.gz XULIINCJBQBRGF-INIZCTEOSA-N 1 0 294.395 3.530 20 5 CHBDRO COC1([C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000414325755 1119984074 /nfs/dbraw/zinc/98/40/74/1119984074.db2.gz XORIDAMZKSQKNS-CHWSQXEVSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCCCCCC2)c(F)c1 ZINC000311770436 1120106987 /nfs/dbraw/zinc/10/69/87/1120106987.db2.gz VXSBFYGPGQVPNM-UHFFFAOYSA-N 1 0 266.316 3.500 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])s1 ZINC000062726421 1120206023 /nfs/dbraw/zinc/20/60/23/1120206023.db2.gz VIMZGAUPDCIROC-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000132109230 1120352281 /nfs/dbraw/zinc/35/22/81/1120352281.db2.gz RKRAERYUGCYHFQ-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO Cc1ccc(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])o1 ZINC000255325030 1120352361 /nfs/dbraw/zinc/35/23/61/1120352361.db2.gz XQMWEIIHRAMQAW-ALCCZGGFSA-N 1 0 286.331 3.641 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000020092197 1120481049 /nfs/dbraw/zinc/48/10/49/1120481049.db2.gz GIBQQWIHJUYFJH-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@@H]1CCC[N@@H+](C(C)(C)CNc2sccc2[N+](=O)[O-])C1 ZINC000301994866 1120528272 /nfs/dbraw/zinc/52/82/72/1120528272.db2.gz PAJNPQNZDPYOMI-LLVKDONJSA-N 1 0 297.424 3.579 20 5 CHBDRO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000922671079 1120576861 /nfs/dbraw/zinc/57/68/61/1120576861.db2.gz LSCGQBHEDJGKLD-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@H](C[C@](C)(O)CC)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000925690762 1120599076 /nfs/dbraw/zinc/59/90/76/1120599076.db2.gz HBPLJNYLLCKQLZ-WOSRLPQWSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1cc(N2CCCC3(CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302287228 1120650810 /nfs/dbraw/zinc/65/08/10/1120650810.db2.gz WAFJKNWUMXFYTG-UHFFFAOYSA-N 1 0 297.358 3.832 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000132493824 1120692383 /nfs/dbraw/zinc/69/23/83/1120692383.db2.gz VOSSMUFFFZYVSO-WHOFXGATSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1nc(C)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000313242015 1120696274 /nfs/dbraw/zinc/69/62/74/1120696274.db2.gz VOGUUJMYZBGZKV-SECBINFHSA-N 1 0 291.376 3.519 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC000090856345 1128935189 /nfs/dbraw/zinc/93/51/89/1128935189.db2.gz FVGLRIRSFYSJSF-RYUDHWBXSA-N 1 0 292.379 3.833 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)o1 ZINC000044730372 1120731515 /nfs/dbraw/zinc/73/15/15/1120731515.db2.gz QTVDIAZWDCDPOS-LBPRGKRZSA-N 1 0 288.347 3.964 20 5 CHBDRO O=[N+]([O-])c1cc(CN2CCC[C@@H]2c2ccccc2)cs1 ZINC000048609558 1120835239 /nfs/dbraw/zinc/83/52/39/1120835239.db2.gz ABQXHZOESHOWQT-CQSZACIVSA-N 1 0 288.372 3.993 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000093632510 1120835662 /nfs/dbraw/zinc/83/56/62/1120835662.db2.gz NRFPWJMEIYVXGP-MFKMUULPSA-N 1 0 282.771 3.917 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000049153297 1120852758 /nfs/dbraw/zinc/85/27/58/1120852758.db2.gz WCCVJIKCVLXJHI-OAHLLOKOSA-N 1 0 290.388 3.940 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCS[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000313502736 1121003461 /nfs/dbraw/zinc/00/34/61/1121003461.db2.gz JGCITYDAXMIDAQ-GLQYFDAESA-N 1 0 294.420 3.920 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc2[nH]ccc21)c1cccc([N+](=O)[O-])c1 ZINC000171130820 1121094784 /nfs/dbraw/zinc/09/47/84/1121094784.db2.gz LNHXEJAROKFARE-LBPRGKRZSA-N 1 0 295.342 3.927 20 5 CHBDRO C[N@H+](CCCNc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000038880779 1121132874 /nfs/dbraw/zinc/13/28/74/1121132874.db2.gz RQSUTDPWEMFQFD-UHFFFAOYSA-N 1 0 299.374 3.529 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 ZINC000040444252 1121181605 /nfs/dbraw/zinc/18/16/05/1121181605.db2.gz SZLVBOUQFOCERP-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1c(C[N@H+]2CCCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000512203218 1121197978 /nfs/dbraw/zinc/19/79/78/1121197978.db2.gz PFGWYKPZFZOQFS-LBPRGKRZSA-N 1 0 262.353 3.668 20 5 CHBDRO CC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCC1 ZINC000706761981 1121439503 /nfs/dbraw/zinc/43/95/03/1121439503.db2.gz LLBOWXACIQSLLN-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1(C)CC1 ZINC000706905969 1121444678 /nfs/dbraw/zinc/44/46/78/1121444678.db2.gz RIGMMSYZFBVPTJ-VIFPVBQESA-N 1 0 268.744 3.526 20 5 CHBDRO CCC1(CC)CCC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001175898218 1121474162 /nfs/dbraw/zinc/47/41/62/1121474162.db2.gz JUTHXQPFAFCTOV-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccsc1 ZINC000120456216 1121531741 /nfs/dbraw/zinc/53/17/41/1121531741.db2.gz VTFPOTMVDXNZCL-GQCTYLIASA-N 1 0 288.372 3.802 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000543631497 1121539182 /nfs/dbraw/zinc/53/91/82/1121539182.db2.gz NNLZYKUZOCVZCK-CJNGLKHVSA-N 1 0 274.364 3.668 20 5 CHBDRO Cc1ccc(C[NH+]2C3CCCC2CCC3)cc1[N+](=O)[O-] ZINC000611273969 1121633749 /nfs/dbraw/zinc/63/37/49/1121633749.db2.gz AKGQLOPTXVHZBE-UHFFFAOYSA-N 1 0 274.364 3.810 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H](OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000611337070 1121637892 /nfs/dbraw/zinc/63/78/92/1121637892.db2.gz OKQKYYOOJUFPSJ-BPUTZDHNSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC=CCC3)o2)c1 ZINC000611521154 1121653936 /nfs/dbraw/zinc/65/39/36/1121653936.db2.gz ITLJLSLFFRRCMM-UHFFFAOYSA-N 1 0 284.315 3.617 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000398213969 1121712687 /nfs/dbraw/zinc/71/26/87/1121712687.db2.gz LACRMCQASZLKJE-NEPJUHHUSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC1(C2CC2)CCC1 ZINC001178272162 1121777184 /nfs/dbraw/zinc/77/71/84/1121777184.db2.gz GOMCWGSXUTYCIY-UHFFFAOYSA-N 1 0 288.391 3.882 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC2CC(C)C2)cc1[N+](=O)[O-] ZINC001179228636 1121861852 /nfs/dbraw/zinc/86/18/52/1121861852.db2.gz OIEHGSCDEQPPJU-UHFFFAOYSA-N 1 0 276.380 3.854 20 5 CHBDRO C[N@H+](CCCCNc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000413349434 1122014975 /nfs/dbraw/zinc/01/49/75/1122014975.db2.gz RSGWLOKNKJQVJU-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCC[C@@H]1C ZINC000501927174 1122024625 /nfs/dbraw/zinc/02/46/25/1122024625.db2.gz JQOIBTKJTVYSBP-WFASDCNBSA-N 1 0 292.379 3.660 20 5 CHBDRO CC[C@H](C)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000421376217 1122105694 /nfs/dbraw/zinc/10/56/94/1122105694.db2.gz IZYIQFMDCGVEBB-STQMWFEESA-N 1 0 264.369 3.552 20 5 CHBDRO Cc1ccc(C[NH2+]C2CCCCCC2)cc1[N+](=O)[O-] ZINC000034995198 1122135346 /nfs/dbraw/zinc/13/53/46/1122135346.db2.gz SSICAKGRTJZFDR-UHFFFAOYSA-N 1 0 262.353 3.716 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000034995608 1122136463 /nfs/dbraw/zinc/13/64/63/1122136463.db2.gz NMCPDXOSADIIQD-RISCZKNCSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000035010718 1122148061 /nfs/dbraw/zinc/14/80/61/1122148061.db2.gz XXVDLISQOXCOFE-SNVBAGLBSA-N 1 0 292.285 3.724 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC001184044778 1122252477 /nfs/dbraw/zinc/25/24/77/1122252477.db2.gz DJXWQOXYOQKOPP-CHWSQXEVSA-N 1 0 276.380 3.867 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505307359 1122356565 /nfs/dbraw/zinc/35/65/65/1122356565.db2.gz DSTJLOULXXIYCO-AWEZNQCLSA-N 1 0 262.353 3.668 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCSC(C)(C)CC1 ZINC000434715201 1122396387 /nfs/dbraw/zinc/39/63/87/1122396387.db2.gz WWKIYCKGSZOSQM-GFCCVEGCSA-N 1 0 294.420 3.873 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCSC(C)(C)CC1 ZINC000434715202 1122396422 /nfs/dbraw/zinc/39/64/22/1122396422.db2.gz WWKIYCKGSZOSQM-LBPRGKRZSA-N 1 0 294.420 3.873 20 5 CHBDRO CC(C)[C@@H]1[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000430101273 1122404404 /nfs/dbraw/zinc/40/44/04/1122404404.db2.gz NHMRFANLSXVVCP-HNNXBMFYSA-N 1 0 274.364 3.605 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CC(C)(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000434754616 1122409883 /nfs/dbraw/zinc/40/98/83/1122409883.db2.gz GKLVNFIZQSNVFV-AAEUAGOBSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1ccc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000505607849 1122434737 /nfs/dbraw/zinc/43/47/37/1122434737.db2.gz KNYHQQGIUWACKG-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505629600 1122442656 /nfs/dbraw/zinc/44/26/56/1122442656.db2.gz BGZQURSKWCLZKL-FZMZJTMJSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1ccc(Cn2cnc3c2C[C@@H](C)[C@@H](C)C3)cc1[N+](=O)[O-] ZINC001189416763 1122500865 /nfs/dbraw/zinc/50/08/65/1122500865.db2.gz ZWKVKVLFIJMEBF-QWHCGFSZSA-N 1 0 299.374 3.519 20 5 CHBDRO Cc1ccc(Cn2cnc3c2C[C@H](C)[C@@H](C)C3)cc1[N+](=O)[O-] ZINC001189416764 1122501188 /nfs/dbraw/zinc/50/11/88/1122501188.db2.gz ZWKVKVLFIJMEBF-STQMWFEESA-N 1 0 299.374 3.519 20 5 CHBDRO C[C@@H]([NH2+]CCF)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000436308458 1122538559 /nfs/dbraw/zinc/53/85/59/1122538559.db2.gz PRQOQYMHTZWENQ-SNVBAGLBSA-N 1 0 294.351 3.943 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000437049693 1122607444 /nfs/dbraw/zinc/60/74/44/1122607444.db2.gz YPJBRPSSYJVHAQ-SGMGOOAPSA-N 1 0 292.379 3.833 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000437049691 1122607896 /nfs/dbraw/zinc/60/78/96/1122607896.db2.gz YPJBRPSSYJVHAQ-MBNYWOFBSA-N 1 0 292.379 3.833 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000516558723 1122611671 /nfs/dbraw/zinc/61/16/71/1122611671.db2.gz DGGZWXNVNYJHMI-NEPJUHHUSA-N 1 0 298.333 3.941 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@@H]1C ZINC001193413277 1122690700 /nfs/dbraw/zinc/69/07/00/1122690700.db2.gz MJIUBKZDGMADSN-XJKSGUPXSA-N 1 0 276.380 3.995 20 5 CHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000506220219 1122697924 /nfs/dbraw/zinc/69/79/24/1122697924.db2.gz VAEDHLRDBZZDCI-TZMCWYRMSA-N 1 0 262.353 3.605 20 5 CHBDRO CC(C)C[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000506477987 1122750411 /nfs/dbraw/zinc/75/04/11/1122750411.db2.gz RJCMSWAKBKMGRC-UHFFFAOYSA-N 1 0 288.347 3.943 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000086642403 1122784652 /nfs/dbraw/zinc/78/46/52/1122784652.db2.gz MTROTXOCJAYNCV-UHFFFAOYSA-N 1 0 250.342 3.653 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1cccc([N+](=O)[O-])c1C ZINC001194782936 1122799041 /nfs/dbraw/zinc/79/90/41/1122799041.db2.gz YJPQOPFZCRKAGS-UHFFFAOYSA-N 1 0 264.369 3.914 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000015301337 1122800750 /nfs/dbraw/zinc/80/07/50/1122800750.db2.gz PNJTZRKGMVUFIE-CQSZACIVSA-N 1 0 288.372 3.993 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H]1CC1(C)C ZINC000426569505 1122823955 /nfs/dbraw/zinc/82/39/55/1122823955.db2.gz AVTREXFKFFIJSA-INDWDQIESA-N 1 0 274.364 3.728 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1CCCCC1 ZINC000506914481 1122912325 /nfs/dbraw/zinc/91/23/25/1122912325.db2.gz BYTXXLLKVKZVLE-UHFFFAOYSA-N 1 0 292.379 3.663 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H](C3CCC3)C2)cc1 ZINC001196255109 1122912915 /nfs/dbraw/zinc/91/29/15/1122912915.db2.gz QWIHQBHYQFEXCW-MRXNPFEDSA-N 1 0 288.391 3.649 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1C[C@H]1c1ccccc1 ZINC000507162061 1122932867 /nfs/dbraw/zinc/93/28/67/1122932867.db2.gz UANIIZGPPHEXKL-SJORKVTESA-N 1 0 296.370 3.830 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507227179 1122941362 /nfs/dbraw/zinc/94/13/62/1122941362.db2.gz DNXCDEOHKKKZBO-BUUCAEBMSA-N 1 0 262.353 3.584 20 5 CHBDRO C[C@@H](c1ccncc1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183715020 1129089809 /nfs/dbraw/zinc/08/98/09/1129089809.db2.gz OZYXHTYTCBKHLD-DYLGSBMWSA-N 1 0 297.358 3.696 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC000507672310 1122982975 /nfs/dbraw/zinc/98/29/75/1122982975.db2.gz JZCWEZKCBMAHOO-QGZVFWFLSA-N 1 0 296.370 3.659 20 5 CHBDRO CC(C)C([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])C(C)C ZINC000776028810 1123043285 /nfs/dbraw/zinc/04/32/85/1123043285.db2.gz XOKPQBGAILTQDP-UHFFFAOYSA-N 1 0 268.332 3.504 20 5 CHBDRO C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000696568954 1123195040 /nfs/dbraw/zinc/19/50/40/1123195040.db2.gz QWJXTWXLKGULLF-SNVBAGLBSA-N 1 0 286.322 3.927 20 5 CHBDRO Cc1ccccc1C(C)(C)C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000507957426 1123248657 /nfs/dbraw/zinc/24/86/57/1123248657.db2.gz VOIYEBFELWYGEO-UHFFFAOYSA-N 1 0 298.386 3.971 20 5 CHBDRO CC[C@H](CC(F)F)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000851869759 1123385352 /nfs/dbraw/zinc/38/53/52/1123385352.db2.gz QCPDTHXEWMTERZ-LLVKDONJSA-N 1 0 298.333 3.634 20 5 CHBDRO CC(C)(O)C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000111385631 1123442924 /nfs/dbraw/zinc/44/29/24/1123442924.db2.gz SKWRJKKANFTJQJ-UHFFFAOYSA-N 1 0 279.383 3.854 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)C1(C)CC1 ZINC000776882200 1123558314 /nfs/dbraw/zinc/55/83/14/1123558314.db2.gz OJBTZUMHNZAKFT-NEPJUHHUSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000020526064 1123646673 /nfs/dbraw/zinc/64/66/73/1123646673.db2.gz LZTMFHSPDBMLPH-OBJOEFQTSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)c2ccns2)cccc1[N+](=O)[O-] ZINC000858577110 1123664813 /nfs/dbraw/zinc/66/48/13/1123664813.db2.gz PCNFXMZOTXPZFV-MNOVXSKESA-N 1 0 291.376 3.772 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000086642144 1123797460 /nfs/dbraw/zinc/79/74/60/1123797460.db2.gz BUOSKJYFOCDFFM-UHFFFAOYSA-N 1 0 250.342 3.653 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1(C(F)F)CC1 ZINC000475211636 1123824622 /nfs/dbraw/zinc/82/46/22/1123824622.db2.gz AIQHJPJGPOXWFI-NSHDSACASA-N 1 0 298.333 3.551 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCCC2(CCC2)C1 ZINC000475269058 1123832490 /nfs/dbraw/zinc/83/24/90/1123832490.db2.gz JYBVTSWXMWRCSL-XVNBXDOJSA-N 1 0 286.375 3.874 20 5 CHBDRO CC[C@H](C)C[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000088293457 1124005520 /nfs/dbraw/zinc/00/55/20/1124005520.db2.gz YUGZQIMWVZNZEB-AAEUAGOBSA-N 1 0 264.369 3.818 20 5 CHBDRO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC1CCC1 ZINC000475581807 1124019290 /nfs/dbraw/zinc/01/92/90/1124019290.db2.gz HLEKZYXGMJTWOA-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1cccs1 ZINC000866216859 1124038481 /nfs/dbraw/zinc/03/84/81/1124038481.db2.gz VVGXPMKGMDSISF-SNVBAGLBSA-N 1 0 294.351 3.516 20 5 CHBDRO CC(C)[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC1CCC1 ZINC000444776522 1124064439 /nfs/dbraw/zinc/06/44/39/1124064439.db2.gz LOMOQSNMLWHOKL-UHFFFAOYSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000121646938 1124112039 /nfs/dbraw/zinc/11/20/39/1124112039.db2.gz YTBRNAVJNBOPAA-ZFWWWQNUSA-N 1 0 296.370 3.894 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000525637134 1124451141 /nfs/dbraw/zinc/45/11/41/1124451141.db2.gz ZVKMQFGYLFLHPB-CHWSQXEVSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)c(C)o1 ZINC000447587801 1124494332 /nfs/dbraw/zinc/49/43/32/1124494332.db2.gz RPANPQGTKBJIKG-GFCCVEGCSA-N 1 0 288.347 3.698 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC2(F)F)CC1 ZINC000593077491 1124561447 /nfs/dbraw/zinc/56/14/47/1124561447.db2.gz RFJLKSGKNULHMV-LLVKDONJSA-N 1 0 296.317 3.777 20 5 CHBDRO CC(C)C1(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449170919 1124658951 /nfs/dbraw/zinc/65/89/51/1124658951.db2.gz JLMWKYLBODLSLB-CYBMUJFWSA-N 1 0 276.380 3.552 20 5 CHBDRO CCSCC[C@@H](C)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449170153 1124659572 /nfs/dbraw/zinc/65/95/72/1124659572.db2.gz QHSAFPZLWSVBOY-OLZOCXBDSA-N 1 0 296.436 3.647 20 5 CHBDRO C[C@H]([NH2+]CCCOC(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872084717 1124679232 /nfs/dbraw/zinc/67/92/32/1124679232.db2.gz HTENMNHDMAUPPR-NSHDSACASA-N 1 0 298.358 3.590 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CC1=CCCCC1 ZINC000449374868 1124706659 /nfs/dbraw/zinc/70/66/59/1124706659.db2.gz CRKVUKGPYQOEFK-POHAHGRESA-N 1 0 272.348 3.698 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000873079328 1124736815 /nfs/dbraw/zinc/73/68/15/1124736815.db2.gz DRTNPWVQCSTUOB-GFCCVEGCSA-N 1 0 298.333 3.879 20 5 CHBDRO Cc1csc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)c1 ZINC000449481372 1124756850 /nfs/dbraw/zinc/75/68/50/1124756850.db2.gz SMSDHKKQATXMDN-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC001170947872 1131290228 /nfs/dbraw/zinc/29/02/28/1131290228.db2.gz BRWOEYZHFLVHBK-XHDPSFHLSA-N 1 0 280.343 3.792 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1cccc(F)c1[N+](=O)[O-] ZINC000037420646 1124931523 /nfs/dbraw/zinc/93/15/23/1124931523.db2.gz SSOYXBZVZCAXGI-GFCCVEGCSA-N 1 0 297.374 3.656 20 5 CHBDRO C[C@@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)(C)C ZINC000877042266 1125002360 /nfs/dbraw/zinc/00/23/60/1125002360.db2.gz NXIJTOAOLAHUNP-JTQLQIEISA-N 1 0 291.351 3.508 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC1(C)CC1 ZINC000530465191 1125157154 /nfs/dbraw/zinc/15/71/54/1125157154.db2.gz JAMSWCISNSQJGC-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC[C@H]2CCCC2(F)F)c1 ZINC000883266675 1125389471 /nfs/dbraw/zinc/38/94/71/1125389471.db2.gz GUCXZGQDAKCWKX-GFCCVEGCSA-N 1 0 284.306 3.510 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000171130833 1125404400 /nfs/dbraw/zinc/40/44/00/1125404400.db2.gz HVBABJITCIOSLI-ZDUSSCGKSA-N 1 0 299.374 3.512 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CC(C)(C)C ZINC000532550727 1125410903 /nfs/dbraw/zinc/41/09/03/1125410903.db2.gz AQEISARNYOVATF-NSHDSACASA-N 1 0 250.342 3.634 20 5 CHBDRO C[C@@H](C[NH2+][C@H]1CC[C@@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000897461637 1125423954 /nfs/dbraw/zinc/42/39/54/1125423954.db2.gz UIMWOWFRCIIEHO-XQQFMLRXSA-N 1 0 294.420 3.572 20 5 CHBDRO CSC1(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000897465067 1125425116 /nfs/dbraw/zinc/42/51/16/1125425116.db2.gz SBPDPUDDMPQOOP-GFCCVEGCSA-N 1 0 294.420 3.574 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)CC1CCC1 ZINC000348245762 1125429310 /nfs/dbraw/zinc/42/93/10/1125429310.db2.gz QMTIXQAVWJNWQB-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC[C@H]2CCc3ccccc32)c1 ZINC001202602982 1125440553 /nfs/dbraw/zinc/44/05/53/1125440553.db2.gz PDJXANZHZVORKY-MRXNPFEDSA-N 1 0 296.370 3.805 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000282864678 1125453009 /nfs/dbraw/zinc/45/30/09/1125453009.db2.gz YUQDVCZTDQNTFW-OCCSQVGLSA-N 1 0 280.343 3.603 20 5 CHBDRO C[C@H]1c2ccccc2CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000139501759 1129202778 /nfs/dbraw/zinc/20/27/78/1129202778.db2.gz XQKISUJOPZCWJJ-AWEZNQCLSA-N 1 0 296.370 3.757 20 5 CHBDRO Cc1ccccc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000037718969 1129205854 /nfs/dbraw/zinc/20/58/54/1129205854.db2.gz IFXCIKWQCOXACU-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO CC(C)(C[NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000037864166 1129280343 /nfs/dbraw/zinc/28/03/43/1129280343.db2.gz RMCLFZYIMQTPLM-UHFFFAOYSA-N 1 0 284.359 3.662 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000090910121 1129335879 /nfs/dbraw/zinc/33/58/79/1129335879.db2.gz ZIEXNOOSKXXCMW-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000735311476 1129340629 /nfs/dbraw/zinc/34/06/29/1129340629.db2.gz QRPQBFYANHBHJQ-GFCCVEGCSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094774537 1129451725 /nfs/dbraw/zinc/45/17/25/1129451725.db2.gz JTDHEEBWYRQVLH-AAEUAGOBSA-N 1 0 280.343 3.744 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303585911 1129547679 /nfs/dbraw/zinc/54/76/79/1129547679.db2.gz QKEONIOIVOHQCG-QGZVFWFLSA-N 1 0 286.375 3.917 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCCCCCC1 ZINC000744385176 1129576219 /nfs/dbraw/zinc/57/62/19/1129576219.db2.gz SEHLXKWFDYJVFU-CYBMUJFWSA-N 1 0 262.353 3.922 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCNc1ccccc1 ZINC000766514048 1129676641 /nfs/dbraw/zinc/67/66/41/1129676641.db2.gz DKLOFHFNFZVIOS-AWEZNQCLSA-N 1 0 299.374 3.666 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168984950 1129686952 /nfs/dbraw/zinc/68/69/52/1129686952.db2.gz BODDXPOGGWBKOQ-BYCMXARLSA-N 1 0 296.798 3.826 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H]([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168979499 1129687200 /nfs/dbraw/zinc/68/72/00/1129687200.db2.gz YRYILSXOBWFOSK-TUVASFSCSA-N 1 0 282.428 3.626 20 5 CHBDRO CCC(CC)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168965912 1129687892 /nfs/dbraw/zinc/68/78/92/1129687892.db2.gz DJXVBDKSJBDDLZ-GDBMZVCRSA-N 1 0 290.407 3.737 20 5 CHBDRO CC(C)c1ccc([C@@H](C)[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001168993307 1129688596 /nfs/dbraw/zinc/68/85/96/1129688596.db2.gz MIZBOHCLZBICQW-JKIFEVAISA-N 1 0 290.407 3.906 20 5 CHBDRO Cc1cc(Cl)ccc1[C@@H](C)[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168990062 1129690111 /nfs/dbraw/zinc/69/01/11/1129690111.db2.gz BEPGUUHCUYPRCV-DYEKYZERSA-N 1 0 296.798 3.744 20 5 CHBDRO C[C@H](c1ccccc1Cl)[N@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169049591 1129692131 /nfs/dbraw/zinc/69/21/31/1129692131.db2.gz WQKLLLDQLUOGOR-FRRDWIJNSA-N 1 0 296.798 3.778 20 5 CHBDRO C[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC001169090986 1129699854 /nfs/dbraw/zinc/69/98/54/1129699854.db2.gz KMUWVQVTKNEMIC-CYBMUJFWSA-N 1 0 276.380 3.505 20 5 CHBDRO C/C(=C/c1ccccc1)CN(C)Cc1cccnc1[N+](=O)[O-] ZINC001169242949 1129712364 /nfs/dbraw/zinc/71/23/64/1129712364.db2.gz DZURMRYUJCDVAW-KAMYIIQDSA-N 1 0 297.358 3.525 20 5 CHBDRO C[C@@H](C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC001169665666 1129745047 /nfs/dbraw/zinc/74/50/47/1129745047.db2.gz DIVJUTRPXNDKDJ-ZDUSSCGKSA-N 1 0 278.396 3.751 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801527276 1129924070 /nfs/dbraw/zinc/92/40/70/1129924070.db2.gz ISEQIYCLGWXQAX-GHMZBOCLSA-N 1 0 280.343 3.648 20 5 CHBDRO COc1cc([C@H](C)[NH2+]Cc2ccsc2)cc([N+](=O)[O-])c1 ZINC000903068438 1130108005 /nfs/dbraw/zinc/10/80/05/1130108005.db2.gz FCPCXXKSDURZQG-JTQLQIEISA-N 1 0 292.360 3.516 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1cncs1)c1ccccc1[N+](=O)[O-] ZINC000903244974 1130135647 /nfs/dbraw/zinc/13/56/47/1130135647.db2.gz HFTOESBHJFADTR-WDEREUQCSA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1ccns1)c1ccccc1[N+](=O)[O-] ZINC000903245350 1130135859 /nfs/dbraw/zinc/13/58/59/1130135859.db2.gz LFSSKINFQDVIEK-MNOVXSKESA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCSC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903282340 1130144955 /nfs/dbraw/zinc/14/49/55/1130144955.db2.gz CQNDJWGAGDPHLU-YPMHNXCESA-N 1 0 294.420 3.920 20 5 CHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748807351 1130248416 /nfs/dbraw/zinc/24/84/16/1130248416.db2.gz MWRQJDQOPRDQOB-CQSZACIVSA-N 1 0 280.343 3.744 20 5 CHBDRO CCCCCC[NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170298349 1130476431 /nfs/dbraw/zinc/47/64/31/1130476431.db2.gz JNHDJEOANISYGZ-CYBMUJFWSA-N 1 0 294.395 3.704 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CC[C@H](C)C1 ZINC000783309269 1130814949 /nfs/dbraw/zinc/81/49/49/1130814949.db2.gz JTNLPODVURDTDI-DRZSPHRISA-N 1 0 262.353 3.742 20 5 CHBDRO NC[C@H]1CCC[N@@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001236247704 1130904256 /nfs/dbraw/zinc/90/42/56/1130904256.db2.gz XEVRJOUZPPGXAT-QGZVFWFLSA-N 1 0 290.410 3.916 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccsc1 ZINC000815624440 1131010705 /nfs/dbraw/zinc/01/07/05/1131010705.db2.gz YNOHFQZGZAPSAP-VHSXEESVSA-N 1 0 291.376 3.650 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000816646319 1131117478 /nfs/dbraw/zinc/11/74/78/1131117478.db2.gz BTWORNNSSHVNIU-RYUDHWBXSA-N 1 0 286.331 3.695 20 5 CHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001171087125 1131510694 /nfs/dbraw/zinc/51/06/94/1131510694.db2.gz LKNJDBMHDQRJAT-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC23CCCC3)cc1Cl ZINC000845998975 1131677080 /nfs/dbraw/zinc/67/70/80/1131677080.db2.gz FWKLLIIKYNLQQY-UHFFFAOYSA-N 1 0 280.755 3.767 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccns2)cc1[N+](=O)[O-] ZINC000716055107 1132003656 /nfs/dbraw/zinc/00/36/56/1132003656.db2.gz NNJGBOPHYLFIBB-QWRGUYRKSA-N 1 0 291.376 3.772 20 5 CHBDRO C[C@H]([NH2+]CCCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000037177037 1132006757 /nfs/dbraw/zinc/00/67/57/1132006757.db2.gz XHYOHGJLVHSKJI-AWEZNQCLSA-N 1 0 284.359 3.878 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(O)cc1-c1ccccc1 ZINC001229972748 1132139161 /nfs/dbraw/zinc/13/91/61/1132139161.db2.gz HUAYNNQYTONTKE-AWEZNQCLSA-O 1 0 286.395 3.533 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[N@@H+]1CCO[C@H]2C[C@H]21 ZINC001141728141 1132242121 /nfs/dbraw/zinc/24/21/21/1132242121.db2.gz NHASEEKMGNJMMH-UXHICEINSA-N 1 0 289.378 3.966 20 5 CHBDRO CC1(C)CCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172904952 1132346978 /nfs/dbraw/zinc/34/69/78/1132346978.db2.gz BNJQLJKHROIINF-OAHLLOKOSA-N 1 0 288.391 3.717 20 5 CHBDRO CCC[NH+](CCC)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907127 1132348906 /nfs/dbraw/zinc/34/89/06/1132348906.db2.gz DGTAMRIPYACYGT-MRXNPFEDSA-N 1 0 290.407 3.964 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C/C=C/c1ccccc1 ZINC001173214896 1132411763 /nfs/dbraw/zinc/41/17/63/1132411763.db2.gz RHCVWQWNQSPQOU-SBJJXXPASA-N 1 0 296.370 3.829 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCC(C)(C)C1 ZINC001173226181 1132412425 /nfs/dbraw/zinc/41/24/25/1132412425.db2.gz VWVWAZNRNNIANX-DZGCQCFKSA-N 1 0 290.407 3.942 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1[C@H](C)CCC[C@@H]1C ZINC001173224438 1132412866 /nfs/dbraw/zinc/41/28/66/1132412866.db2.gz FVQKGZHDZZNVPK-HZSPNIEDSA-N 1 0 276.380 3.789 20 5 CHBDRO CC(C)[N@H+](CC1CC1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173228472 1132412976 /nfs/dbraw/zinc/41/29/76/1132412976.db2.gz XIQKDAIRTKLURD-CYBMUJFWSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)C1CCCC1 ZINC001173231566 1132413585 /nfs/dbraw/zinc/41/35/85/1132413585.db2.gz ATQIUBYSANVXBI-CHWSQXEVSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC2(CCC2)C1 ZINC001173230195 1132413906 /nfs/dbraw/zinc/41/39/06/1132413906.db2.gz COQVRXXHZHMBSC-AWEZNQCLSA-N 1 0 288.391 3.792 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[C@@H](C)CC1 ZINC001173232759 1132414180 /nfs/dbraw/zinc/41/41/80/1132414180.db2.gz FYXUJCJVPFZYHP-UMVBOHGHSA-N 1 0 276.380 3.694 20 5 CHBDRO CC(C)[C@@H]1CCC[N@@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230994 1132414209 /nfs/dbraw/zinc/41/42/09/1132414209.db2.gz IBGJWAJHBUDISM-BBRMVZONSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C2CCCC1CCC2 ZINC001173231650 1132414384 /nfs/dbraw/zinc/41/43/84/1132414384.db2.gz NIYDBSPFEMKLJH-JEYLPNPQSA-N 1 0 288.391 3.933 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC(F)(F)C1 ZINC001173220457 1132416752 /nfs/dbraw/zinc/41/67/52/1132416752.db2.gz AKBVIOQUGSXMLG-DGCLKSJQSA-N 1 0 298.333 3.693 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCc1ccc(C)o1 ZINC001161769746 1133027585 /nfs/dbraw/zinc/02/75/85/1133027585.db2.gz ZFLJHAIFRNGUMA-UHFFFAOYSA-N 1 0 273.400 3.796 20 5 CHBDRO Cc1cccc(-n2ccc3cc([C@@H](C)[NH3+])ccc32)c1[N+](=O)[O-] ZINC001162910861 1133121552 /nfs/dbraw/zinc/12/15/52/1133121552.db2.gz XGRQQUFWTHLGAG-GFCCVEGCSA-N 1 0 295.342 3.867 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC001207152185 1133771777 /nfs/dbraw/zinc/77/17/77/1133771777.db2.gz ZGFXPUGATCOLRR-HZPDHXFCSA-N 1 0 288.391 3.962 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1c[nH+]ccc1N1CCCC1 ZINC001211288498 1134403879 /nfs/dbraw/zinc/40/38/79/1134403879.db2.gz UGVPKOPQPNIIBE-UHFFFAOYSA-N 1 0 298.346 3.642 20 5 CHBDRO C[NH+](C)Cc1ccc(Nc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC001216483795 1134904448 /nfs/dbraw/zinc/90/44/48/1134904448.db2.gz MUIBIDATDGQYBM-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO C[NH+](C)Cc1ccccc1Nc1cc(F)cc([N+](=O)[O-])c1 ZINC001216484351 1134904715 /nfs/dbraw/zinc/90/47/15/1134904715.db2.gz MFMSBQDHIQGETK-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO C[C@@H]1C[C@@H](Oc2cccc3ccc4cccnc4c32)C[NH2+]1 ZINC001218036951 1135047601 /nfs/dbraw/zinc/04/76/01/1135047601.db2.gz GLACNTLBIYHWIL-IUODEOHRSA-N 1 0 278.355 3.517 20 5 CHBDRO Cc1ccc(CO[C@H](C)C[N+](C)(C)C)c2ccccc12 ZINC001222796659 1135274172 /nfs/dbraw/zinc/27/41/72/1135274172.db2.gz VRYRXGWFYKLCGQ-OAHLLOKOSA-N 1 0 272.412 3.760 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCc1ccccc1Cc1ccccc1 ZINC001223165777 1135312430 /nfs/dbraw/zinc/31/24/30/1135312430.db2.gz VWYCFLRVWKWMOK-QGZVFWFLSA-N 1 0 298.450 3.889 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OC(Cl)(Cl)c1ccccc1F ZINC001223768059 1135380561 /nfs/dbraw/zinc/38/05/61/1135380561.db2.gz CGNFJUAGXSMOSG-SNVBAGLBSA-N 1 0 295.205 3.525 20 5 CHBDRO C[C@H](OCCC[N+](C)(C)C)c1csc(Cl)c1 ZINC001224620766 1135462453 /nfs/dbraw/zinc/46/24/53/1135462453.db2.gz AXDYUVBCGOTKRA-JTQLQIEISA-N 1 0 262.826 3.575 20 5 CHBDRO CC(C)C[C@@H](Cc1ccccc1)OCCC[N+](C)(C)C ZINC001224621758 1135462584 /nfs/dbraw/zinc/46/25/84/1135462584.db2.gz CUFFQNAXUKWYRB-SFHVURJKSA-N 1 0 278.460 3.757 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cc(C(F)(F)F)ccc1Cl ZINC001225324865 1135543431 /nfs/dbraw/zinc/54/34/31/1135543431.db2.gz TUBORLWRONHTGG-VIFPVBQESA-N 1 0 296.740 3.832 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(SC(F)(F)F)cc1 ZINC001225792063 1135623237 /nfs/dbraw/zinc/62/32/37/1135623237.db2.gz IAGCTCQLBZQJHI-JTQLQIEISA-N 1 0 294.362 3.772 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc(CCc2ccccc2)c1 ZINC001226930354 1135762929 /nfs/dbraw/zinc/76/29/29/1135762929.db2.gz SUEBIOHUHHJZDR-KRWDZBQOSA-N 1 0 298.450 3.945 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1[C@H](C)CC[C@@H]1C ZINC000342077864 535021479 /nfs/dbraw/zinc/02/14/79/535021479.db2.gz SWJHHLMFDNFNJH-BETUJISGSA-N 1 0 292.379 3.755 20 5 CHBDRO CSc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000352834401 532958345 /nfs/dbraw/zinc/95/83/45/532958345.db2.gz LXRHXPWUYKMDPZ-UHFFFAOYSA-N 1 0 294.401 3.668 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000020121805 171001019 /nfs/dbraw/zinc/00/10/19/171001019.db2.gz VABTXFSOKRWXAG-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000020121808 171001223 /nfs/dbraw/zinc/00/12/23/171001223.db2.gz VABTXFSOKRWXAG-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCOCC(C)C)cc1[N+](=O)[O-] ZINC000020147377 171033694 /nfs/dbraw/zinc/03/36/94/171033694.db2.gz HNQIFNNGJNUBDB-AWEZNQCLSA-N 1 0 294.395 3.617 20 5 CHBDRO CC[C@H]([NH2+]CCC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000036721091 172658028 /nfs/dbraw/zinc/65/80/28/172658028.db2.gz AUVWFTAMNICEFP-AWEZNQCLSA-N 1 0 250.342 3.682 20 5 CHBDRO COc1cc[nH+]c(NC/C(C)=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000468585548 225028642 /nfs/dbraw/zinc/02/86/42/225028642.db2.gz BSNOAMAOXXZNMP-WQLSENKSSA-N 1 0 299.330 3.514 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)cs1 ZINC000344343169 225036505 /nfs/dbraw/zinc/03/65/05/225036505.db2.gz FOOGTPLRCYBBSJ-FRRDWIJNSA-N 1 0 280.393 3.715 20 5 CHBDRO Cc1cccc(CN(C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000352784891 227221290 /nfs/dbraw/zinc/22/12/90/227221290.db2.gz SDPDIRWRRCJNIN-AWEZNQCLSA-N 1 0 299.374 3.800 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H](C)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000480666492 228060545 /nfs/dbraw/zinc/06/05/45/228060545.db2.gz ZYWSSKLVLLOUIJ-WPRPVWTQSA-N 1 0 290.285 3.752 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000037010578 260062262 /nfs/dbraw/zinc/06/22/62/260062262.db2.gz ZMYDVDYNVDPEEB-INIZCTEOSA-N 1 0 288.322 3.975 20 5 CHBDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000037177089 260072844 /nfs/dbraw/zinc/07/28/44/260072844.db2.gz CXAPEVNUEGHIFV-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000070101812 260152184 /nfs/dbraw/zinc/15/21/84/260152184.db2.gz SJLPQEYFDDQFNH-ABAIWWIYSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)s1 ZINC000080243041 260179810 /nfs/dbraw/zinc/17/98/10/260179810.db2.gz NTNSAWBGLWHKKD-SECBINFHSA-N 1 0 296.417 3.747 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC2CCC1CC2)c1ccccc1[N+](=O)[O-] ZINC000312896526 260219503 /nfs/dbraw/zinc/21/95/03/260219503.db2.gz XRPHIOVZYSILBD-LPXQKFACSA-N 1 0 274.364 3.824 20 5 CHBDRO CC(C)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000313600214 260303628 /nfs/dbraw/zinc/30/36/28/260303628.db2.gz AYNNAUHUQFUHTE-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)cc1 ZINC000152876084 261070804 /nfs/dbraw/zinc/07/08/04/261070804.db2.gz KEKWOAPTHGRITI-UHFFFAOYSA-N 1 0 286.306 3.513 20 5 CHBDRO CC[NH+](CC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000156906866 261134660 /nfs/dbraw/zinc/13/46/60/261134660.db2.gz ZUMDNFCTYIBTNG-UHFFFAOYSA-N 1 0 291.376 3.560 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1cncs1)c1cccc([N+](=O)[O-])c1 ZINC000161605080 261253877 /nfs/dbraw/zinc/25/38/77/261253877.db2.gz CCSAHKDIIHPGOX-ZWNOBZJWSA-N 1 0 291.376 3.853 20 5 CHBDRO CC(C)C1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000176960550 261322075 /nfs/dbraw/zinc/32/20/75/261322075.db2.gz CHMQMLCHSUSGKN-LBPRGKRZSA-N 1 0 262.353 3.682 20 5 CHBDRO CC[C@@H]([NH2+]CC1(C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000181654753 261431780 /nfs/dbraw/zinc/43/17/80/261431780.db2.gz KZSNPCBRKYMTOH-OAHLLOKOSA-N 1 0 274.364 3.826 20 5 CHBDRO C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000186003970 262075166 /nfs/dbraw/zinc/07/51/66/262075166.db2.gz YPKVXZLWJRXWCJ-CJNGLKHVSA-N 1 0 292.379 3.595 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000390157152 262143273 /nfs/dbraw/zinc/14/32/73/262143273.db2.gz MXCLUFSDDHGEAJ-UGSOOPFHSA-N 1 0 296.370 3.975 20 5 CHBDRO C[C@H]1C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000390157149 262143303 /nfs/dbraw/zinc/14/33/03/262143303.db2.gz MXCLUFSDDHGEAJ-SCLBCKFNSA-N 1 0 296.370 3.975 20 5 CHBDRO CC[C@@H]([NH2+]CC(C)(C)CCOC)c1cccc([N+](=O)[O-])c1 ZINC000183934153 262255579 /nfs/dbraw/zinc/25/55/79/262255579.db2.gz WWWAPUHYZIFRHL-OAHLLOKOSA-N 1 0 294.395 3.698 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000281139715 263066785 /nfs/dbraw/zinc/06/67/85/263066785.db2.gz ODTOAALLHPGQIV-VXGBXAGGSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)cc1[N+](=O)[O-] ZINC000187861117 263280050 /nfs/dbraw/zinc/28/00/50/263280050.db2.gz HLCYRONMGPJBHR-TZMCWYRMSA-N 1 0 292.379 3.511 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@H](OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000188830928 264247998 /nfs/dbraw/zinc/24/79/98/264247998.db2.gz FPAVGILOVANMNA-KBMXLJTQSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccccc1CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000094182658 265226074 /nfs/dbraw/zinc/22/60/74/265226074.db2.gz QPAJFLDJJYKAAT-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000356686571 266159499 /nfs/dbraw/zinc/15/94/99/266159499.db2.gz VHDHLTLWCQTTKJ-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO CC[C@@H](C)[C@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580240074 327746928 /nfs/dbraw/zinc/74/69/28/327746928.db2.gz BFMYYOQJNXVENO-NEPJUHHUSA-N 1 0 289.379 3.643 20 5 CHBDRO CCC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000185352003 327838440 /nfs/dbraw/zinc/83/84/40/327838440.db2.gz KKMWZPFURYBKGB-KRWDZBQOSA-N 1 0 299.374 3.663 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]CCC1CCCCC1 ZINC000062726331 327894534 /nfs/dbraw/zinc/89/45/34/327894534.db2.gz AUKYQUIALWJMPF-UHFFFAOYSA-N 1 0 276.380 3.697 20 5 CHBDRO CCCC[C@H](COC)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000531714529 328027951 /nfs/dbraw/zinc/02/79/51/328027951.db2.gz BAZKTQRUAARKFU-UONOGXRCSA-N 1 0 294.395 3.759 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000534349895 328047614 /nfs/dbraw/zinc/04/76/14/328047614.db2.gz TYRYPIPPVLYICI-GFCCVEGCSA-N 1 0 264.369 3.770 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@H]2CCC[C@@H]2C2CC2)cs1 ZINC000414485636 328185755 /nfs/dbraw/zinc/18/57/55/328185755.db2.gz PSRJUWIPQBGHGP-CHWSQXEVSA-N 1 0 280.393 3.572 20 5 CHBDRO CCCC[C@H](COC)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000531969182 328356361 /nfs/dbraw/zinc/35/63/61/328356361.db2.gz RNXSVWLPUKXDIB-DZGCQCFKSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@H]([NH2+]CCOC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000111636193 328370084 /nfs/dbraw/zinc/37/00/84/328370084.db2.gz VKJANCRZTAGNFC-ZDUSSCGKSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963576 328379980 /nfs/dbraw/zinc/37/99/80/328379980.db2.gz ZTSMYMWLRJQCTQ-NXEZZACHSA-N 1 0 270.760 3.772 20 5 CHBDRO CC(C)CCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963515 328380112 /nfs/dbraw/zinc/38/01/12/328380112.db2.gz UCSOMUQJMYDJRE-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)Cc1ccncc1 ZINC000531993922 328386187 /nfs/dbraw/zinc/38/61/87/328386187.db2.gz LTGNZJCURDDEPB-ZIAGYGMSSA-N 1 0 299.374 3.580 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000050443685 328439819 /nfs/dbraw/zinc/43/98/19/328439819.db2.gz PIUGDZJJVMQCDB-VHSXEESVSA-N 1 0 270.760 3.772 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCSCC(C)C)cccc1[N+](=O)[O-] ZINC000537948686 326841724 /nfs/dbraw/zinc/84/17/24/326841724.db2.gz XZDKYGOUXCJQFV-CYBMUJFWSA-N 1 0 296.436 3.943 20 5 CHBDRO C[C@@H](C1CC1)[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000255713865 327007010 /nfs/dbraw/zinc/00/70/10/327007010.db2.gz PCIALLMDNUDLTL-AGLBCWCQSA-N 1 0 286.375 3.871 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000558257484 327083538 /nfs/dbraw/zinc/08/35/38/327083538.db2.gz LPTQGPDLBRSFFD-ZBFHGGJFSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@H]1CCC[C@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000088195109 327130331 /nfs/dbraw/zinc/13/03/31/327130331.db2.gz RIUBXHRJTWCZQF-OLZOCXBDSA-N 1 0 262.353 3.511 20 5 CHBDRO C[C@H](F)CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000559332850 327160867 /nfs/dbraw/zinc/16/08/67/327160867.db2.gz UDRXYHRYNWLLFE-NSHDSACASA-N 1 0 292.310 3.693 20 5 CHBDRO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CS1 ZINC000449348652 327166269 /nfs/dbraw/zinc/16/62/69/327166269.db2.gz MRVBBXZJNXNRKF-NJZAAPMLSA-N 1 0 294.420 3.776 20 5 CHBDRO CSc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000048068900 327277250 /nfs/dbraw/zinc/27/72/50/327277250.db2.gz UVMFEFAEOYHUQR-UHFFFAOYSA-N 1 0 288.372 3.607 20 5 CHBDRO CCC1(C)CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000507195010 332795243 /nfs/dbraw/zinc/79/52/43/332795243.db2.gz HSEPHZSEJLDPQK-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1Cl ZINC000193735318 329061572 /nfs/dbraw/zinc/06/15/72/329061572.db2.gz BTMVZINSIMYMOQ-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC1(C)C ZINC000582550688 329106273 /nfs/dbraw/zinc/10/62/73/329106273.db2.gz WAMCNBCCYRKXOX-IUODEOHRSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000584366894 329295350 /nfs/dbraw/zinc/29/53/50/329295350.db2.gz SMERGVCVOXGRPJ-VDERGJSUSA-N 1 0 288.391 3.694 20 5 CHBDRO CC(C)CSCC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000397342696 329350902 /nfs/dbraw/zinc/35/09/02/329350902.db2.gz WJMLYFHFESLUKL-GFCCVEGCSA-N 1 0 282.409 3.635 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(C)nc1C)c1cccc([N+](=O)[O-])c1 ZINC000187441147 329357604 /nfs/dbraw/zinc/35/76/04/329357604.db2.gz ZWRVFSRYZULYJY-KRWDZBQOSA-N 1 0 299.374 3.848 20 5 CHBDRO CC1=C[C@@H](C)C[C@@H](C[NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000583901332 329530869 /nfs/dbraw/zinc/53/08/69/329530869.db2.gz YIKQYMNAVCUTKH-UKRRQHHQSA-N 1 0 288.391 3.719 20 5 CHBDRO CSc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000049592767 329640526 /nfs/dbraw/zinc/64/05/26/329640526.db2.gz SVXSTTFPJRISHQ-UHFFFAOYSA-N 1 0 288.372 3.607 20 5 CHBDRO CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CCO1 ZINC000421854582 330088474 /nfs/dbraw/zinc/08/84/74/330088474.db2.gz KWLSFCFZUOAPOR-BFHYXJOUSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc(C)n1 ZINC000421888576 330096675 /nfs/dbraw/zinc/09/66/75/330096675.db2.gz TYBUDSUJZGFGCK-CQSZACIVSA-N 1 0 299.374 3.766 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc(C)n1 ZINC000421883781 330102659 /nfs/dbraw/zinc/10/26/59/330102659.db2.gz QIHBJCXLNKADED-AWEZNQCLSA-N 1 0 299.374 3.766 20 5 CHBDRO CC(C)([NH2+]Cc1ccsc1)c1ccc([N+](=O)[O-])cc1 ZINC000080347407 330124158 /nfs/dbraw/zinc/12/41/58/330124158.db2.gz APSGKYMMRDBNSL-UHFFFAOYSA-N 1 0 276.361 3.681 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000536831569 330229254 /nfs/dbraw/zinc/22/92/54/330229254.db2.gz GBEMVDYMRZPOKD-XJFOESAGSA-N 1 0 292.379 3.510 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000035253370 330244288 /nfs/dbraw/zinc/24/42/88/330244288.db2.gz WVVSUKIIHUTOLR-BXUZGUMPSA-N 1 0 262.353 3.572 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4C[C@H]4C3)o2)c1 ZINC000424197241 330325575 /nfs/dbraw/zinc/32/55/75/330325575.db2.gz BQMMBMFHOZITNA-BTTYYORXSA-N 1 0 298.342 3.743 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC12CC2 ZINC000424332528 330342603 /nfs/dbraw/zinc/34/26/03/330342603.db2.gz WTLGBFBTRCNERC-BXUZGUMPSA-N 1 0 292.404 3.608 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000045628991 330347279 /nfs/dbraw/zinc/34/72/79/330347279.db2.gz NXJUDYMCCJNWQP-OLZOCXBDSA-N 1 0 260.337 3.602 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000544830504 330393317 /nfs/dbraw/zinc/39/33/17/330393317.db2.gz BOCUTTXBXUHNFH-ONGXEEELSA-N 1 0 290.285 3.976 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000336812839 330840716 /nfs/dbraw/zinc/84/07/16/330840716.db2.gz SILHQICNXJTRQQ-KBPBESRZSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000449090474 330898455 /nfs/dbraw/zinc/89/84/55/330898455.db2.gz NDOPLGWIDLVKOL-LLVKDONJSA-N 1 0 290.388 3.686 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC[C@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449350461 330917430 /nfs/dbraw/zinc/91/74/30/330917430.db2.gz WFKNBVWBLCCYAT-UVBJJODRSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1CCSCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449351216 330917476 /nfs/dbraw/zinc/91/74/76/330917476.db2.gz ZUQHGYDNIZEHIX-RYUDHWBXSA-N 1 0 294.420 3.777 20 5 CHBDRO CC1(C2([NH2+]C/C=C\c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000449672602 330943184 /nfs/dbraw/zinc/94/31/84/330943184.db2.gz MYRWFNLMFIKKRS-XQRVVYSFSA-N 1 0 272.348 3.530 20 5 CHBDRO CCC1([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000453273965 331109876 /nfs/dbraw/zinc/10/98/76/331109876.db2.gz ALAAVHOCQICSME-UKRRQHHQSA-N 1 0 288.391 3.838 20 5 CHBDRO CC[C@@H]1C[C@H]1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453305087 331113871 /nfs/dbraw/zinc/11/38/71/331113871.db2.gz GXAMNCTULZBVQN-UPJWGTAASA-N 1 0 262.353 3.600 20 5 CHBDRO CC/C=C\C[NH2+][C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000453316837 331115739 /nfs/dbraw/zinc/11/57/39/331115739.db2.gz JZWZHORPMMYCAL-ZHRWSRJISA-N 1 0 278.352 3.610 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2Cc3ccccc32)cc1[N+](=O)[O-] ZINC000195651198 331179401 /nfs/dbraw/zinc/17/94/01/331179401.db2.gz KPXASUYBFSHBSV-XJKSGUPXSA-N 1 0 296.370 3.894 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CCC[C@@H]2CCCF)c1 ZINC000510661048 332909937 /nfs/dbraw/zinc/90/99/37/332909937.db2.gz FPOPVHOBCYEISU-ZBFHGGJFSA-N 1 0 294.370 3.645 20 5 CHBDRO COc1cc(C[N@H+](CC(C)C)C(C)C)c([N+](=O)[O-])cc1F ZINC000463480676 331348376 /nfs/dbraw/zinc/34/83/76/331348376.db2.gz HQPUBUACQBDGEG-UHFFFAOYSA-N 1 0 298.358 3.609 20 5 CHBDRO CC(C)[C@@H]1C[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CCS1 ZINC000464774709 331367425 /nfs/dbraw/zinc/36/74/25/331367425.db2.gz PZZIPVWKMKMHTI-DOMZBBRYSA-N 1 0 294.420 3.729 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468001648 331426485 /nfs/dbraw/zinc/42/64/85/331426485.db2.gz CWIVTSXOCGYFET-JSGCOSHPSA-N 1 0 276.380 3.552 20 5 CHBDRO CSCCCC[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000468634992 331437961 /nfs/dbraw/zinc/43/79/61/331437961.db2.gz KTBPJIDKFPWJAA-RAXLEYEMSA-N 1 0 294.420 3.731 20 5 CHBDRO CCCCC[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000468642461 331438120 /nfs/dbraw/zinc/43/81/20/331438120.db2.gz RMHZHAHAQUFBHN-RAXLEYEMSA-N 1 0 262.353 3.778 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1 ZINC000468643023 331438152 /nfs/dbraw/zinc/43/81/52/331438152.db2.gz VTFVWRKGEIOAOY-UVTDQMKNSA-N 1 0 282.343 3.788 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)CCC1CC1 ZINC000469131397 331446409 /nfs/dbraw/zinc/44/64/09/331446409.db2.gz ZDPUMCCVLKAMMN-LBPRGKRZSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CC[C@@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000510991649 332923181 /nfs/dbraw/zinc/92/31/81/332923181.db2.gz JOSPKFCZWTUESP-CABCVRRESA-N 1 0 274.364 3.572 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC000477741261 331689850 /nfs/dbraw/zinc/68/98/50/331689850.db2.gz IDFCDWQMBGGCKF-GJZGRUSLSA-N 1 0 274.364 3.572 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000487967779 331986107 /nfs/dbraw/zinc/98/61/07/331986107.db2.gz DETYEFKYJSLLEO-JHJVBQTASA-N 1 0 262.353 3.634 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CC(C)C ZINC000489101408 332041593 /nfs/dbraw/zinc/04/15/93/332041593.db2.gz HBMUWTPYLQEDCI-GFCCVEGCSA-N 1 0 250.342 3.552 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CCC(F)(F)F ZINC000489135641 332042238 /nfs/dbraw/zinc/04/22/38/332042238.db2.gz HNXIATWHSNMTJB-SNVBAGLBSA-N 1 0 290.285 3.848 20 5 CHBDRO COc1cc(C[N@@H+]2C[C@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000490029443 332077235 /nfs/dbraw/zinc/07/72/35/332077235.db2.gz KIMCXNCUPXRCHA-OLZOCXBDSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C)[C@@H]1C ZINC000490067157 332079821 /nfs/dbraw/zinc/07/98/21/332079821.db2.gz MGHMCNSXHMFOMY-DRZSPHRISA-N 1 0 262.353 3.695 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](CC2CCCC2)C2CC2)cc1 ZINC000490823354 332118029 /nfs/dbraw/zinc/11/80/29/332118029.db2.gz FNBZEIFMMZMENB-UHFFFAOYSA-N 1 0 274.364 3.749 20 5 CHBDRO C[C@H](C1CCC1)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492174177 332385751 /nfs/dbraw/zinc/38/57/51/332385751.db2.gz AEPZBBXFRNSXGQ-SNVBAGLBSA-N 1 0 282.771 3.869 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1)C(C)(C)C ZINC000492785465 332413408 /nfs/dbraw/zinc/41/34/08/332413408.db2.gz TYZLMISTCUOMQT-CQSZACIVSA-N 1 0 280.368 3.518 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1(C)CC1 ZINC000495379491 332516426 /nfs/dbraw/zinc/51/64/26/332516426.db2.gz KPYJSXFGBHDHRL-JTQLQIEISA-N 1 0 282.771 3.569 20 5 CHBDRO CC[C@@H](C)[C@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000495440166 332519131 /nfs/dbraw/zinc/51/91/31/332519131.db2.gz PNPGOUSHQQXXTA-MNOVXSKESA-N 1 0 284.787 3.815 20 5 CHBDRO CC[C@@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000503032136 332679130 /nfs/dbraw/zinc/67/91/30/332679130.db2.gz FOFCUACIWVRPHE-INIZCTEOSA-N 1 0 298.386 3.921 20 5 CHBDRO CC(C)CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000312259307 333078982 /nfs/dbraw/zinc/07/89/82/333078982.db2.gz DQLFOKWWESVAON-HNNXBMFYSA-N 1 0 276.380 3.899 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C2CC(OC(C)C)C2)cc1[N+](=O)[O-] ZINC000186553403 333162726 /nfs/dbraw/zinc/16/27/26/333162726.db2.gz ZTIFKRMXJJGDQD-LRVUVFPRSA-N 1 0 292.379 3.510 20 5 CHBDRO CCC[C@H]([NH2+]CC1(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000222170960 333176352 /nfs/dbraw/zinc/17/63/52/333176352.db2.gz DKSOAJSZVZJDNY-AWEZNQCLSA-N 1 0 262.353 3.826 20 5 CHBDRO CCC1(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000222202289 333176871 /nfs/dbraw/zinc/17/68/71/333176871.db2.gz OWYLVCRQNVMYTG-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@@H]3CCC34CCC4)c2c1 ZINC000575901464 335129329 /nfs/dbraw/zinc/12/93/29/335129329.db2.gz LPXBIBRQMSWWIR-MRXNPFEDSA-N 1 0 299.374 3.541 20 5 CHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@H]3CCC34CCC4)c2c1 ZINC000575901463 335129385 /nfs/dbraw/zinc/12/93/85/335129385.db2.gz LPXBIBRQMSWWIR-INIZCTEOSA-N 1 0 299.374 3.541 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2c2ccccc2)cc1 ZINC000522269144 333277198 /nfs/dbraw/zinc/27/71/98/333277198.db2.gz DOOYNEHBLFJBHS-SFHVURJKSA-N 1 0 296.370 3.974 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000523610477 333333959 /nfs/dbraw/zinc/33/39/59/333333959.db2.gz WUIUUCUBMQNNLT-CYBMUJFWSA-N 1 0 294.395 3.860 20 5 CHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000303671711 333345316 /nfs/dbraw/zinc/34/53/16/333345316.db2.gz JVYIHFPOAMEJKP-OAHLLOKOSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000235303051 333367488 /nfs/dbraw/zinc/36/74/88/333367488.db2.gz AETRCJZLBPWIMM-IUODEOHRSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000235538293 333370677 /nfs/dbraw/zinc/37/06/77/333370677.db2.gz ASTYUWBEDQQDOX-AAEUAGOBSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H](CC[NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000237564824 333380267 /nfs/dbraw/zinc/38/02/67/333380267.db2.gz MIXPYPHYVQJKLN-HNNXBMFYSA-N 1 0 298.386 3.921 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCCc3ccccc32)cc1 ZINC000315728087 333383094 /nfs/dbraw/zinc/38/30/94/333383094.db2.gz LPZKIMFRBMQBDH-GOSISDBHSA-N 1 0 296.370 3.805 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)CC(C)C)cc1[N+](=O)[O-] ZINC000037260588 333525986 /nfs/dbraw/zinc/52/59/86/333525986.db2.gz ZBVMBQVEPCZPLF-STQMWFEESA-N 1 0 264.369 3.988 20 5 CHBDRO CC[C@@H](C)C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000538967118 333647106 /nfs/dbraw/zinc/64/71/06/333647106.db2.gz XVGVAFQYEWOEOJ-CYBMUJFWSA-N 1 0 264.369 3.553 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000539020246 333649332 /nfs/dbraw/zinc/64/93/32/333649332.db2.gz WCLIVDHEXUZRLT-QGZVFWFLSA-N 1 0 296.370 3.706 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1CCC(F)(F)CC1 ZINC000539520591 333676100 /nfs/dbraw/zinc/67/61/00/333676100.db2.gz LDNGGKHGRDVMGW-HWKANZROSA-N 1 0 296.317 3.776 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1C2CCC1CC2 ZINC000539802755 333691241 /nfs/dbraw/zinc/69/12/41/333691241.db2.gz MWGOVJHIBAVIQQ-PNESKVBLSA-N 1 0 260.337 3.591 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000540162606 333716175 /nfs/dbraw/zinc/71/61/75/333716175.db2.gz LFDPBBHKLBANKW-JQWIXIFHSA-N 1 0 284.306 3.823 20 5 CHBDRO CCCCOCCC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000132025750 333970467 /nfs/dbraw/zinc/97/04/67/333970467.db2.gz ODKJEDMQFFIVSG-CQSZACIVSA-N 1 0 294.395 3.761 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000545457232 333982904 /nfs/dbraw/zinc/98/29/04/333982904.db2.gz ASBWXMJKDXZDBK-MWLCHTKSSA-N 1 0 290.285 3.976 20 5 CHBDRO CCSCC[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000135471909 334131006 /nfs/dbraw/zinc/13/10/06/334131006.db2.gz YKOUMWREMDSQEG-NWDGAFQWSA-N 1 0 282.409 3.777 20 5 CHBDRO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CCC1CCCC1 ZINC000549171127 334186975 /nfs/dbraw/zinc/18/69/75/334186975.db2.gz NDUYLCJBLKKPBB-UHFFFAOYSA-N 1 0 276.380 3.649 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)cc1 ZINC000081635453 334201156 /nfs/dbraw/zinc/20/11/56/334201156.db2.gz MINATVPSTSFKKV-HUUCEWRRSA-N 1 0 274.364 3.653 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C2(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000551259837 334243207 /nfs/dbraw/zinc/24/32/07/334243207.db2.gz SMHBROAUTDZXPB-LBPRGKRZSA-N 1 0 262.353 3.742 20 5 CHBDRO CCC1CC([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000551778553 334260603 /nfs/dbraw/zinc/26/06/03/334260603.db2.gz JRXKWIWGBXLIHG-UHFFFAOYSA-N 1 0 282.771 3.569 20 5 CHBDRO C[C@@]1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000555606377 334484140 /nfs/dbraw/zinc/48/41/40/334484140.db2.gz KBQGXXGTQXVTLS-ROUUACIJSA-N 1 0 296.370 3.878 20 5 CHBDRO CO[C@@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C(C)(C)C ZINC000154944230 334708574 /nfs/dbraw/zinc/70/85/74/334708574.db2.gz REMLDHDTTHWHPM-DOMZBBRYSA-N 1 0 294.395 3.615 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C1CCCCC1 ZINC000579971335 335940613 /nfs/dbraw/zinc/94/06/13/335940613.db2.gz AVKKALHUVXRUBQ-AWEZNQCLSA-N 1 0 260.337 3.504 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCCCCC1 ZINC000380785551 336028998 /nfs/dbraw/zinc/02/89/98/336028998.db2.gz YJRMVKMDSIEHGM-UHFFFAOYSA-N 1 0 268.744 3.624 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000381796490 336073249 /nfs/dbraw/zinc/07/32/49/336073249.db2.gz SYLNWEHLNIEYJB-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000383626630 336115927 /nfs/dbraw/zinc/11/59/27/336115927.db2.gz UIFHWZUPYNSXFD-DGCLKSJQSA-N 1 0 280.343 3.744 20 5 CHBDRO CC(C)(C)C(C)(C)C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000386482763 336175658 /nfs/dbraw/zinc/17/56/58/336175658.db2.gz IPTXBKCHIMKLEI-UHFFFAOYSA-N 1 0 270.398 3.818 20 5 CHBDRO CCC[C@H](C)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000337258566 521038432 /nfs/dbraw/zinc/03/84/32/521038432.db2.gz VBOODONNESFOSH-ZDUSSCGKSA-N 1 0 292.379 3.627 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000037010512 522938265 /nfs/dbraw/zinc/93/82/65/522938265.db2.gz ZBVJFJFYGXWTKP-IUODEOHRSA-N 1 0 285.347 3.792 20 5 CHBDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000130172226 523122636 /nfs/dbraw/zinc/12/26/36/523122636.db2.gz NUKYCZJRQWGDDU-INIZCTEOSA-N 1 0 299.374 3.881 20 5 CHBDRO Cc1cccc(C)c1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000130403835 524263081 /nfs/dbraw/zinc/26/30/81/524263081.db2.gz NQTYVESZJIGSJF-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000048068866 524585792 /nfs/dbraw/zinc/58/57/92/524585792.db2.gz BJFYEVKAORRWDW-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000157952316 525480558 /nfs/dbraw/zinc/48/05/58/525480558.db2.gz IRVQWNZZCGLHFL-RISCZKNCSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc([N+](=O)[O-])cc1 ZINC000130587895 525690653 /nfs/dbraw/zinc/69/06/53/525690653.db2.gz NJRUIQQKHGTNJA-BZNIZROVSA-N 1 0 298.342 3.639 20 5 CHBDRO CCC(CC)[C@H](CC[NH2+]Cc1cccc([N+](=O)[O-])c1)OC ZINC000344827919 528851351 /nfs/dbraw/zinc/85/13/51/528851351.db2.gz ONUZOXHDDJKTJV-INIZCTEOSA-N 1 0 294.395 3.526 20 5 CHBDRO CC[C@@H]([NH2+]CCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000352776826 529165779 /nfs/dbraw/zinc/16/57/79/529165779.db2.gz DTFHASWDLKFFQU-QGZVFWFLSA-N 1 0 299.374 3.748 20 5 CHBDRO CC(C)CC[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000611254178 1121632250 /nfs/dbraw/zinc/63/22/50/1121632250.db2.gz HBDHMYUXORMLBU-SOFGYWHQSA-N 1 0 262.353 3.586 20 5 CHBDRO CC[C@@H](C)[N@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000507190268 1122937586 /nfs/dbraw/zinc/93/75/86/1122937586.db2.gz YKQLSVKDGJOFOP-GFCCVEGCSA-N 1 0 264.369 3.949 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)C1(C)CC1 ZINC000776882203 1123558032 /nfs/dbraw/zinc/55/80/32/1123558032.db2.gz OJBTZUMHNZAKFT-RYUDHWBXSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000129469448 1125337053 /nfs/dbraw/zinc/33/70/53/1125337053.db2.gz KRRXVKMXHRNBSN-DGCLKSJQSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H](OCCC[N+](C)(C)C)c1ccccc1Cl ZINC001224617980 1135462778 /nfs/dbraw/zinc/46/27/78/1135462778.db2.gz AURPZCMPJOOELU-GFCCVEGCSA-N 1 0 256.797 3.514 20 5 CHBDRO C[C@H](OCC[N+](C)(C)C)c1c(Cl)cccc1Cl ZINC001224772577 1135480567 /nfs/dbraw/zinc/48/05/67/1135480567.db2.gz AODZLKJWSMVYTB-JTQLQIEISA-N 1 0 277.215 3.777 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCC1(F)CCC1)CCC2 ZINC000348318785 1125544274 /nfs/dbraw/zinc/54/42/74/1125544274.db2.gz FXSDPSAXRCETQV-HNNXBMFYSA-N 1 0 292.354 3.844 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](F)C2)cc1[N+](=O)[O-] ZINC000348338232 1125593976 /nfs/dbraw/zinc/59/39/76/1125593976.db2.gz VBNILXJEGBPOLA-WCFLWFBJSA-N 1 0 296.342 3.535 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cc(C)ccc1C ZINC000886300716 1125666713 /nfs/dbraw/zinc/66/67/13/1125666713.db2.gz OLJHSXIXNVOHBR-MRXNPFEDSA-N 1 0 299.374 3.848 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3cccnc32)cc1[N+](=O)[O-] ZINC000886550120 1125690297 /nfs/dbraw/zinc/69/02/97/1125690297.db2.gz SLUYATTVMKDVFR-SWLSCSKDSA-N 1 0 297.358 3.636 20 5 CHBDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000121969083 1125780471 /nfs/dbraw/zinc/78/04/71/1125780471.db2.gz LZEDDBBJPIGMLZ-OLZOCXBDSA-N 1 0 294.395 3.757 20 5 CHBDRO CC1=C(c2ccco2)C[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000338337641 1126734570 /nfs/dbraw/zinc/73/45/70/1126734570.db2.gz AKFOXWKIWSLESZ-UHFFFAOYSA-N 1 0 298.342 3.867 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)cc(Cl)c2)cc1 ZINC000160892493 1126784445 /nfs/dbraw/zinc/78/44/45/1126784445.db2.gz UQLUGJBCNOADRK-UHFFFAOYSA-N 1 0 294.713 3.677 20 5 CHBDRO Cc1ccc2c(c1)CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000483994757 1126809134 /nfs/dbraw/zinc/80/91/34/1126809134.db2.gz OONBYOIUFKQEOG-UHFFFAOYSA-N 1 0 296.370 3.504 20 5 CHBDRO CC(C)[C@H](C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000484160485 1126811965 /nfs/dbraw/zinc/81/19/65/1126811965.db2.gz LJJDYSNLFPPUDW-CZUORRHYSA-N 1 0 290.407 3.798 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CCc1ccncc1 ZINC000181482271 1126855977 /nfs/dbraw/zinc/85/59/77/1126855977.db2.gz GLBJUMUATZZNKR-AWEZNQCLSA-N 1 0 299.374 3.534 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccn1 ZINC000192594128 1126962541 /nfs/dbraw/zinc/96/25/41/1126962541.db2.gz VXCJEOLWIJNQSR-PXAZEXFGSA-N 1 0 297.358 3.718 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccn1 ZINC000192594084 1126962634 /nfs/dbraw/zinc/96/26/34/1126962634.db2.gz VXCJEOLWIJNQSR-YVEFUNNKSA-N 1 0 297.358 3.718 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000348539826 1127121369 /nfs/dbraw/zinc/12/13/69/1127121369.db2.gz BMDKVOMQNNJMOF-INIZCTEOSA-N 1 0 268.316 3.542 20 5 CHBDRO C[C@H](CC(F)(F)F)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000222262887 1127162123 /nfs/dbraw/zinc/16/21/23/1127162123.db2.gz AGCQSENNJJBJSW-SSDOTTSWSA-N 1 0 296.676 3.679 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C)CC1 ZINC000349975659 1127169722 /nfs/dbraw/zinc/16/97/22/1127169722.db2.gz OETHAEFBJSJAFY-LBPRGKRZSA-N 1 0 262.353 3.525 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000286905376 1127275881 /nfs/dbraw/zinc/27/58/81/1127275881.db2.gz JJIYLGFYFOZBBA-UHFFFAOYSA-N 1 0 284.306 3.605 20 5 CHBDRO Cc1cc(C)c(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000058092744 1127307704 /nfs/dbraw/zinc/30/77/04/1127307704.db2.gz XKFLQCLAXZTENG-UHFFFAOYSA-N 1 0 298.386 3.852 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC2(C(F)F)CC2)cc1[N+](=O)[O-] ZINC000355174473 1127323198 /nfs/dbraw/zinc/32/31/98/1127323198.db2.gz ZLRVUPYOSMVJRU-UHFFFAOYSA-N 1 0 298.333 3.853 20 5 CHBDRO CCCCC[N@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H](C)CCC ZINC000355537596 1127348132 /nfs/dbraw/zinc/34/81/32/1127348132.db2.gz AFNVVINJXOJZKM-CYBMUJFWSA-N 1 0 296.415 3.509 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CC1CCC(F)CC1 ZINC000592376681 1127343431 /nfs/dbraw/zinc/34/34/31/1127343431.db2.gz DXDBDPXWVLJNLO-HWKANZROSA-N 1 0 292.354 3.726 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)CC(F)F ZINC000592392403 1127344727 /nfs/dbraw/zinc/34/47/27/1127344727.db2.gz QWHREDLBXSYXDY-KOLCDFICSA-N 1 0 286.322 3.845 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)F ZINC000592392355 1127344989 /nfs/dbraw/zinc/34/49/89/1127344989.db2.gz MQDJFYDQYSLIGL-ZJUUUORDSA-N 1 0 272.295 3.537 20 5 CHBDRO CC[N@H+](CCSC)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000592204052 1127345065 /nfs/dbraw/zinc/34/50/65/1127345065.db2.gz QZAZEPAENDCWHV-GFCCVEGCSA-N 1 0 282.409 3.649 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)cccc1[N+](=O)[O-] ZINC000592400817 1127373705 /nfs/dbraw/zinc/37/37/05/1127373705.db2.gz WBQMUGPBLGZQIE-XDQVBPFNSA-N 1 0 274.364 3.742 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761053952 1127413028 /nfs/dbraw/zinc/41/30/28/1127413028.db2.gz IFKIOJYXSLACPQ-KOLCDFICSA-N 1 0 288.269 3.540 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000594490225 1127418291 /nfs/dbraw/zinc/41/82/91/1127418291.db2.gz ISVIIDYGCMTVQL-LRDDRELGSA-N 1 0 282.343 3.933 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC[C@@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000594511321 1127420293 /nfs/dbraw/zinc/42/02/93/1127420293.db2.gz FTAKRJOYBMSPTR-WOPDTQHZSA-N 1 0 280.393 3.530 20 5 CHBDRO C[C@H]([NH2+][C@H]1C[C@H](OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000594514171 1127420380 /nfs/dbraw/zinc/42/03/80/1127420380.db2.gz HMVHYEVGZCUNDB-WHOFXGATSA-N 1 0 292.379 3.592 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC(C)(C)F ZINC000594973170 1127438061 /nfs/dbraw/zinc/43/80/61/1127438061.db2.gz OUCNLJZLVRMJPG-FMIVXFBMSA-N 1 0 280.343 3.726 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@]23C[C@@H]2CCC3)cc1[N+](=O)[O-] ZINC000594954033 1127439921 /nfs/dbraw/zinc/43/99/21/1127439921.db2.gz WSLZBZMFSXQPAR-BBRMVZONSA-N 1 0 274.364 3.750 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C2CC(CF)(CF)C2)cc1[N+](=O)[O-] ZINC000595025020 1127443218 /nfs/dbraw/zinc/44/32/18/1127443218.db2.gz DOXARHMDTCORRC-LLVKDONJSA-N 1 0 298.333 3.642 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CCC(F)CC1 ZINC000594988706 1127444469 /nfs/dbraw/zinc/44/44/69/1127444469.db2.gz BSNVHIDDCQXZAE-XGNXJENSSA-N 1 0 280.343 3.601 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccs1 ZINC000595004269 1127445331 /nfs/dbraw/zinc/44/53/31/1127445331.db2.gz OBCSDGRMUXLLRI-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO CSCC1(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595071754 1127448669 /nfs/dbraw/zinc/44/86/69/1127448669.db2.gz DKDCBFNPERKZGI-LBPRGKRZSA-N 1 0 294.420 3.779 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCC=C(C)C ZINC000595041785 1127450528 /nfs/dbraw/zinc/45/05/28/1127450528.db2.gz RDUMZAKNUQFZFI-GFCCVEGCSA-N 1 0 278.352 3.610 20 5 CHBDRO CC[C@H]([NH2+]C[C@H](C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000595049826 1127450925 /nfs/dbraw/zinc/45/09/25/1127450925.db2.gz PHDRIJIBWVIFFE-BBRMVZONSA-N 1 0 299.374 3.834 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595079640 1127453450 /nfs/dbraw/zinc/45/34/50/1127453450.db2.gz MDEKYBNKHFODHV-CHWSQXEVSA-N 1 0 284.306 3.681 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CCC(C)(C)F)cc1[N+](=O)[O-] ZINC000595085302 1127453537 /nfs/dbraw/zinc/45/35/37/1127453537.db2.gz JYCBINOQQLAQIJ-NSHDSACASA-N 1 0 298.358 3.782 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000595078834 1127453587 /nfs/dbraw/zinc/45/35/87/1127453587.db2.gz BGIHOLBBEHFYNR-SMDDNHRTSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000595078832 1127453683 /nfs/dbraw/zinc/45/36/83/1127453683.db2.gz BGIHOLBBEHFYNR-FZMZJTMJSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000595080861 1127453732 /nfs/dbraw/zinc/45/37/32/1127453732.db2.gz OZWPRINGCWGQAT-NHYWBVRUSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]([NH2+]CC[C@]1(C)CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595081271 1127453741 /nfs/dbraw/zinc/45/37/41/1127453741.db2.gz RFOMZYOUEFMZGK-ZWNOBZJWSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000595093329 1127454608 /nfs/dbraw/zinc/45/46/08/1127454608.db2.gz ZVPFKKXPOPJZKO-GTNSWQLSSA-N 1 0 298.342 3.639 20 5 CHBDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359293510 1127456719 /nfs/dbraw/zinc/45/67/19/1127456719.db2.gz FPFTUFGXWWVTIJ-BBRMVZONSA-N 1 0 274.364 3.607 20 5 CHBDRO CC(C)[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000359299334 1127457474 /nfs/dbraw/zinc/45/74/74/1127457474.db2.gz ASZTZPIHAZFWNE-QGZVFWFLSA-N 1 0 299.374 3.519 20 5 CHBDRO C[C@H]([N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)C1(C)CC1 ZINC000360027080 1127487159 /nfs/dbraw/zinc/48/71/59/1127487159.db2.gz DBBRQDHWRSERFX-JTQLQIEISA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000596650702 1127515171 /nfs/dbraw/zinc/51/51/71/1127515171.db2.gz KEFNRRGBCXFKBF-DIFFPNOSSA-N 1 0 297.358 3.515 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)C[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000360930380 1127521339 /nfs/dbraw/zinc/52/13/39/1127521339.db2.gz LCHOYVUTLIICGA-KWCYVHTRSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC23CC3)cc1[N+](=O)[O-] ZINC000597059369 1127526016 /nfs/dbraw/zinc/52/60/16/1127526016.db2.gz JTPJIEZLOMQVIE-IUODEOHRSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1c(C[N@H+](C2CC2)C2CCCC2)cccc1[N+](=O)[O-] ZINC000060562753 1127544336 /nfs/dbraw/zinc/54/43/36/1127544336.db2.gz QCFHRQDBWXERRA-UHFFFAOYSA-N 1 0 274.364 3.810 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)Cc2ccncc2)cccc1[N+](=O)[O-] ZINC000361967273 1127603091 /nfs/dbraw/zinc/60/30/91/1127603091.db2.gz KALCCINIQRGSRP-OCCSQVGLSA-N 1 0 299.374 3.580 20 5 CHBDRO CCC1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCC1 ZINC000602676790 1127605636 /nfs/dbraw/zinc/60/56/36/1127605636.db2.gz DXLVOFKTOOWMJC-UHFFFAOYSA-N 1 0 289.335 3.548 20 5 CHBDRO CCCc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000598639810 1127629634 /nfs/dbraw/zinc/62/96/34/1127629634.db2.gz JMHMRQGHECSONC-UHFFFAOYSA-N 1 0 290.388 3.899 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC[C@@H]2CC2(F)F)cccc1[N+](=O)[O-] ZINC000598679596 1127631269 /nfs/dbraw/zinc/63/12/69/1127631269.db2.gz KPJGENWQTHYIFA-GHMZBOCLSA-N 1 0 284.306 3.599 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC[C@H]1CC1(F)F)CCC2 ZINC000598680350 1127632177 /nfs/dbraw/zinc/63/21/77/1127632177.db2.gz XQAGTHYPLMWPCZ-FZMZJTMJSA-N 1 0 296.317 3.607 20 5 CHBDRO CC[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)[NH+]1CCCC1 ZINC000603629365 1127663191 /nfs/dbraw/zinc/66/31/91/1127663191.db2.gz BVEZMRLIQPTWQM-NSHDSACASA-N 1 0 297.786 3.535 20 5 CHBDRO COc1ccc(C[N@H+](C)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000603837847 1127673869 /nfs/dbraw/zinc/67/38/69/1127673869.db2.gz PAZUBPUSWXIWEM-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000603836686 1127675404 /nfs/dbraw/zinc/67/54/04/1127675404.db2.gz AKYZTTMVYBCJAE-CQSZACIVSA-N 1 0 262.353 3.668 20 5 CHBDRO CCC(CC)C[N@H+](CC)CCOc1ccccc1[N+](=O)[O-] ZINC000603849891 1127676845 /nfs/dbraw/zinc/67/68/45/1127676845.db2.gz ZMDWPNAXNFJVSL-UHFFFAOYSA-N 1 0 294.395 3.732 20 5 CHBDRO CCC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000603900932 1127681318 /nfs/dbraw/zinc/68/13/18/1127681318.db2.gz IIOAHYGLCVIONB-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO C[NH+](C)C1(CNc2ccc([N+](=O)[O-])s2)CCCCCC1 ZINC000603937080 1127684194 /nfs/dbraw/zinc/68/41/94/1127684194.db2.gz GEJDHVUNKLVVFM-UHFFFAOYSA-N 1 0 297.424 3.723 20 5 CHBDRO C[C@@H]1CCC[N@H+](CCCCNc2ccc([N+](=O)[O-])s2)C1 ZINC000604409274 1127702980 /nfs/dbraw/zinc/70/29/80/1127702980.db2.gz MTBBFXJNVGLLEE-GFCCVEGCSA-N 1 0 297.424 3.580 20 5 CHBDRO CC[N@H+](CCC(F)(F)F)Cc1cccc([N+](=O)[O-])c1C ZINC000604525267 1127706811 /nfs/dbraw/zinc/70/68/11/1127706811.db2.gz DUVOYUFZQCKULF-UHFFFAOYSA-N 1 0 290.285 3.678 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000298250253 1127716922 /nfs/dbraw/zinc/71/69/22/1127716922.db2.gz KLFYCNRCRXPKSR-DDTOSNHZSA-N 1 0 296.317 3.633 20 5 CHBDRO CCOC1(C)CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000298429329 1127723433 /nfs/dbraw/zinc/72/34/33/1127723433.db2.gz YGLVZWHUBGKWRJ-CYBMUJFWSA-N 1 0 292.379 3.547 20 5 CHBDRO C[C@@H]1CC[C@@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000230417772 1127753867 /nfs/dbraw/zinc/75/38/67/1127753867.db2.gz QXAQJMFPQQRXDS-GHMZBOCLSA-N 1 0 282.771 3.774 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccsc2)cc1[N+](=O)[O-] ZINC000063152316 1127799071 /nfs/dbraw/zinc/79/90/71/1127799071.db2.gz HCAKBUZIOWPVJY-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO CC[N@H+](CCc1cccs1)Cc1cccc([N+](=O)[O-])c1 ZINC000063755667 1127864357 /nfs/dbraw/zinc/86/43/57/1127864357.db2.gz LKLZRKWWSKNMOF-UHFFFAOYSA-N 1 0 290.388 3.721 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000374007187 1127870331 /nfs/dbraw/zinc/87/03/31/1127870331.db2.gz CJWZFJSKXIVTJV-TZMCWYRMSA-N 1 0 286.331 3.738 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000539500757 1127925828 /nfs/dbraw/zinc/92/58/28/1127925828.db2.gz OZOFEJZYCHAHQZ-UMVBOHGHSA-N 1 0 274.364 3.653 20 5 CHBDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000076067351 1127932058 /nfs/dbraw/zinc/93/20/58/1127932058.db2.gz BUOSZHWXDDITOR-HUUCEWRRSA-N 1 0 294.420 3.701 20 5 CHBDRO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539827557 1127943968 /nfs/dbraw/zinc/94/39/68/1127943968.db2.gz IKYAZRWARYTEQS-FZMZJTMJSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000540055014 1127959662 /nfs/dbraw/zinc/95/96/62/1127959662.db2.gz AUJZCXUHJYUXAD-FZMZJTMJSA-N 1 0 262.353 3.666 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC=CCC1 ZINC000540172293 1127966070 /nfs/dbraw/zinc/96/60/70/1127966070.db2.gz YDMOGPHCKUBPDF-QWHCGFSZSA-N 1 0 260.337 3.663 20 5 CHBDRO C[C@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000544405092 1127972176 /nfs/dbraw/zinc/97/21/76/1127972176.db2.gz ULDKUWBJYPXDRT-HNNXBMFYSA-N 1 0 298.386 3.606 20 5 CHBDRO CCC[NH+](CCC)Cc1ccc([N+](=O)[O-])cc1C ZINC000544606326 1127977956 /nfs/dbraw/zinc/97/79/56/1127977956.db2.gz ZFIOLWCAFOMDAD-UHFFFAOYSA-N 1 0 250.342 3.525 20 5 CHBDRO Cc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)c1 ZINC000544612285 1127979497 /nfs/dbraw/zinc/97/94/97/1127979497.db2.gz VBKDWMDVCUFFSR-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H](C)C1 ZINC000468260563 1128000026 /nfs/dbraw/zinc/00/00/26/1128000026.db2.gz KYKAOOKDXIHWFW-OLZOCXBDSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)s1 ZINC000541772419 1128038785 /nfs/dbraw/zinc/03/87/85/1128038785.db2.gz ZCONECWKYYCULL-UHFFFAOYSA-N 1 0 290.388 3.905 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC2(CCC2)C1 ZINC000470179403 1128064857 /nfs/dbraw/zinc/06/48/57/1128064857.db2.gz XEFBYCZGELMXCN-GXDHUFHOSA-N 1 0 286.375 3.874 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C1CCCC1 ZINC000470176210 1128065072 /nfs/dbraw/zinc/06/50/72/1128065072.db2.gz JHOLCZZHTBWPNP-JLHYYAGUSA-N 1 0 274.364 3.873 20 5 CHBDRO CCCC[N@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470176659 1128065078 /nfs/dbraw/zinc/06/50/78/1128065078.db2.gz XUOGSYODSJADPD-RAXLEYEMSA-N 1 0 262.353 3.730 20 5 CHBDRO CC[C@@H](C)[N@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470179136 1128065094 /nfs/dbraw/zinc/06/50/94/1128065094.db2.gz SSXREKYQKCHKEE-KIWPFMIBSA-N 1 0 262.353 3.728 20 5 CHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000471022910 1128085578 /nfs/dbraw/zinc/08/55/78/1128085578.db2.gz QRSIAWROHQMFIE-RDTXWAMCSA-N 1 0 296.370 3.830 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CC=CC3)o2)cc1 ZINC000151968821 1128087637 /nfs/dbraw/zinc/08/76/37/1128087637.db2.gz CLRCYIXPJZBPMN-UHFFFAOYSA-N 1 0 284.315 3.663 20 5 CHBDRO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000272018562 1128096399 /nfs/dbraw/zinc/09/63/99/1128096399.db2.gz RNEWRTOSBXKVRA-CYBMUJFWSA-N 1 0 282.343 3.935 20 5 CHBDRO C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519535 1128132847 /nfs/dbraw/zinc/13/28/47/1128132847.db2.gz BILLYDYJKVYZNX-BXKDBHETSA-N 1 0 268.744 3.526 20 5 CHBDRO C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCCC1 ZINC000494199794 1128160243 /nfs/dbraw/zinc/16/02/43/1128160243.db2.gz YMINPVBCXXGGLO-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@]2(C)CCCCO2)cccc1[N+](=O)[O-] ZINC000927025381 1128208997 /nfs/dbraw/zinc/20/89/97/1128208997.db2.gz YKAUQMYKUOMONI-BBRMVZONSA-N 1 0 292.379 3.513 20 5 CHBDRO CC[N@H+](Cc1ccncc1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000272507330 1128349289 /nfs/dbraw/zinc/34/92/89/1128349289.db2.gz OJLISWCLDGJXFC-CQSZACIVSA-N 1 0 299.374 3.881 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000272594535 1128361715 /nfs/dbraw/zinc/36/17/15/1128361715.db2.gz IESPUPWTCAPUBA-SNVBAGLBSA-N 1 0 294.738 3.735 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(CF)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000932177783 1128398436 /nfs/dbraw/zinc/39/84/36/1128398436.db2.gz RRPDQVWRCUHBSS-GFCCVEGCSA-N 1 0 288.322 3.915 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)CC(C)C)cc1[N+](=O)[O-] ZINC000037260590 1128428201 /nfs/dbraw/zinc/42/82/01/1128428201.db2.gz ZBVMBQVEPCZPLF-CHWSQXEVSA-N 1 0 264.369 3.988 20 5 CHBDRO CCC(CC)C[N@H+](CC)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917054853 1128469765 /nfs/dbraw/zinc/46/97/65/1128469765.db2.gz WSCSFQAVKHWDLD-UHFFFAOYSA-N 1 0 282.359 3.992 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000564081518 1128492388 /nfs/dbraw/zinc/49/23/88/1128492388.db2.gz WOFLUAGZGPDZFJ-UKRRQHHQSA-N 1 0 297.358 3.540 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1-c1cccc(C[NH2+]C2CC2)c1 ZINC000600788577 1128681200 /nfs/dbraw/zinc/68/12/00/1128681200.db2.gz DTXCXSSTCNBJCN-UHFFFAOYSA-N 1 0 286.306 3.653 20 5 CHBDRO C[C@H]1CCC[C@H](C)[NH+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609417695 1128714688 /nfs/dbraw/zinc/71/46/88/1128714688.db2.gz ILQYIWABUMYZKQ-KBPBESRZSA-N 1 0 292.379 3.627 20 5 CHBDRO CCCC[N@H+](CC)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705211 1128722851 /nfs/dbraw/zinc/72/28/51/1128722851.db2.gz GFUQTSFGVRFXMW-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000610080162 1128737903 /nfs/dbraw/zinc/73/79/03/1128737903.db2.gz KFWQRTQAMTVOHN-LBPRGKRZSA-N 1 0 268.382 3.811 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)CCC[C@@H]1C ZINC000610215387 1117882196 /nfs/dbraw/zinc/88/21/96/1117882196.db2.gz KQEVFCWLXABPRH-STQMWFEESA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000090918552 1117923682 /nfs/dbraw/zinc/92/36/82/1117923682.db2.gz TUDXVXNTSVVLIP-SKDRFNHKSA-N 1 0 290.285 3.976 20 5 CHBDRO CC1(C)CC[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000164873224 1117955075 /nfs/dbraw/zinc/95/50/75/1117955075.db2.gz IKFICDGDRIYVTP-LBPRGKRZSA-N 1 0 282.771 3.917 20 5 CHBDRO CC[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000509535924 1117958604 /nfs/dbraw/zinc/95/86/04/1117958604.db2.gz AEDVNCQHEJFENM-DEBLGDTFSA-N 1 0 274.364 3.730 20 5 CHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000359298116 1117984434 /nfs/dbraw/zinc/98/44/34/1117984434.db2.gz KSKOVKBKHOPDOR-MLGOLLRUSA-N 1 0 292.354 3.746 20 5 CHBDRO Cc1cccc(C(C)(C)[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000179583109 1128749092 /nfs/dbraw/zinc/74/90/92/1128749092.db2.gz NTSCFXJVYZNKGW-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CCCc3ccccc32)c1 ZINC000340140056 1118080081 /nfs/dbraw/zinc/08/00/81/1118080081.db2.gz LPJBIZKNUOVHNL-SFHVURJKSA-N 1 0 296.370 3.805 20 5 CHBDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000071117706 1118436511 /nfs/dbraw/zinc/43/65/11/1118436511.db2.gz ACUCVNYASBUGFW-OCCSQVGLSA-N 1 0 262.353 3.653 20 5 CHBDRO CC(C)(C[NH2+]Cc1csc([N+](=O)[O-])c1)c1cccs1 ZINC000083601885 1118455815 /nfs/dbraw/zinc/45/58/15/1118455815.db2.gz UCVIRZAHFMWMEM-UHFFFAOYSA-N 1 0 296.417 3.785 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000579749221 1118484885 /nfs/dbraw/zinc/48/48/85/1118484885.db2.gz MCRBMKIBUBVCOA-LSDHHAIUSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000253071544 1118499816 /nfs/dbraw/zinc/49/98/16/1118499816.db2.gz NHHIOFMDTWPWQK-WDEREUQCSA-N 1 0 282.771 3.726 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2Nc1cc(C2CC2)ccn1 ZINC000580783869 1118504170 /nfs/dbraw/zinc/50/41/70/1118504170.db2.gz NLOPRXNPYLVIFV-HNNXBMFYSA-N 1 0 295.342 3.967 20 5 CHBDRO C[C@H](c1ccccc1)N(C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394943964 1118562997 /nfs/dbraw/zinc/56/29/97/1118562997.db2.gz HNSFGQBOUVXDPS-GFCCVEGCSA-N 1 0 288.322 3.927 20 5 CHBDRO CSCC1CCC([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000296431961 1118584123 /nfs/dbraw/zinc/58/41/23/1118584123.db2.gz NHCOXVLPIFFZMV-UHFFFAOYSA-N 1 0 294.420 3.606 20 5 CHBDRO C[C@H]([N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)(C)C ZINC000610581097 1118595216 /nfs/dbraw/zinc/59/52/16/1118595216.db2.gz IRQSLNXYNYLFOU-JTQLQIEISA-N 1 0 291.351 3.602 20 5 CHBDRO CCCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000610581263 1118778265 /nfs/dbraw/zinc/77/82/65/1118778265.db2.gz WFOBGGSTFLFQNU-UHFFFAOYSA-N 1 0 289.335 3.501 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000162483215 1118801846 /nfs/dbraw/zinc/80/18/46/1118801846.db2.gz YJNBTYQNAZHMIJ-AAEUAGOBSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCC[C@@H]2CCCF)cc1 ZINC000510731214 1118804593 /nfs/dbraw/zinc/80/45/93/1118804593.db2.gz HRIRZFDSTXBPGZ-ZBFHGGJFSA-N 1 0 294.370 3.645 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000610796091 1118872698 /nfs/dbraw/zinc/87/26/98/1118872698.db2.gz GSVLYKUBARXWBY-ZYHUDNBSSA-N 1 0 250.342 3.742 20 5 CHBDRO CCC[C@@H](CC)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000050401966 1119118178 /nfs/dbraw/zinc/11/81/78/1119118178.db2.gz JXGSSZKNMAKPLO-CYBMUJFWSA-N 1 0 250.342 3.572 20 5 CHBDRO CC(C)[N@H+](C/C=C\Cl)Cc1ccc([N+](=O)[O-])cc1 ZINC000255517326 1119120141 /nfs/dbraw/zinc/12/01/41/1119120141.db2.gz BDEBYOSSUZLCMG-BAQGIRSFSA-N 1 0 268.744 3.558 20 5 CHBDRO CC(C)[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000158713825 1119151256 /nfs/dbraw/zinc/15/12/56/1119151256.db2.gz KKDMGHLXZDHRBV-UHFFFAOYSA-N 1 0 274.320 3.695 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000050225218 1119160400 /nfs/dbraw/zinc/16/04/00/1119160400.db2.gz JHGIBHIWEYZCLP-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO CC(C)(C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178677570 1119225486 /nfs/dbraw/zinc/22/54/86/1119225486.db2.gz RRLFAGZYJQGZLE-CQSZACIVSA-N 1 0 276.380 3.552 20 5 CHBDRO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000563820988 1119441244 /nfs/dbraw/zinc/44/12/44/1119441244.db2.gz MXMUQMBGOCEBCP-UHFFFAOYSA-N 1 0 250.342 3.524 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@@H](C)CCOC)c1cccc([N+](=O)[O-])c1 ZINC000414194281 1119933755 /nfs/dbraw/zinc/93/37/55/1119933755.db2.gz IPPTURJLYHIQAZ-XJKSGUPXSA-N 1 0 294.395 3.698 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)cccc1[N+](=O)[O-] ZINC000414211984 1119941735 /nfs/dbraw/zinc/94/17/35/1119941735.db2.gz PJIPWFBKRCOSFT-RJZRQDKASA-N 1 0 274.364 3.742 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000181261765 1120032616 /nfs/dbraw/zinc/03/26/16/1120032616.db2.gz HFTHKJWRDQXXQV-SMDDNHRTSA-N 1 0 292.379 3.592 20 5 CHBDRO C[NH+](C)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000301519120 1120091134 /nfs/dbraw/zinc/09/11/34/1120091134.db2.gz HEDNKWHLYPBCCO-MNOVXSKESA-N 1 0 297.786 3.533 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C/C=C/Cl ZINC000903446558 1120107969 /nfs/dbraw/zinc/10/79/69/1120107969.db2.gz YLMORZGXYMFHBG-BSPAPZMXSA-N 1 0 286.784 3.720 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000273437280 1120116825 /nfs/dbraw/zinc/11/68/25/1120116825.db2.gz MFXKXVRFWXARKV-INIZCTEOSA-N 1 0 285.347 3.568 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)CC[C@@H]1C ZINC000542701424 1120122218 /nfs/dbraw/zinc/12/22/18/1120122218.db2.gz FDIKXQCYPQTBHL-AAEUAGOBSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@H](c1ccccc1)[C@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123164387 1120170629 /nfs/dbraw/zinc/17/06/29/1120170629.db2.gz CXFGSGZTGXVRAI-GJZGRUSLSA-N 1 0 298.386 3.919 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC1(C)C ZINC000468634657 1120231213 /nfs/dbraw/zinc/23/12/13/1120231213.db2.gz GYESPZHANZEXPA-GMMCIKNFSA-N 1 0 274.364 3.634 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)nc1 ZINC000930594577 1120299187 /nfs/dbraw/zinc/29/91/87/1120299187.db2.gz MBGVRNNUTVPHRX-WDEREUQCSA-N 1 0 289.310 3.541 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCCF)CCCC2 ZINC000417354438 1120434771 /nfs/dbraw/zinc/43/47/71/1120434771.db2.gz ZJFSNDBPKBKIIG-OAHLLOKOSA-N 1 0 280.343 3.702 20 5 CHBDRO CC[C@H](C)C[N@H+](CC)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000466201976 1120448435 /nfs/dbraw/zinc/44/84/35/1120448435.db2.gz KNCRIXHCPQLNIH-NSHDSACASA-N 1 0 298.358 3.611 20 5 CHBDRO COC1(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCCC1 ZINC000315585665 1120462931 /nfs/dbraw/zinc/46/29/31/1120462931.db2.gz SPPJTYPYMBRAMB-CYBMUJFWSA-N 1 0 292.379 3.513 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000020092199 1120481504 /nfs/dbraw/zinc/48/15/04/1120481504.db2.gz GIBQQWIHJUYFJH-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000618567147 1128919799 /nfs/dbraw/zinc/91/97/99/1128919799.db2.gz ZBERBSMEWSANEA-MEDUHNTESA-N 1 0 274.364 3.608 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc2cc[nH]c21)c1cccc([N+](=O)[O-])c1 ZINC000317937555 1120520201 /nfs/dbraw/zinc/52/02/01/1120520201.db2.gz SMLAANUILLDCLS-LBPRGKRZSA-N 1 0 295.342 3.927 20 5 CHBDRO Cc1c(C[NH2+]Cc2cc3ccccc3o2)cccc1[N+](=O)[O-] ZINC000317981905 1120521069 /nfs/dbraw/zinc/52/10/69/1120521069.db2.gz DDFKYGUFWGTGCT-UHFFFAOYSA-N 1 0 296.326 3.939 20 5 CHBDRO Cc1ccsc1[C@@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000070091907 1120528405 /nfs/dbraw/zinc/52/84/05/1120528405.db2.gz PVAPRFJOAGNEDA-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000922540473 1120550070 /nfs/dbraw/zinc/55/00/70/1120550070.db2.gz JPWQVKSBMNNNDN-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccn1 ZINC000093338685 1120558372 /nfs/dbraw/zinc/55/83/72/1120558372.db2.gz MVIIBZUMECXLQD-VQHVLOKHSA-N 1 0 297.358 3.525 20 5 CHBDRO CSCC[C@@H](C)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093558616 1120561984 /nfs/dbraw/zinc/56/19/84/1120561984.db2.gz JBKZEONLYGMVAS-STMXVASLSA-N 1 0 294.420 3.681 20 5 CHBDRO CC(C)(/C=C\Cl)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000922649053 1120572233 /nfs/dbraw/zinc/57/22/33/1120572233.db2.gz RLIACMQOWDBDNT-MLMNYHKTSA-N 1 0 280.755 3.729 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCSC3(CCC3)C2)cc1 ZINC000922843296 1120610597 /nfs/dbraw/zinc/61/05/97/1120610597.db2.gz UNMWCDCLSSTGTA-ZDUSSCGKSA-N 1 0 292.404 3.503 20 5 CHBDRO CCC(CC)C[N@H+](CC)Cc1c(F)cccc1[N+](=O)[O-] ZINC000509128744 1120666991 /nfs/dbraw/zinc/66/69/91/1120666991.db2.gz WSMNKQVFSLLQLK-UHFFFAOYSA-N 1 0 282.359 3.992 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000093632512 1120835655 /nfs/dbraw/zinc/83/56/55/1120835655.db2.gz NRFPWJMEIYVXGP-ZWNOBZJWSA-N 1 0 282.771 3.917 20 5 CHBDRO O=[N+]([O-])c1ccc(SCCC[NH+]2CCCCC2)c(F)c1 ZINC000618962807 1128956615 /nfs/dbraw/zinc/95/66/15/1128956615.db2.gz GVJYWKVDDVDBDO-UHFFFAOYSA-N 1 0 298.383 3.702 20 5 CHBDRO CCC1CC([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000585764766 1121032967 /nfs/dbraw/zinc/03/29/67/1121032967.db2.gz DHDJCUDSEATIBB-LKSINWNRSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(CCC2)C1 ZINC000344210031 1121120470 /nfs/dbraw/zinc/12/04/70/1121120470.db2.gz CTUFJQZFWAGXOG-GFCCVEGCSA-N 1 0 260.337 3.532 20 5 CHBDRO C[C@@H]1CCCC[C@H]1CC[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000512226839 1121210601 /nfs/dbraw/zinc/21/06/01/1121210601.db2.gz PPUZFKZKKWAZLO-HIFRSBDPSA-N 1 0 276.380 3.901 20 5 CHBDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000042857644 1121318655 /nfs/dbraw/zinc/31/86/55/1121318655.db2.gz DZQJTRZRYCNHQM-JSGCOSHPSA-N 1 0 262.353 3.511 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH+]2CCC3(CC3)CC2)ccc1Cl ZINC000706916444 1121443613 /nfs/dbraw/zinc/44/36/13/1121443613.db2.gz SMOHZURJDAYARX-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000512653365 1121510327 /nfs/dbraw/zinc/51/03/27/1121510327.db2.gz WNNFKPHLMQHFSS-VCELZJIISA-N 1 0 286.375 3.873 20 5 CHBDRO C[C@@H]1CC[C@@H]([N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000433037396 1121532345 /nfs/dbraw/zinc/53/23/45/1121532345.db2.gz FACAXIAXFLZVDJ-BBUPELFUSA-N 1 0 274.364 3.728 20 5 CHBDRO CC1(C)CC([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000433228189 1121622960 /nfs/dbraw/zinc/62/29/60/1121622960.db2.gz VYKMVYLRWMWFLE-UHFFFAOYSA-N 1 0 282.771 3.569 20 5 CHBDRO Cc1c(C[N@H+]2CC3(CCC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000433256849 1121631308 /nfs/dbraw/zinc/63/13/08/1121631308.db2.gz CATFGSBYIKQYKH-GFCCVEGCSA-N 1 0 274.364 3.668 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000611248257 1121632275 /nfs/dbraw/zinc/63/22/75/1121632275.db2.gz ZTORTDQRXXYLCP-RYUDHWBXSA-N 1 0 292.379 3.690 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000611271344 1121633945 /nfs/dbraw/zinc/63/39/45/1121633945.db2.gz SNRPIEXWYVGVTP-VFQAQYNWSA-N 1 0 298.342 3.691 20 5 CHBDRO Cc1cccc2c1CC[C@@H]2[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000611337335 1121638226 /nfs/dbraw/zinc/63/82/26/1121638226.db2.gz RYSMADKVIYNRCY-SFHVURJKSA-N 1 0 296.370 3.723 20 5 CHBDRO CC(C)C([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)C ZINC000611434110 1121647253 /nfs/dbraw/zinc/64/72/53/1121647253.db2.gz NTFVAOCUHBYEQX-UHFFFAOYSA-N 1 0 291.351 3.506 20 5 CHBDRO CC1(C)C[C@@H]1[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000611468902 1121650262 /nfs/dbraw/zinc/65/02/62/1121650262.db2.gz GROPBOVEGBPPGK-INWMFGNUSA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cs1 ZINC000292561516 1121693410 /nfs/dbraw/zinc/69/34/10/1121693410.db2.gz BRQUAEPDVPGZKA-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1sccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000293483851 1121715548 /nfs/dbraw/zinc/71/55/48/1121715548.db2.gz GARPFBTYUWWCEK-SNVBAGLBSA-N 1 0 276.361 3.816 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1C[C@@H]2CCC[C@@H]12 ZINC001179768177 1121906249 /nfs/dbraw/zinc/90/62/49/1121906249.db2.gz LPIZNFUFHRIFBC-TWGJTLPSSA-N 1 0 286.375 3.776 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CCCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000183350472 1122020787 /nfs/dbraw/zinc/02/07/87/1122020787.db2.gz IIOKOIVHDVMLFK-GOEBONIOSA-N 1 0 292.379 3.595 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC2(CCC2)CC1 ZINC001181610408 1122066856 /nfs/dbraw/zinc/06/68/56/1122066856.db2.gz GSCDAGDEOJFODX-UHFFFAOYSA-N 1 0 288.391 3.978 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000502727755 1122144329 /nfs/dbraw/zinc/14/43/29/1122144329.db2.gz JYSANHBJQKGRGH-JTQLQIEISA-N 1 0 270.760 3.869 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H](c2ccccc2)C2CC2)c1 ZINC000035053162 1122159994 /nfs/dbraw/zinc/15/99/94/1122159994.db2.gz BHMNDUVYPFITKX-QGZVFWFLSA-N 1 0 282.343 3.836 20 5 CHBDRO CCC[C@@H](C)CC[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC001183572157 1122229616 /nfs/dbraw/zinc/22/96/16/1122229616.db2.gz LKPUHMQZYAPZQR-LLVKDONJSA-N 1 0 268.332 3.650 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC001184044781 1122252571 /nfs/dbraw/zinc/25/25/71/1122252571.db2.gz DJXWQOXYOQKOPP-STQMWFEESA-N 1 0 276.380 3.867 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCCC1 ZINC000504918718 1122310088 /nfs/dbraw/zinc/31/00/88/1122310088.db2.gz HVMODICNQIWKBQ-LBPRGKRZSA-N 1 0 294.420 3.998 20 5 CHBDRO C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000716534513 1122424072 /nfs/dbraw/zinc/42/40/72/1122424072.db2.gz WYWCWBHIRDWRIK-QIRAZROLSA-N 1 0 294.782 3.630 20 5 CHBDRO CCC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])CC(C)C ZINC000505784094 1122530959 /nfs/dbraw/zinc/53/09/59/1122530959.db2.gz OPVZEZYOZXMRPG-UHFFFAOYSA-N 1 0 268.332 3.602 20 5 CHBDRO C[C@@H](c1cccs1)N(C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505864136 1122573694 /nfs/dbraw/zinc/57/36/94/1122573694.db2.gz JXZUQRCCKCDCSO-JTQLQIEISA-N 1 0 294.351 3.988 20 5 CHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000516301046 1122585160 /nfs/dbraw/zinc/58/51/60/1122585160.db2.gz ICQPNXHDHZZPOT-PIZKADEWSA-N 1 0 282.343 3.959 20 5 CHBDRO C[C@@H]1CCCC[C@H]1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001191521339 1122604459 /nfs/dbraw/zinc/60/44/59/1122604459.db2.gz PTNYHDIHEHTMDF-HIFRSBDPSA-N 1 0 288.391 3.779 20 5 CHBDRO Cc1c(C[N@H+]2C[C@H](C)CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC001192500878 1122648304 /nfs/dbraw/zinc/64/83/04/1122648304.db2.gz JUXNMROKDWDXIT-GFCCVEGCSA-N 1 0 276.380 3.771 20 5 CHBDRO CCC[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000506405114 1122734024 /nfs/dbraw/zinc/73/40/24/1122734024.db2.gz RYBPDOAWRFHTTR-UHFFFAOYSA-N 1 0 274.320 3.697 20 5 CHBDRO CC[C@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000518581228 1122768219 /nfs/dbraw/zinc/76/82/19/1122768219.db2.gz BDGWZHZWFQKUQV-STQMWFEESA-N 1 0 262.353 3.778 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CC1(C)C ZINC001195269474 1122858893 /nfs/dbraw/zinc/85/88/93/1122858893.db2.gz MGCUIUSSHILYCZ-STQMWFEESA-N 1 0 280.343 3.648 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507106309 1122925714 /nfs/dbraw/zinc/92/57/14/1122925714.db2.gz XHBVNTUXOYNHFW-QGZVFWFLSA-N 1 0 296.370 3.893 20 5 CHBDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000507184391 1122934770 /nfs/dbraw/zinc/93/47/70/1122934770.db2.gz UYRTWTJYGVKNKJ-HNNXBMFYSA-N 1 0 296.370 3.893 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cn1 ZINC001199354531 1123028224 /nfs/dbraw/zinc/02/82/24/1123028224.db2.gz UTLMUWWPRHXCJN-UHFFFAOYSA-N 1 0 299.374 3.711 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCC(C)(F)F)cc1[N+](=O)[O-] ZINC000294083438 1123058147 /nfs/dbraw/zinc/05/81/47/1123058147.db2.gz AJXWRCCHEZHBKT-JTQLQIEISA-N 1 0 272.295 3.599 20 5 CHBDRO Cc1cccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000052926191 1123061338 /nfs/dbraw/zinc/06/13/38/1123061338.db2.gz XONXCJSSDUWYRK-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000049119605 1123110315 /nfs/dbraw/zinc/11/03/15/1123110315.db2.gz COWRLAULRHFUEZ-SMDDNHRTSA-N 1 0 280.343 3.792 20 5 CHBDRO C[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000134110966 1123156517 /nfs/dbraw/zinc/15/65/17/1123156517.db2.gz DHRFDHZLAJZAJW-BXUZGUMPSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449246522 1123164736 /nfs/dbraw/zinc/16/47/36/1123164736.db2.gz BVPYSFWMCPPHGK-OLZOCXBDSA-N 1 0 276.380 3.694 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC001202356884 1123202079 /nfs/dbraw/zinc/20/20/79/1123202079.db2.gz MIGPQQXIIUQUMB-HNNXBMFYSA-N 1 0 276.380 3.996 20 5 CHBDRO Cc1csc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449482663 1123357755 /nfs/dbraw/zinc/35/77/55/1123357755.db2.gz ZGVBOLUSRFCIDF-GFCCVEGCSA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C2(Cl)CC2)cc1[N+](=O)[O-] ZINC000925490916 1123572768 /nfs/dbraw/zinc/57/27/68/1123572768.db2.gz CVDRFDXLZCNDDA-WDEREUQCSA-N 1 0 282.771 3.714 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CCCC1)CCC2 ZINC000192591741 1123706691 /nfs/dbraw/zinc/70/66/91/1123706691.db2.gz AQHCQHPKKHVSLK-OAHLLOKOSA-N 1 0 260.337 3.504 20 5 CHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522714117 1123719854 /nfs/dbraw/zinc/71/98/54/1123719854.db2.gz CEPVBELLHXDZJX-OAHLLOKOSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1ccsc1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000084439966 1129153474 /nfs/dbraw/zinc/15/34/74/1129153474.db2.gz NSCHMYDIGONUBG-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO CC(C)[N@@H+](Cc1ccccc1[N+](=O)[O-])CC1CCC1 ZINC000444770020 1124061598 /nfs/dbraw/zinc/06/15/98/1124061598.db2.gz JXKNUPKFSODVFB-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC12CCC2 ZINC000444778665 1124063705 /nfs/dbraw/zinc/06/37/05/1124063705.db2.gz XAZJQYNWNLUTIE-UHFFFAOYSA-N 1 0 280.755 3.767 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CCCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000088512086 1124064302 /nfs/dbraw/zinc/06/43/02/1124064302.db2.gz QXGXMPHOCSVBGH-OCCSQVGLSA-N 1 0 292.379 3.662 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1ccc([N+](=O)[O-])cc1 ZINC000866449481 1124066533 /nfs/dbraw/zinc/06/65/33/1124066533.db2.gz WHQMYRIULBXXPF-DDTOSNHZSA-N 1 0 266.316 3.526 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CCCCC2(C)C)cc1[N+](=O)[O-] ZINC000094325324 1124079859 /nfs/dbraw/zinc/07/98/59/1124079859.db2.gz GFYJRSLTWFUOFY-HNNXBMFYSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1cc(C)c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000037668260 1129165392 /nfs/dbraw/zinc/16/53/92/1129165392.db2.gz JZMCWORCFAHVEL-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000269012207 1124097208 /nfs/dbraw/zinc/09/72/08/1124097208.db2.gz NJQHRZYTLSUUSW-QGZVFWFLSA-N 1 0 299.374 3.663 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000034996038 1124110401 /nfs/dbraw/zinc/11/04/01/1124110401.db2.gz OLEDGAQQBHHCDO-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO CCC(C)(C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000525998950 1124489098 /nfs/dbraw/zinc/48/90/98/1124489098.db2.gz KROQILZUMUIGDM-UHFFFAOYSA-N 1 0 250.342 3.524 20 5 CHBDRO Cc1ccsc1C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449106213 1124648028 /nfs/dbraw/zinc/64/80/28/1124648028.db2.gz LBQZEWGFWJVLQJ-LBPRGKRZSA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1cccc(CC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449113428 1124653827 /nfs/dbraw/zinc/65/38/27/1124653827.db2.gz VXYVQAIDOULNTK-OAHLLOKOSA-N 1 0 298.386 3.667 20 5 CHBDRO C[C@H](Cc1ccco1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872020398 1124657851 /nfs/dbraw/zinc/65/78/51/1124657851.db2.gz HANNUTNKGBXZPU-MNOVXSKESA-N 1 0 292.310 3.609 20 5 CHBDRO CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCO1 ZINC000449169743 1124658851 /nfs/dbraw/zinc/65/88/51/1124658851.db2.gz HLSMAMHTLUSYMX-VHDGCEQUSA-N 1 0 292.379 3.511 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])C1 ZINC000872038778 1124663476 /nfs/dbraw/zinc/66/34/76/1124663476.db2.gz OFGPIANKBMBGLB-HBNTYKKESA-N 1 0 298.383 3.669 20 5 CHBDRO C[C@@H]([NH2+]CCCC(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872041869 1124664276 /nfs/dbraw/zinc/66/42/76/1124664276.db2.gz WXMKSXLDZVWSFY-MRVPVSSYSA-N 1 0 294.248 3.727 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1c(F)cccc1[N+](=O)[O-] ZINC000872080423 1124677521 /nfs/dbraw/zinc/67/75/21/1124677521.db2.gz XGKIERMHCFTWLF-DCQANWLSSA-N 1 0 278.327 3.573 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449246521 1124680001 /nfs/dbraw/zinc/68/00/01/1124680001.db2.gz BVPYSFWMCPPHGK-CHWSQXEVSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC12CC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872091233 1124681247 /nfs/dbraw/zinc/68/12/47/1124681247.db2.gz HGMUTYOGWXZOOB-GXFFZTMASA-N 1 0 278.327 3.717 20 5 CHBDRO COCC(C)(C)CC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000872105356 1124683777 /nfs/dbraw/zinc/68/37/77/1124683777.db2.gz HMEUFRVAIURTAM-CYBMUJFWSA-N 1 0 294.395 3.617 20 5 CHBDRO CSC1CC[NH+](Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000877663179 1125060317 /nfs/dbraw/zinc/06/03/17/1125060317.db2.gz JLZGMOCIDXDRJC-UHFFFAOYSA-N 1 0 294.420 3.539 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CC1CC1)C1CCC1 ZINC000475670324 1125167381 /nfs/dbraw/zinc/16/73/81/1125167381.db2.gz GLYGZVRXQMRYIX-UHFFFAOYSA-N 1 0 274.364 3.668 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000532072960 1125232150 /nfs/dbraw/zinc/23/21/50/1125232150.db2.gz AXHCTTGTWNISSM-LLVKDONJSA-N 1 0 268.382 3.668 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccccc1 ZINC000532188780 1125238236 /nfs/dbraw/zinc/23/82/36/1125238236.db2.gz XZXFYFPKSCXQEH-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CC12CCCC2 ZINC000428535142 1125289845 /nfs/dbraw/zinc/28/98/45/1125289845.db2.gz KVWSXTMYIUGYJM-WQMJKPAKSA-N 1 0 286.375 3.920 20 5 CHBDRO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000883461912 1125411292 /nfs/dbraw/zinc/41/12/92/1125411292.db2.gz GFQWMGUEWHLBCD-INIZCTEOSA-N 1 0 297.358 3.630 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000132492994 1125419036 /nfs/dbraw/zinc/41/90/36/1125419036.db2.gz OFDPOFTXEVKADN-XHDPSFHLSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H](CSC(C)(C)C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000766193677 1129281839 /nfs/dbraw/zinc/28/18/39/1129281839.db2.gz OKEVFOVWWIMDEE-GFCCVEGCSA-N 1 0 296.436 3.647 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000090909924 1129336065 /nfs/dbraw/zinc/33/60/65/1129336065.db2.gz XJJLVGJWTNSAST-MRXNPFEDSA-N 1 0 299.374 3.663 20 5 CHBDRO CC(C)[C@@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303648514 1129550662 /nfs/dbraw/zinc/55/06/62/1129550662.db2.gz DDMZQFAAAGQWOE-INIZCTEOSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCNc2ccccc2)cc1[N+](=O)[O-] ZINC000766516956 1129678625 /nfs/dbraw/zinc/67/86/25/1129678625.db2.gz ZJEKJISWFULGSR-CQSZACIVSA-N 1 0 299.374 3.666 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc2ccccc2c1 ZINC001168978242 1129686120 /nfs/dbraw/zinc/68/61/20/1129686120.db2.gz QENDDRUNGZJTCV-HBUWYVDXSA-N 1 0 298.386 3.936 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168984956 1129687207 /nfs/dbraw/zinc/68/72/07/1129687207.db2.gz BODDXPOGGWBKOQ-NILFDRSVSA-N 1 0 296.798 3.826 20 5 CHBDRO CC(C)(C)C1CCC([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168968395 1129687788 /nfs/dbraw/zinc/68/77/88/1129687788.db2.gz YRYILSXOBWFOSK-VXGQWTEUSA-N 1 0 282.428 3.626 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(Cl)c1 ZINC001168986102 1129687987 /nfs/dbraw/zinc/68/79/87/1129687987.db2.gz VWHAZHXHGDTPCC-BYCMXARLSA-N 1 0 296.798 3.826 20 5 CHBDRO CC(C)c1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001168993305 1129688323 /nfs/dbraw/zinc/68/83/23/1129688323.db2.gz MIZBOHCLZBICQW-CPUCHLNUSA-N 1 0 290.407 3.906 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](CC2CC2)c2ccccc2)C1 ZINC001169000943 1129688325 /nfs/dbraw/zinc/68/83/25/1129688325.db2.gz ZSCRJIXFAGWCFW-PVAVHDDUSA-N 1 0 288.391 3.563 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C)cc1C ZINC001168991543 1129688418 /nfs/dbraw/zinc/68/84/18/1129688418.db2.gz HHNOTUXQVYWQSN-HLLBOEOZSA-N 1 0 290.407 3.790 20 5 CHBDRO Cc1cc(Cl)ccc1[C@@H](C)[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168990061 1129689893 /nfs/dbraw/zinc/68/98/93/1129689893.db2.gz BEPGUUHCUYPRCV-BZPMIXESSA-N 1 0 296.798 3.744 20 5 CHBDRO CC[N@H+](Cc1cccc(Cl)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169042788 1129690840 /nfs/dbraw/zinc/69/08/40/1129690840.db2.gz FSCBNWDRFPANNW-ZFWWWQNUSA-N 1 0 296.798 3.607 20 5 CHBDRO CC[N@H+](Cc1ccc(Cl)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169039779 1129690854 /nfs/dbraw/zinc/69/08/54/1129690854.db2.gz TWABAGUDJOHTAM-ZFWWWQNUSA-N 1 0 296.798 3.607 20 5 CHBDRO CC(C)CC[NH+](CCC(C)C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046370 1129691217 /nfs/dbraw/zinc/69/12/17/1129691217.db2.gz LIJZMGRHQCIADG-CVEARBPZSA-N 1 0 284.444 3.826 20 5 CHBDRO CCCC1CCC([N@H+](C)Cc2cccnc2[N+](=O)[O-])CC1 ZINC001169953857 1129768363 /nfs/dbraw/zinc/76/83/63/1129768363.db2.gz WTNNNHGQGXZPMJ-UHFFFAOYSA-N 1 0 291.395 3.781 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC23CCC3)ccc1Cl ZINC000769983191 1129934444 /nfs/dbraw/zinc/93/44/44/1129934444.db2.gz GAWRURLNGIEFIW-UHFFFAOYSA-N 1 0 280.755 3.767 20 5 CHBDRO CC(C)[C@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746663602 1129978611 /nfs/dbraw/zinc/97/86/11/1129978611.db2.gz SHBOGSZUJBWDNZ-CYBMUJFWSA-N 1 0 282.771 3.869 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000903244730 1130134873 /nfs/dbraw/zinc/13/48/73/1130134873.db2.gz CGXNQMRFGWMRIE-CJNGLKHVSA-N 1 0 299.374 3.834 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])c1cncs1 ZINC000903244971 1130135964 /nfs/dbraw/zinc/13/59/64/1130135964.db2.gz HFTOESBHJFADTR-GHMZBOCLSA-N 1 0 291.376 3.506 20 5 CHBDRO CC[C@@H]1C[N@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)CCS1 ZINC001461964733 1130142399 /nfs/dbraw/zinc/14/23/99/1130142399.db2.gz XVHODIPHDGSABY-CYBMUJFWSA-N 1 0 294.420 3.539 20 5 CHBDRO CC[C@H]1C[N@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)CCS1 ZINC001461964759 1130143611 /nfs/dbraw/zinc/14/36/11/1130143611.db2.gz XVHODIPHDGSABY-ZDUSSCGKSA-N 1 0 294.420 3.539 20 5 CHBDRO CC1(C)CCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746665766 1130143620 /nfs/dbraw/zinc/14/36/20/1130143620.db2.gz FXKARJFONFNDAQ-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)c2cncs2)cccc1[N+](=O)[O-] ZINC000903309377 1130150660 /nfs/dbraw/zinc/15/06/60/1130150660.db2.gz FAAZOQYIKWQUNA-WDEREUQCSA-N 1 0 291.376 3.772 20 5 CHBDRO CC(C)CC[C@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788498159 1130191441 /nfs/dbraw/zinc/19/14/41/1130191441.db2.gz LKYSKPIMIWMVCR-NWDGAFQWSA-N 1 0 279.384 3.652 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc[nH]1 ZINC000788593576 1130196316 /nfs/dbraw/zinc/19/63/16/1130196316.db2.gz VAINCIXLCHWPHX-BZNIZROVSA-N 1 0 299.374 3.996 20 5 CHBDRO CCC(CC)[N@H+](C)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170351389 1130487086 /nfs/dbraw/zinc/48/70/86/1130487086.db2.gz FWFUXMSXWBAPGQ-GFCCVEGCSA-N 1 0 294.395 3.655 20 5 CHBDRO C(c1ccc2ccc3cccnc3c2n1)=C1CC[NH2+]CC1 ZINC001240873909 1130498835 /nfs/dbraw/zinc/49/88/35/1130498835.db2.gz LAGAZIBSZUSALO-UHFFFAOYSA-N 1 0 275.355 3.550 20 5 CHBDRO CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC1CCC1 ZINC000793351272 1130549975 /nfs/dbraw/zinc/54/99/75/1130549975.db2.gz FMWXWXCYXBZENH-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@H]1C[C@@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473710 1130614381 /nfs/dbraw/zinc/61/43/81/1130614381.db2.gz JERFMMXTLSTJAQ-JGVFFNPUSA-N 1 0 289.162 3.647 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2CN1CC[NH2+][C@@H]2C[C@@H]21 ZINC001235287474 1130731404 /nfs/dbraw/zinc/73/14/04/1130731404.db2.gz CSMVMOASDGRXND-UXHICEINSA-N 1 0 288.394 3.539 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCSCC1)c1ccc([N+](=O)[O-])cc1 ZINC000692465186 1130740402 /nfs/dbraw/zinc/74/04/02/1130740402.db2.gz MPGKOCHHJWVRHF-AAEUAGOBSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783710657 1130850634 /nfs/dbraw/zinc/85/06/34/1130850634.db2.gz SFLOSLNAQRBXTR-GXSJLCMTSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1C ZINC000816648930 1131120955 /nfs/dbraw/zinc/12/09/55/1131120955.db2.gz QWSOHKLWVIDRFC-NEPJUHHUSA-N 1 0 286.331 3.695 20 5 CHBDRO CC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC001116476247 1131148805 /nfs/dbraw/zinc/14/88/05/1131148805.db2.gz MAZXZMPRLSHXOQ-UHFFFAOYSA-N 1 0 288.372 3.965 20 5 CHBDRO [NH3+]CCCCCCCOc1cc([N+](=O)[O-])ccc1Cl ZINC000818619910 1131218751 /nfs/dbraw/zinc/21/87/51/1131218751.db2.gz NTECRNPMQRHNRP-UHFFFAOYSA-N 1 0 286.759 3.536 20 5 CHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ccoc3)C2)cc1 ZINC000824820796 1131485896 /nfs/dbraw/zinc/48/58/96/1131485896.db2.gz NEWWPBYDFNEAEA-HNNXBMFYSA-N 1 0 286.331 3.567 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)cc1[N+](=O)[O-] ZINC000846108803 1131686392 /nfs/dbraw/zinc/68/63/92/1131686392.db2.gz QUFXBFPRAKQOJD-AWEZNQCLSA-N 1 0 296.317 3.524 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CC3(CCC3)C2)cc1Cl ZINC000846114853 1131688598 /nfs/dbraw/zinc/68/85/98/1131688598.db2.gz XXMCECWUEGFJIC-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO CC(=O)c1ccc2cc(O[C@@H](C)C[N+](C)(C)C)ccc2c1 ZINC001227761215 1131738257 /nfs/dbraw/zinc/73/82/57/1131738257.db2.gz LBEHBTLFBDSJLC-ZDUSSCGKSA-N 1 0 286.395 3.516 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc2ccc3cccnc3c21 ZINC001227763549 1131738676 /nfs/dbraw/zinc/73/86/76/1131738676.db2.gz DWPKNMKJPLJQRA-AWEZNQCLSA-N 1 0 295.406 3.862 20 5 CHBDRO c1ccc2c(c1)nc(NC[C@@H]1CCCC[NH2+]1)c1ccccc21 ZINC001171341761 1131877970 /nfs/dbraw/zinc/87/79/70/1131877970.db2.gz YSHAMDDTWWEZPH-AWEZNQCLSA-N 1 0 291.398 3.942 20 5 CHBDRO C[C@H](CCc1ccco1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000037177120 1132006943 /nfs/dbraw/zinc/00/69/43/1132006943.db2.gz DDFUMHACGGFHNJ-CHWSQXEVSA-N 1 0 288.347 3.860 20 5 CHBDRO CC[N@@H+]1CC[C@@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001230203742 1132159921 /nfs/dbraw/zinc/15/99/21/1132159921.db2.gz WWYSSETVBQUVHY-OAHLLOKOSA-N 1 0 292.382 3.861 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000839197232 1132192128 /nfs/dbraw/zinc/19/21/28/1132192128.db2.gz VWUGORIFLCPZBX-ICCXJUOJSA-N 1 0 280.755 3.526 20 5 CHBDRO C[N@H+](Cc1c2ccccc2cc2ccccc21)C1COC1 ZINC001141728585 1132242008 /nfs/dbraw/zinc/24/20/08/1132242008.db2.gz YMQGCBAHIZPCCT-UHFFFAOYSA-N 1 0 277.367 3.824 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C1CCC1 ZINC001172906316 1132347372 /nfs/dbraw/zinc/34/73/72/1132347372.db2.gz NYURLPIYELSJKI-LRDDRELGSA-N 1 0 288.391 3.620 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900807 1132348264 /nfs/dbraw/zinc/34/82/64/1132348264.db2.gz FXJYSRUOBZFIJH-CJNGLKHVSA-N 1 0 290.407 3.866 20 5 CHBDRO CC(C)(C)CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898808 1132348521 /nfs/dbraw/zinc/34/85/21/1132348521.db2.gz PINDFMQEVGPCDH-OAHLLOKOSA-N 1 0 290.407 3.868 20 5 CHBDRO CCC[N@H+](CC)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907445 1132350440 /nfs/dbraw/zinc/35/04/40/1132350440.db2.gz DUKLOTRNUIQZNI-HNNXBMFYSA-N 1 0 276.380 3.574 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1[C@@H](C)CC[C@@H]1C ZINC001173218490 1132411082 /nfs/dbraw/zinc/41/10/82/1132411082.db2.gz BFUIXJHBNQXWRH-RWMBFGLXSA-N 1 0 276.380 3.550 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](C)CC1 ZINC001173221563 1132411479 /nfs/dbraw/zinc/41/14/79/1132411479.db2.gz KHHGTMAHLPDEOL-UONOGXRCSA-N 1 0 276.380 3.648 20 5 CHBDRO CC(C)CC[C@@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173217743 1132411505 /nfs/dbraw/zinc/41/15/05/1132411505.db2.gz LSRDZYIMXHQPQV-KGLIPLIRSA-N 1 0 278.396 3.940 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001173225684 1132412552 /nfs/dbraw/zinc/41/25/52/1132412552.db2.gz FISJPSFCCSNFIS-DGCLKSJQSA-N 1 0 298.333 3.503 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC[C@H]1C ZINC001173227372 1132412957 /nfs/dbraw/zinc/41/29/57/1132412957.db2.gz QGMDUPPVNQFLSF-ZIAGYGMSSA-N 1 0 276.380 3.790 20 5 CHBDRO Cc1cccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001173231990 1132414062 /nfs/dbraw/zinc/41/40/62/1132414062.db2.gz BXZDICBYTFDADM-UONOGXRCSA-N 1 0 299.374 3.580 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC001173234426 1132414205 /nfs/dbraw/zinc/41/42/05/1132414205.db2.gz OPGCNEBKICAMRM-XJKSGUPXSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)c1cccs1 ZINC001173211924 1132416328 /nfs/dbraw/zinc/41/63/28/1132416328.db2.gz VLASKHXTFCMBHM-VXGBXAGGSA-N 1 0 290.388 3.938 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCCC[C@H]1C ZINC001173211113 1132416380 /nfs/dbraw/zinc/41/63/80/1132416380.db2.gz PKPULPWHKKWTQA-FMKPAKJESA-N 1 0 290.407 3.942 20 5 CHBDRO Cc1ccc(C)c(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173214154 1132416492 /nfs/dbraw/zinc/41/64/92/1132416492.db2.gz MLALRDIWZIIIJG-HNNXBMFYSA-N 1 0 298.386 3.932 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(F)(F)CC1 ZINC001173209276 1132416524 /nfs/dbraw/zinc/41/65/24/1132416524.db2.gz AYIBXTUKESQNMQ-LLVKDONJSA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(C)CCCCC1 ZINC001173212239 1132416782 /nfs/dbraw/zinc/41/67/82/1132416782.db2.gz YBEDDLURVWNAFR-CYBMUJFWSA-N 1 0 276.380 3.838 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC1CCCC1 ZINC001173212652 1132416879 /nfs/dbraw/zinc/41/68/79/1132416879.db2.gz CBKQQUISVXAJBC-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO CCc1ccc(C)[nH+]c1NCCc1ccc([N+](=O)[O-])cc1 ZINC001206660317 1132686514 /nfs/dbraw/zinc/68/65/14/1132686514.db2.gz AEWIZWORRCEQIT-UHFFFAOYSA-N 1 0 285.347 3.515 20 5 CHBDRO C1=C(Nc2cccc3cc4ccccc4cc32)C[NH2+]C1 ZINC001159713110 1132897129 /nfs/dbraw/zinc/89/71/29/1132897129.db2.gz DAKNKWOJZONUON-UHFFFAOYSA-N 1 0 260.340 3.892 20 5 CHBDRO Cc1ccc(Nc2ccc([C@H]3CC[NH2+]C3)cc2)c([N+](=O)[O-])c1 ZINC001159777908 1132909342 /nfs/dbraw/zinc/90/93/42/1132909342.db2.gz NXSBTFNJZZQKGK-AWEZNQCLSA-N 1 0 297.358 3.724 20 5 CHBDRO CC[NH2+]Cc1cccc(Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC001159956952 1132930037 /nfs/dbraw/zinc/93/00/37/1132930037.db2.gz YMNACRFEYFHOED-UHFFFAOYSA-N 1 0 285.347 3.756 20 5 CHBDRO CC(C)[PH+](CCNc1cccc([N+](=O)[O-])n1)C(C)C ZINC001162358388 1133071640 /nfs/dbraw/zinc/07/16/40/1133071640.db2.gz OOQGYUGZZYBPHQ-UHFFFAOYSA-N 1 0 283.312 3.700 20 5 CHBDRO Cc1cccc(-n2ccc3cc([C@H](C)[NH3+])ccc32)c1[N+](=O)[O-] ZINC001162910862 1133122216 /nfs/dbraw/zinc/12/22/16/1133122216.db2.gz XGRQQUFWTHLGAG-LBPRGKRZSA-N 1 0 295.342 3.867 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC001204602155 1133466463 /nfs/dbraw/zinc/46/64/63/1133466463.db2.gz SAGWJKRNRGSHQS-QGZVFWFLSA-N 1 0 288.391 3.976 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC001204929788 1133502262 /nfs/dbraw/zinc/50/22/62/1133502262.db2.gz CUTAACUAORGMKN-KRWDZBQOSA-N 1 0 299.374 3.877 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)C[C@H]1CC1(C)C ZINC001206808233 1133751302 /nfs/dbraw/zinc/75/13/02/1133751302.db2.gz DUQPBWXCOUXVBQ-CYBMUJFWSA-N 1 0 276.380 3.690 20 5 CHBDRO Cc1ccc(C[NH2+]C2CC3(C2)CCCC3)cc1[N+](=O)[O-] ZINC001207151540 1133771566 /nfs/dbraw/zinc/77/15/66/1133771566.db2.gz RQHUSBHJFVQDQS-UHFFFAOYSA-N 1 0 274.364 3.716 20 5 CHBDRO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccc([N+](=O)[O-])cc1 ZINC000403635476 1134821808 /nfs/dbraw/zinc/82/18/08/1134821808.db2.gz NABWLGBFKKXHRE-WAEYWBMLSA-N 1 0 292.404 3.672 20 5 CHBDRO Nc1ccc2cc3ccc(NC4=CCCOC4)cc3[nH+]c2c1 ZINC001216509399 1134912471 /nfs/dbraw/zinc/91/24/71/1134912471.db2.gz HYLHKECBAGKZLF-UHFFFAOYSA-N 1 0 291.354 3.686 20 5 CHBDRO c1ccc2c(c1)nc1ccccc1c2CO[C@@H]1CCC[NH2+]C1 ZINC001217768068 1134996778 /nfs/dbraw/zinc/99/67/78/1134996778.db2.gz SUTKJFJVILMFGK-CQSZACIVSA-N 1 0 292.382 3.657 20 5 CHBDRO C[C@@H]1C[C@@H](Oc2cccc3cc4ccccc4nc32)CC[NH2+]1 ZINC001218058412 1135052396 /nfs/dbraw/zinc/05/23/96/1135052396.db2.gz WYLFGFUZJQQHQO-CJNGLKHVSA-N 1 0 292.382 3.907 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@@H]3C[C@H]4C[NH2+][C@@H]3C4)c12 ZINC001218490031 1135116596 /nfs/dbraw/zinc/11/65/96/1135116596.db2.gz RVMZEUXKQWURBD-XGWLTEMNSA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCCCCCCc1ccccc1 ZINC001224560647 1135459717 /nfs/dbraw/zinc/45/97/17/1135459717.db2.gz NDDNAPGRIIMAQI-QGZVFWFLSA-N 1 0 278.460 3.901 20 5 CHBDRO C[C@@H](OCC[N+](C)(C)C)c1c(Cl)cccc1Cl ZINC001224772580 1135480164 /nfs/dbraw/zinc/48/01/64/1135480164.db2.gz AODZLKJWSMVYTB-SNVBAGLBSA-N 1 0 277.215 3.777 20 5 CHBDRO C[C@@H](OCC[N+](C)(C)C)c1c(Cl)ccc(F)c1Cl ZINC001224772217 1135480524 /nfs/dbraw/zinc/48/05/24/1135480524.db2.gz XEFPDZPQVPFEPZ-SECBINFHSA-N 1 0 295.205 3.916 20 5 CHBDRO C[C@@H](OCCC[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC001224860965 1135488873 /nfs/dbraw/zinc/48/88/73/1135488873.db2.gz SBFHODDNDHBLRA-CQSZACIVSA-N 1 0 292.379 3.548 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(C(F)(F)F)cc1Cl ZINC001225919276 1135639027 /nfs/dbraw/zinc/63/90/27/1135639027.db2.gz ACUDIWXCNDRTDT-VIFPVBQESA-N 1 0 296.740 3.832 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(-c2ccccc2)cc1 ZINC001227409680 1135829754 /nfs/dbraw/zinc/82/97/54/1135829754.db2.gz MRGPWOMGZPDINO-HNNXBMFYSA-N 1 0 270.396 3.827 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccncc1 ZINC000347372593 529631471 /nfs/dbraw/zinc/63/14/71/529631471.db2.gz XLENBVNDLNUDBO-HNNXBMFYSA-N 1 0 285.347 3.539 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000020121802 171000923 /nfs/dbraw/zinc/00/09/23/171000923.db2.gz VABTXFSOKRWXAG-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@H]([NH2+]C1CCC(C)CC1)c1ccccc1[N+](=O)[O-] ZINC000020526020 171239005 /nfs/dbraw/zinc/23/90/05/171239005.db2.gz NIDAICIYQKWJOP-CPCZMJQVSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)[NH+]1CCC(Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000034980705 171913203 /nfs/dbraw/zinc/91/32/03/171913203.db2.gz HOFOWGGQGBMLMC-UHFFFAOYSA-N 1 0 297.786 3.533 20 5 CHBDRO CCC(CC)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035368061 172159876 /nfs/dbraw/zinc/15/98/76/172159876.db2.gz NZDSQAOTKXONRE-UHFFFAOYSA-N 1 0 256.733 3.526 20 5 CHBDRO Cc1c(C[NH2+]C2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000035648710 172325216 /nfs/dbraw/zinc/32/52/16/172325216.db2.gz YDRYCLHYOONHEI-UHFFFAOYSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@H]([NH2+]CCC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000037739567 173660083 /nfs/dbraw/zinc/66/00/83/173660083.db2.gz FFTUNRZKVLIUIY-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@H]([NH2+]CCC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000037739635 173660129 /nfs/dbraw/zinc/66/01/29/173660129.db2.gz OQFVTHKKRZRVBC-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO CS[C@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)C(C)(C)C ZINC000344350410 225040329 /nfs/dbraw/zinc/04/03/29/225040329.db2.gz IVRFUYSYQQQLPZ-SNVBAGLBSA-N 1 0 288.438 3.524 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CC2CC2)cc1[N+](=O)[O-] ZINC000070101180 260152224 /nfs/dbraw/zinc/15/22/24/260152224.db2.gz UKNMPRLXFFRCMP-NWDGAFQWSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccs1 ZINC000037562640 260161762 /nfs/dbraw/zinc/16/17/62/260161762.db2.gz JQMIDYONXHVECM-QMMMGPOBSA-N 1 0 268.363 3.569 20 5 CHBDRO C[C@H]1CCC[C@@H](C[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000089609123 260189972 /nfs/dbraw/zinc/18/99/72/260189972.db2.gz LNLBKOAWOWCMEC-DZGCQCFKSA-N 1 0 276.380 3.553 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000088747220 260234321 /nfs/dbraw/zinc/23/43/21/260234321.db2.gz UIDJKGNVZNTBMM-ZFWWWQNUSA-N 1 0 260.337 3.744 20 5 CHBDRO CC(C)(C)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000313532666 260300766 /nfs/dbraw/zinc/30/07/66/260300766.db2.gz PUEJBUXCJHGCJS-LBPRGKRZSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000222786312 260317757 /nfs/dbraw/zinc/31/77/57/260317757.db2.gz KWPODCPXBZMVME-IUCAKERBSA-N 1 0 276.258 3.586 20 5 CHBDRO CC[N@@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])cc1Cl ZINC000518400973 260399670 /nfs/dbraw/zinc/39/96/70/260399670.db2.gz VHHLMCWOQIJNPB-LBPRGKRZSA-N 1 0 297.786 3.535 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000449058653 261139077 /nfs/dbraw/zinc/13/90/77/261139077.db2.gz LAEPCUOFTIRLRV-YPMHNXCESA-N 1 0 288.347 3.778 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)c2cccnc2)cccc1[N+](=O)[O-] ZINC000158518689 261166200 /nfs/dbraw/zinc/16/62/00/261166200.db2.gz YPXAFGPBMXKADJ-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1cc(N2CCCCCC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302170841 261349979 /nfs/dbraw/zinc/34/99/79/261349979.db2.gz LYLJGGNRFRYCRN-UHFFFAOYSA-N 1 0 285.347 3.832 20 5 CHBDRO Cc1c(C[N@@H+]2CCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000497416220 262158250 /nfs/dbraw/zinc/15/82/50/262158250.db2.gz IUGIZKFQYAEPQA-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000525786446 262236187 /nfs/dbraw/zinc/23/61/87/262236187.db2.gz JPEMDEYOVTYTBF-OAHLLOKOSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@H]([NH2+]CCCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000020526147 262246161 /nfs/dbraw/zinc/24/61/61/262246161.db2.gz OGLIVQKIICLUDA-AWEZNQCLSA-N 1 0 284.359 3.878 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000216306572 262275645 /nfs/dbraw/zinc/27/56/45/262275645.db2.gz MFPWQQYHXPRTDF-NJZAAPMLSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CS[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000488541602 262333905 /nfs/dbraw/zinc/33/39/05/262333905.db2.gz IHQTULRRNPVSSC-ZFWWWQNUSA-N 1 0 294.420 3.523 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccnc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000391159866 262384418 /nfs/dbraw/zinc/38/44/18/262384418.db2.gz BDSDMBPZOVAJBK-MRXNPFEDSA-N 1 0 285.347 3.539 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCc3sccc32)cs1 ZINC000061360216 262394526 /nfs/dbraw/zinc/39/45/26/262394526.db2.gz MQGLTAXGVQFRPO-NSHDSACASA-N 1 0 294.401 3.885 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccc([N+](=O)[O-])cc1 ZINC000414293993 262837646 /nfs/dbraw/zinc/83/76/46/262837646.db2.gz WHQMYRIULBXXPF-ZLKJLUDKSA-N 1 0 266.316 3.526 20 5 CHBDRO CCOC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000189348552 264291986 /nfs/dbraw/zinc/29/19/86/264291986.db2.gz FPAQHVOQYPIXCI-DZGCQCFKSA-N 1 0 294.395 3.615 20 5 CHBDRO CCSCC[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000132281077 264386262 /nfs/dbraw/zinc/38/62/62/264386262.db2.gz YCJAYJWAEOCNPS-RYUDHWBXSA-N 1 0 282.409 3.777 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000094278234 265232390 /nfs/dbraw/zinc/23/23/90/265232390.db2.gz KFCLJZPRVFVEDQ-CQSZACIVSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000094307445 265235380 /nfs/dbraw/zinc/23/53/80/265235380.db2.gz KYYWSCBIUZGXBQ-FZMZJTMJSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000519001675 265289463 /nfs/dbraw/zinc/28/94/63/265289463.db2.gz MOAGPHGKKHPOTJ-TZMCWYRMSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC12CCC2 ZINC000357023184 266233841 /nfs/dbraw/zinc/23/38/41/266233841.db2.gz LBCBCZSYUCGPCK-LBPRGKRZSA-N 1 0 292.354 3.746 20 5 CHBDRO Cc1cc(NCC2CCC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000228484286 327921033 /nfs/dbraw/zinc/92/10/33/327921033.db2.gz VIQGPBFRDPVDDZ-UHFFFAOYSA-N 1 0 271.320 3.663 20 5 CHBDRO C[C@@H]1CCC[C@](CNc2ccccc2[N+](=O)[O-])([NH+](C)C)C1 ZINC000040669968 328015261 /nfs/dbraw/zinc/01/52/61/328015261.db2.gz YYMITHVCKPSMSE-CJNGLKHVSA-N 1 0 291.395 3.517 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000040675865 328015598 /nfs/dbraw/zinc/01/55/98/328015598.db2.gz ACBYBWTZGRROQS-CHWSQXEVSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]([N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000534349905 328047795 /nfs/dbraw/zinc/04/77/95/328047795.db2.gz AWADKSQPNUSLEK-FROQITRMSA-N 1 0 276.380 3.974 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000049119634 328339917 /nfs/dbraw/zinc/33/99/17/328339917.db2.gz MIODRWHIKCJBCE-HOCLYGCPSA-N 1 0 276.380 3.696 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000556572378 326952399 /nfs/dbraw/zinc/95/23/99/326952399.db2.gz CXRSGWSOZSBQOL-CYBMUJFWSA-N 1 0 282.771 3.569 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCCC[C@H]1C ZINC000255955119 327037256 /nfs/dbraw/zinc/03/72/56/327037256.db2.gz SZAPHYCDVLUGDT-DOMZBBRYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000558259597 327083109 /nfs/dbraw/zinc/08/31/09/327083109.db2.gz UJZAHGLDUHYAFM-HUUCEWRRSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCC1(C)C ZINC000558256935 327083545 /nfs/dbraw/zinc/08/35/45/327083545.db2.gz LFGULXCJMCNPIN-RISCZKNCSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@H]3C[C@H]32)cc1[N+](=O)[O-] ZINC000558699784 327115668 /nfs/dbraw/zinc/11/56/68/327115668.db2.gz QZAOTOJYNAISNL-BEAPCOKYSA-N 1 0 274.364 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000560882066 327349139 /nfs/dbraw/zinc/34/91/39/327349139.db2.gz AQJWLIFQAOGMCS-KCPJHIHWSA-N 1 0 286.331 3.703 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCC2(F)CCC2)cc1[N+](=O)[O-] ZINC000562061661 327444199 /nfs/dbraw/zinc/44/41/99/327444199.db2.gz DEICOBQZCHVEBM-GFCCVEGCSA-N 1 0 280.343 3.836 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC12CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000395646367 328751919 /nfs/dbraw/zinc/75/19/19/328751919.db2.gz NQPIPAOAVGXKIU-RISCZKNCSA-N 1 0 260.337 3.578 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C1CCCCC1)C1CC1 ZINC000532441680 328778066 /nfs/dbraw/zinc/77/80/66/328778066.db2.gz RFLUFRLGTCKBGH-INIZCTEOSA-N 1 0 288.391 3.838 20 5 CHBDRO C[NH+](C)C1CCC(Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000420623748 329779780 /nfs/dbraw/zinc/77/97/80/329779780.db2.gz IGXQWSCUTQBNPD-UHFFFAOYSA-N 1 0 297.786 3.533 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)[C@H]1CCCO1 ZINC000246376226 329843206 /nfs/dbraw/zinc/84/32/06/329843206.db2.gz JSHPTOIXFZQDJX-ARFHVFGLSA-N 1 0 292.379 3.593 20 5 CHBDRO CCCC[NH+](CCCC)Cc1ccc([N+](=O)[O-])cc1 ZINC000302810078 332885228 /nfs/dbraw/zinc/88/52/28/332885228.db2.gz KQJBOAXRUKNBBY-UHFFFAOYSA-N 1 0 264.369 3.997 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cc(C)nc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000421867059 330099382 /nfs/dbraw/zinc/09/93/82/330099382.db2.gz BRERILLCNQOVKX-QGZVFWFLSA-N 1 0 299.374 3.848 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000421870640 330100101 /nfs/dbraw/zinc/10/01/01/330100101.db2.gz FTFLOKVPTQWBOL-IUODEOHRSA-N 1 0 276.380 3.552 20 5 CHBDRO CSC1(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CCC1 ZINC000572462419 330111257 /nfs/dbraw/zinc/11/12/57/330111257.db2.gz HQGGRZBBKXRQBH-GFCCVEGCSA-N 1 0 294.420 3.840 20 5 CHBDRO CCCC[C@@H](C[NH3+])N[C@@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000423301653 330188931 /nfs/dbraw/zinc/18/89/31/330188931.db2.gz UHMWYMNNSWYPOB-HOCLYGCPSA-N 1 0 293.411 3.543 20 5 CHBDRO CC[C@H]([NH2+]Cc1cc(C)cc(N)c1)c1cccc([N+](=O)[O-])c1 ZINC000423482697 330206671 /nfs/dbraw/zinc/20/66/71/330206671.db2.gz RWSRYHKXOXQFGT-KRWDZBQOSA-N 1 0 299.374 3.726 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)CC(C)C)cccc1[N+](=O)[O-] ZINC000536838629 330231861 /nfs/dbraw/zinc/23/18/61/330231861.db2.gz LYYVCLLLRLJPFC-WCQYABFASA-N 1 0 264.369 3.988 20 5 CHBDRO C[C@@H]1C[C@H](C)[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000527238488 330240646 /nfs/dbraw/zinc/24/06/46/330240646.db2.gz FPHXHJSRIYSFKY-TXEJJXNPSA-N 1 0 286.331 3.838 20 5 CHBDRO Cc1c(C[NH2+]C2CCCCCC2)cccc1[N+](=O)[O-] ZINC000035648881 330248485 /nfs/dbraw/zinc/24/84/85/330248485.db2.gz KPSMTJPEBBTUPF-UHFFFAOYSA-N 1 0 262.353 3.716 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000079601926 330249090 /nfs/dbraw/zinc/24/90/90/330249090.db2.gz PIMGUSJGOZPDRN-SNVBAGLBSA-N 1 0 268.382 3.665 20 5 CHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1(C)CC1 ZINC000536878920 330313444 /nfs/dbraw/zinc/31/34/44/330313444.db2.gz YJXUZIJSDZOGML-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO CC(C)=CCC[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000536878176 330314098 /nfs/dbraw/zinc/31/40/98/330314098.db2.gz UJNDRKNBRQCXDS-ZDUSSCGKSA-N 1 0 262.353 3.819 20 5 CHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000105461420 330326419 /nfs/dbraw/zinc/32/64/19/330326419.db2.gz JKHKYSNXOKWZOU-LJLILKBBSA-N 1 0 298.342 3.664 20 5 CHBDRO Cc1ccccc1CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000105895029 330330621 /nfs/dbraw/zinc/33/06/21/330330621.db2.gz NLNVYQDHMSEJEB-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2CC23CC3)c2ccccc2)c1 ZINC000424325730 330341367 /nfs/dbraw/zinc/34/13/67/330341367.db2.gz OIXIOHNIDAMCOF-SJORKVTESA-N 1 0 294.354 3.826 20 5 CHBDRO CC[C@@H](C)C[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000088293581 330375658 /nfs/dbraw/zinc/37/56/58/330375658.db2.gz OBYYGJNDDQYANA-ZJUUUORDSA-N 1 0 256.371 3.571 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000159927006 330854357 /nfs/dbraw/zinc/85/43/57/330854357.db2.gz ZXBUVPUVBVOARA-GXTWGEPZSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC12CCCC2 ZINC000449288188 330912119 /nfs/dbraw/zinc/91/21/19/330912119.db2.gz YBVCCXXWOHHFDV-CJNGLKHVSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC(C)(F)F ZINC000449353452 330917960 /nfs/dbraw/zinc/91/79/60/330917960.db2.gz BQRBFWXWMOIFBK-NSHDSACASA-N 1 0 286.322 3.551 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000162481342 330918060 /nfs/dbraw/zinc/91/80/60/330918060.db2.gz MXHCGDFPCLENPZ-NWDGAFQWSA-N 1 0 262.353 3.824 20 5 CHBDRO CCC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000449412784 330923607 /nfs/dbraw/zinc/92/36/07/330923607.db2.gz GPIYZMMMCVGHDG-UHFFFAOYSA-N 1 0 286.331 3.887 20 5 CHBDRO C[C@@H](F)CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553153 331033868 /nfs/dbraw/zinc/03/38/68/331033868.db2.gz XPYAJBMUILJVJM-TZMCWYRMSA-N 1 0 280.343 3.522 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cs1 ZINC000453118228 331090983 /nfs/dbraw/zinc/09/09/83/331090983.db2.gz KUOHHIXMIROHBU-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO Cc1cc(C)c(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000195582101 331178259 /nfs/dbraw/zinc/17/82/59/331178259.db2.gz YSXNKXSMWSYXOY-UHFFFAOYSA-N 1 0 298.386 3.852 20 5 CHBDRO C[C@H](CC(F)(F)F)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000463732572 331351214 /nfs/dbraw/zinc/35/12/14/331351214.db2.gz YUNXLEWODXFMHI-AYYIZTPMSA-N 1 0 288.269 3.539 20 5 CHBDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000464743417 331365753 /nfs/dbraw/zinc/36/57/53/331365753.db2.gz YJGBKONLDFYXLW-UKRRQHHQSA-N 1 0 276.380 3.995 20 5 CHBDRO CCSCC[C@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000464857374 331371492 /nfs/dbraw/zinc/37/14/92/331371492.db2.gz NHIIUTMSBMLPQP-LBPRGKRZSA-N 1 0 296.436 3.867 20 5 CHBDRO C[C@@H]1CCC[C@H]1C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000466421676 331396281 /nfs/dbraw/zinc/39/62/81/331396281.db2.gz NOVHKMMSOOFAOL-JHTAHENJSA-N 1 0 274.364 3.634 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC1(C)C ZINC000468634660 331437927 /nfs/dbraw/zinc/43/79/27/331437927.db2.gz GYESPZHANZEXPA-YRBHFNIASA-N 1 0 274.364 3.634 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C(C)C ZINC000468656646 331438429 /nfs/dbraw/zinc/43/84/29/331438429.db2.gz YNQUSVGTUARFFA-MAUPQMMJSA-N 1 0 276.380 3.880 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000469127979 331446177 /nfs/dbraw/zinc/44/61/77/331446177.db2.gz YVCSGALHNQZPNH-RYWCDNDXSA-N 1 0 274.364 3.776 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CC[C@@H]2C2CCC2)c(Cl)c1 ZINC000511044551 332925542 /nfs/dbraw/zinc/92/55/42/332925542.db2.gz BXZTXLYYYCPMKB-HIFRSBDPSA-N 1 0 294.782 3.917 20 5 CHBDRO CC(C)=CCC[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000480310299 331767741 /nfs/dbraw/zinc/76/77/41/331767741.db2.gz VPSKADQXURUUMS-GXDHUFHOSA-N 1 0 274.364 3.944 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000481185165 331800636 /nfs/dbraw/zinc/80/06/36/331800636.db2.gz DNJDAGIEHSWNPM-UHIISALHSA-N 1 0 280.343 3.648 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000481231806 331801483 /nfs/dbraw/zinc/80/14/83/331801483.db2.gz IILSKUSAPIABIR-KGLIPLIRSA-N 1 0 274.364 3.910 20 5 CHBDRO CCCC[C@@H](COC)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000483207313 331863110 /nfs/dbraw/zinc/86/31/10/331863110.db2.gz FCZLUZZVTGVSHD-GOEBONIOSA-N 1 0 294.395 3.841 20 5 CHBDRO CC[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000402479520 331908951 /nfs/dbraw/zinc/90/89/51/331908951.db2.gz IZKORSCDBWJHQN-SNVBAGLBSA-N 1 0 290.285 3.663 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCSC(C)(C)C1 ZINC000490099148 332081421 /nfs/dbraw/zinc/08/14/21/332081421.db2.gz GCPLOAWAMKNQBA-LBPRGKRZSA-N 1 0 294.420 3.792 20 5 CHBDRO C[C@@H]1C[C@@H]1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000490164317 332083309 /nfs/dbraw/zinc/08/33/09/332083309.db2.gz LKIZKZXANGLYGQ-MZMPZRCHSA-N 1 0 296.370 3.930 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490429312 332089294 /nfs/dbraw/zinc/08/92/94/332089294.db2.gz DYAJWASUDKCOHB-AWEZNQCLSA-N 1 0 280.343 3.744 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1occc1C ZINC000491432158 332210688 /nfs/dbraw/zinc/21/06/88/332210688.db2.gz MWLHMCWNMRJLFE-WQLSENKSSA-N 1 0 286.331 3.689 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000513057052 333002023 /nfs/dbraw/zinc/00/20/23/333002023.db2.gz MHDTZXGVNGMCEQ-RISCZKNCSA-N 1 0 286.331 3.743 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CC[C@H]2C)cc1[N+](=O)[O-] ZINC000513117800 333005274 /nfs/dbraw/zinc/00/52/74/333005274.db2.gz VIBWVHVJJGFEEQ-RISCZKNCSA-N 1 0 262.353 3.606 20 5 CHBDRO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000513682574 333032073 /nfs/dbraw/zinc/03/20/73/333032073.db2.gz APUVQHIPPBOCKB-CYBMUJFWSA-N 1 0 282.343 3.714 20 5 CHBDRO CC(C)C[C@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000311287876 333066771 /nfs/dbraw/zinc/06/67/71/333066771.db2.gz NMDNVDRZUOAKHO-STQMWFEESA-N 1 0 264.369 3.928 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000311667152 333071070 /nfs/dbraw/zinc/07/10/70/333071070.db2.gz HDYGUZQACIHCPR-UHFFFAOYSA-N 1 0 268.332 3.792 20 5 CHBDRO CC(C)C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000521195740 333114712 /nfs/dbraw/zinc/11/47/12/333114712.db2.gz RDPFRYDJBHZPKT-UHFFFAOYSA-N 1 0 276.380 3.995 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCC2CCCC2)cc1 ZINC000220720108 333168559 /nfs/dbraw/zinc/16/85/59/333168559.db2.gz MULVYHFXPLQIBJ-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC2(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000222220808 333177283 /nfs/dbraw/zinc/17/72/83/333177283.db2.gz ZQLHCSNXEBKXIF-ZDUSSCGKSA-N 1 0 276.380 3.990 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000225791775 333240701 /nfs/dbraw/zinc/24/07/01/333240701.db2.gz FJODKGBFXXGLOT-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000230661982 333320099 /nfs/dbraw/zinc/32/00/99/333320099.db2.gz DPRWHOJWFAZFDI-OBJOEFQTSA-N 1 0 262.353 3.682 20 5 CHBDRO CC[C@H]1CCC[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000231884375 333331264 /nfs/dbraw/zinc/33/12/64/333331264.db2.gz KCTGGQJFIOUQAA-GXTWGEPZSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000235576651 333370954 /nfs/dbraw/zinc/37/09/54/333370954.db2.gz AETRCJZLBPWIMM-SWLSCSKDSA-N 1 0 276.380 3.552 20 5 CHBDRO CC1=C[C@@H](C)C[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000235669833 333371615 /nfs/dbraw/zinc/37/16/15/333371615.db2.gz CWWGPMPREORCQL-DOMZBBRYSA-N 1 0 274.364 3.677 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CC1(C)C ZINC000397796473 333428766 /nfs/dbraw/zinc/42/87/66/333428766.db2.gz QWVBWVYPMULKLA-WDMOLILDSA-N 1 0 262.353 3.680 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1ccc(C)cc1[N+](=O)[O-] ZINC000037401061 333532997 /nfs/dbraw/zinc/53/29/97/333532997.db2.gz RILBWPBMNGEWEC-CQSZACIVSA-N 1 0 293.411 3.826 20 5 CHBDRO CC(C)[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000539084755 333656394 /nfs/dbraw/zinc/65/63/94/333656394.db2.gz UHUJSUONMXSDDH-QGZVFWFLSA-N 1 0 290.407 3.942 20 5 CHBDRO CCC1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000539123352 333659619 /nfs/dbraw/zinc/65/96/19/333659619.db2.gz HABMTSNSKHZXOL-HNNXBMFYSA-N 1 0 288.391 3.696 20 5 CHBDRO CCC[C@H]([NH2+][C@H](CC)C(C)(C)O)c1cccc([N+](=O)[O-])c1 ZINC000340503822 335157062 /nfs/dbraw/zinc/15/70/62/335157062.db2.gz NUYUBUKYAADSDI-LSDHHAIUSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000070306571 333806584 /nfs/dbraw/zinc/80/65/84/333806584.db2.gz SEPVEEJVHFFBKF-LBPRGKRZSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC2CCSCC2)cc1[N+](=O)[O-] ZINC000131163151 333906183 /nfs/dbraw/zinc/90/61/83/333906183.db2.gz PBPRXYHTIAHMLR-LBPRGKRZSA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@@H]([NH2+]CCCNc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000132103389 333972541 /nfs/dbraw/zinc/97/25/41/333972541.db2.gz RALBQPMYTPCUGS-CQSZACIVSA-N 1 0 299.374 3.748 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCc2ccsc2C1 ZINC000132850991 334007912 /nfs/dbraw/zinc/00/79/12/334007912.db2.gz GRHAGJJRZSYYEW-LLVKDONJSA-N 1 0 288.372 3.776 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000546888685 334054186 /nfs/dbraw/zinc/05/41/86/334054186.db2.gz UJOCRWVYJNKHKX-NXEZZACHSA-N 1 0 290.285 3.976 20 5 CHBDRO CCSCC[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000135471856 334131075 /nfs/dbraw/zinc/13/10/75/334131075.db2.gz YKOUMWREMDSQEG-NEPJUHHUSA-N 1 0 282.409 3.777 20 5 CHBDRO CC1(C)CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000079979036 334164932 /nfs/dbraw/zinc/16/49/32/334164932.db2.gz SNPNUMYJAQXKCL-CYBMUJFWSA-N 1 0 262.353 3.653 20 5 CHBDRO CC(C)([NH2+]Cc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000080347151 334170679 /nfs/dbraw/zinc/17/06/79/334170679.db2.gz WPQQZWYFYNRAPI-UHFFFAOYSA-N 1 0 276.361 3.681 20 5 CHBDRO CC(C)[C@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000081046888 334177289 /nfs/dbraw/zinc/17/72/89/334177289.db2.gz NQBYFYFHBLOKLB-NEPJUHHUSA-N 1 0 250.342 3.538 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000245596514 334205750 /nfs/dbraw/zinc/20/57/50/334205750.db2.gz NEMQKOXEYWOOIC-GVXVVHGQSA-N 1 0 292.379 3.510 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C2(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000550886361 334231845 /nfs/dbraw/zinc/23/18/45/334231845.db2.gz MRYFQGPVPOODLN-GFCCVEGCSA-N 1 0 292.379 3.833 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C2(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000550886362 334231987 /nfs/dbraw/zinc/23/19/87/334231987.db2.gz MRYFQGPVPOODLN-LBPRGKRZSA-N 1 0 292.379 3.833 20 5 CHBDRO C[C@@H](F)CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000551258125 334242998 /nfs/dbraw/zinc/24/29/98/334242998.db2.gz DJAHWFPINQOEBL-YGRLFVJLSA-N 1 0 280.343 3.655 20 5 CHBDRO C[N@@H+]1CCCC[C@H]1CCSCc1ccc([N+](=O)[O-])cc1 ZINC000551460863 334251028 /nfs/dbraw/zinc/25/10/28/334251028.db2.gz ALMCSGRFTNWNQF-AWEZNQCLSA-N 1 0 294.420 3.702 20 5 CHBDRO C[C@@H]1CC[C@H]1[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000552323676 334316997 /nfs/dbraw/zinc/31/69/97/334316997.db2.gz OQOPALRJXUZZDF-KMUNFCNLSA-N 1 0 274.364 3.705 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000090035985 334355900 /nfs/dbraw/zinc/35/59/00/334355900.db2.gz NTHWSFIFGIGNJI-JSGCOSHPSA-N 1 0 290.363 3.753 20 5 CHBDRO C[C@H]([N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])C1(C)CC1 ZINC000091900337 334385860 /nfs/dbraw/zinc/38/58/60/334385860.db2.gz DSNUFLJBKYPHLY-CFNZNRNTSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CC[C@H](C)CC2)cc1[N+](=O)[O-] ZINC000252959130 334403488 /nfs/dbraw/zinc/40/34/88/334403488.db2.gz LZFUVJODGLPAKS-YEORSEQZSA-N 1 0 262.353 3.572 20 5 CHBDRO CC[C@@H]1CC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000554108433 334412650 /nfs/dbraw/zinc/41/26/50/334412650.db2.gz FAKBHJSPWUMVMS-GDBMZVCRSA-N 1 0 276.380 3.696 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC[C@H]1C(C)(C)C ZINC000565060751 334537118 /nfs/dbraw/zinc/53/71/18/334537118.db2.gz MAKADKVYVZSSLO-KGLIPLIRSA-N 1 0 292.379 3.518 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2[C@@H]3CCC[C@@H]32)o1 ZINC000566500894 334653300 /nfs/dbraw/zinc/65/33/00/334653300.db2.gz RRNOVJWXOPAWGE-FVCICTRLSA-N 1 0 298.342 3.743 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000566678212 334659892 /nfs/dbraw/zinc/65/98/92/334659892.db2.gz XEWBOEAFVDDXKF-CYZMBNFOSA-N 1 0 266.316 3.526 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC1CC(F)(F)C1 ZINC000567015296 334673464 /nfs/dbraw/zinc/67/34/64/334673464.db2.gz LDQCGLDRAJPYKJ-NSHDSACASA-N 1 0 298.333 3.989 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000576392590 335197681 /nfs/dbraw/zinc/19/76/81/335197681.db2.gz SCUTUDVEYGPBDG-SVEBXFOSSA-N 1 0 298.386 3.873 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000579749219 335879321 /nfs/dbraw/zinc/87/93/21/335879321.db2.gz MCRBMKIBUBVCOA-GJZGRUSLSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC2CCC1CC2)c1ccc([N+](=O)[O-])cc1 ZINC000380684438 336016624 /nfs/dbraw/zinc/01/66/24/336016624.db2.gz DCXNTDIHJQWUMR-YQGLWYKZSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@H](CC(C)(C)C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000384717479 336129765 /nfs/dbraw/zinc/12/97/65/336129765.db2.gz HPUIEGFYYFLFIR-LLVKDONJSA-N 1 0 250.342 3.509 20 5 CHBDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)o1 ZINC000344640365 533819492 /nfs/dbraw/zinc/81/94/92/533819492.db2.gz ZAHSPVOZLZNLHT-SNVBAGLBSA-N 1 0 294.376 3.669 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)c(Cl)c1 ZINC000571703381 518203001 /nfs/dbraw/zinc/20/30/01/518203001.db2.gz IUHSJERABASPOV-MRCXROJRSA-N 1 0 280.755 3.526 20 5 CHBDRO CC(C)([NH2+]Cc1ccsc1)c1ccccc1[N+](=O)[O-] ZINC000291756761 519324724 /nfs/dbraw/zinc/32/47/24/519324724.db2.gz QYFRRYBCDNJFGY-UHFFFAOYSA-N 1 0 276.361 3.681 20 5 CHBDRO CC(C)([NH2+]Cc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000291761251 519325261 /nfs/dbraw/zinc/32/52/61/519325261.db2.gz RNFGNAHMAPDURZ-UHFFFAOYSA-N 1 0 270.332 3.620 20 5 CHBDRO CC(C)C[N@H+](Cc1csc([N+](=O)[O-])c1)C(C)C ZINC000339926810 519718758 /nfs/dbraw/zinc/71/87/58/519718758.db2.gz NCGXOWCFUCCBRF-UHFFFAOYSA-N 1 0 256.371 3.523 20 5 CHBDRO CCC[C@@H]([NH2+][C@H](C)CCCCO)c1cccc([N+](=O)[O-])c1 ZINC000295841990 520791002 /nfs/dbraw/zinc/79/10/02/520791002.db2.gz ANSOGGPODKUWTH-CZUORRHYSA-N 1 0 294.395 3.577 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1CCCCS1)c1cccc([N+](=O)[O-])c1 ZINC000156334830 522632281 /nfs/dbraw/zinc/63/22/81/522632281.db2.gz AKEPTQJTEBWTCR-CABCVRRESA-N 1 0 294.420 3.921 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000337303982 522735855 /nfs/dbraw/zinc/73/58/55/522735855.db2.gz RBUXHTYKFMRYNF-DYVFJYSZSA-N 1 0 299.374 3.662 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)[C@H]1CCCO1 ZINC000246550141 522742321 /nfs/dbraw/zinc/74/23/21/522742321.db2.gz WMBLVIVYXIQSGB-IVMMDQJWSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000130116228 522966452 /nfs/dbraw/zinc/96/64/52/522966452.db2.gz RBZOTPQSRGRLCQ-MRXNPFEDSA-N 1 0 285.347 3.573 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CC34CC4)o2)cc1 ZINC000418089128 534881178 /nfs/dbraw/zinc/88/11/78/534881178.db2.gz BIZZFYHHHCUMSC-ZDUSSCGKSA-N 1 0 298.342 3.745 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289687894 526079882 /nfs/dbraw/zinc/07/98/82/526079882.db2.gz GUMNJFRGMQRDEA-QWRGUYRKSA-N 1 0 284.306 3.633 20 5 CHBDRO CC(C)([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccs1 ZINC000344313706 527296558 /nfs/dbraw/zinc/29/65/58/527296558.db2.gz TTYQBPBHWVICAQ-UHFFFAOYSA-N 1 0 282.390 3.743 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH+](C2CCC2)C2CCC2)cs1 ZINC000292449282 527329995 /nfs/dbraw/zinc/32/99/95/527329995.db2.gz PGNZASVNCJFKPG-UHFFFAOYSA-N 1 0 266.366 3.563 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@H]2C[C@H]2c2ccccc2)cs1 ZINC000111397927 527331081 /nfs/dbraw/zinc/33/10/81/527331081.db2.gz CNLPYIXZEVMALS-KGLIPLIRSA-N 1 0 288.372 3.550 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000127380778 527396164 /nfs/dbraw/zinc/39/61/64/527396164.db2.gz QGIHJHPYHGGXNZ-PFWMLDTASA-N 1 0 297.358 3.773 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1cccnc1 ZINC000347369044 527500792 /nfs/dbraw/zinc/50/07/92/527500792.db2.gz GYLOWEDYOISMCP-ZROIWOOFSA-N 1 0 297.358 3.525 20 5 CHBDRO CC1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000344700481 527981703 /nfs/dbraw/zinc/98/17/03/527981703.db2.gz QGVXMFPTUGHLBN-UHFFFAOYSA-N 1 0 286.331 3.745 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2CC23CC3)cc1[N+](=O)[O-] ZINC000418090569 528099716 /nfs/dbraw/zinc/09/97/16/528099716.db2.gz DSAURJIYQJDTKX-ZDUSSCGKSA-N 1 0 274.364 3.608 20 5 CHBDRO CCC(CC)[C@H](CC[NH2+]Cc1ccc([N+](=O)[O-])cc1)OC ZINC000344852977 528851710 /nfs/dbraw/zinc/85/17/10/528851710.db2.gz LNDUYNRHRPEKRS-INIZCTEOSA-N 1 0 294.395 3.526 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C[C@H](C)C[C@H](C)C1 ZINC000251689990 1125484570 /nfs/dbraw/zinc/48/45/70/1125484570.db2.gz AUALMPWHNKTTSQ-IMRBUKKESA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(C)(F)F)cc1[N+](=O)[O-] ZINC000294083442 1123058905 /nfs/dbraw/zinc/05/89/05/1123058905.db2.gz AJXWRCCHEZHBKT-SNVBAGLBSA-N 1 0 272.295 3.599 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000129623210 1123458818 /nfs/dbraw/zinc/45/88/18/1123458818.db2.gz ZIGQCKDPBIQSDG-NWDGAFQWSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)C[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035081396 1123495327 /nfs/dbraw/zinc/49/53/27/1123495327.db2.gz QNPWRBLRSOOYRU-JTQLQIEISA-N 1 0 270.760 3.772 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000414282531 1123545011 /nfs/dbraw/zinc/54/50/11/1123545011.db2.gz HMMKWKXVSZPUHC-ZLKJLUDKSA-N 1 0 266.316 3.526 20 5 CHBDRO C[C@H](CCC(F)(F)F)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449347757 1124695534 /nfs/dbraw/zinc/69/55/34/1124695534.db2.gz ISXIVUIAKXRSIW-ZJUUUORDSA-N 1 0 290.285 3.976 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000119271250 1125530665 /nfs/dbraw/zinc/53/06/65/1125530665.db2.gz VHSXQGWNFIXUBX-CHWSQXEVSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCOC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000119271449 1125531018 /nfs/dbraw/zinc/53/10/18/1125531018.db2.gz VHSXQGWNFIXUBX-OLZOCXBDSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H](c1ccccc1)[N@H+](CC)Cc1cccnc1[N+](=O)[O-] ZINC000885969346 1125631543 /nfs/dbraw/zinc/63/15/43/1125631543.db2.gz PHEZCNDGNYBXHA-MRXNPFEDSA-N 1 0 299.374 3.963 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc3ccccc3o2)cc1 ZINC000037505642 1125717330 /nfs/dbraw/zinc/71/73/30/1125717330.db2.gz JYQONSMYBPZYOJ-UHFFFAOYSA-N 1 0 282.299 3.631 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000090035848 1125738308 /nfs/dbraw/zinc/73/83/08/1125738308.db2.gz SMJVUIZKBWUZND-OLZOCXBDSA-N 1 0 260.337 3.663 20 5 CHBDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000121990241 1125782744 /nfs/dbraw/zinc/78/27/44/1125782744.db2.gz XYANAXZWLQOXEY-YPMHNXCESA-N 1 0 294.395 3.757 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@H](C)C1 ZINC000482293842 1126749692 /nfs/dbraw/zinc/74/96/92/1126749692.db2.gz SHQXIQMASYJZNX-LBPRGKRZSA-N 1 0 262.353 3.525 20 5 CHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC(C)(C)C1 ZINC000483107786 1126768192 /nfs/dbraw/zinc/76/81/92/1126768192.db2.gz SDBGSNLQQSATOT-OAHLLOKOSA-N 1 0 276.380 3.648 20 5 CHBDRO CC1=C(C)C[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000483370593 1126783186 /nfs/dbraw/zinc/78/31/86/1126783186.db2.gz GUXAICZPRAMCNX-CYBMUJFWSA-N 1 0 260.337 3.698 20 5 CHBDRO CC(C)c1ccc(CNc2ccccc2C[NH3+])cc1[N+](=O)[O-] ZINC000904484196 1126854076 /nfs/dbraw/zinc/85/40/76/1126854076.db2.gz NJJHUERFXXOZBF-UHFFFAOYSA-N 1 0 299.374 3.789 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccn1 ZINC000192594100 1126962415 /nfs/dbraw/zinc/96/24/15/1126962415.db2.gz VXCJEOLWIJNQSR-SJKOYZFVSA-N 1 0 297.358 3.718 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccccc2)C2CC2)c1 ZINC000043643070 1127005779 /nfs/dbraw/zinc/00/57/79/1127005779.db2.gz FROYOCJLYIYVGZ-UHFFFAOYSA-N 1 0 282.343 3.759 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1 ZINC000323740046 1127049625 /nfs/dbraw/zinc/04/96/25/1127049625.db2.gz QAIOKUBPGDQOJU-GFCCVEGCSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCCCF)cc1[N+](=O)[O-] ZINC000284268548 1127179369 /nfs/dbraw/zinc/17/93/69/1127179369.db2.gz XIXBCPWWGSEQQS-GFCCVEGCSA-N 1 0 268.332 3.694 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@H](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000588977847 1127209054 /nfs/dbraw/zinc/20/90/54/1127209054.db2.gz AMUOMXYLAJVBSR-OAHLLOKOSA-N 1 0 274.364 3.525 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000589209390 1127216366 /nfs/dbraw/zinc/21/63/66/1127216366.db2.gz KXHRHBVMMGDYNU-UYZDIKGJSA-N 1 0 286.375 3.730 20 5 CHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000287027228 1127283369 /nfs/dbraw/zinc/28/33/69/1127283369.db2.gz RZLVZHSQTITYIQ-UHFFFAOYSA-N 1 0 298.333 3.647 20 5 CHBDRO Cc1ccc(CCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000354134930 1127295893 /nfs/dbraw/zinc/29/58/93/1127295893.db2.gz VUQQVZJILGSQBI-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000046089166 1127330394 /nfs/dbraw/zinc/33/03/94/1127330394.db2.gz DGXZDEIPHGUYHJ-OAHLLOKOSA-N 1 0 288.372 3.993 20 5 CHBDRO CCCCC[N@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)CCC ZINC000355537597 1127348413 /nfs/dbraw/zinc/34/84/13/1127348413.db2.gz AFNVVINJXOJZKM-ZDUSSCGKSA-N 1 0 296.415 3.509 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)CC(F)F ZINC000592373102 1127343410 /nfs/dbraw/zinc/34/34/10/1127343410.db2.gz UBWAUBABKISEDW-IGEMTJHASA-N 1 0 298.333 3.879 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000592379532 1127346298 /nfs/dbraw/zinc/34/62/98/1127346298.db2.gz LJSNATTVYDEYCX-KMFMQKCQSA-N 1 0 286.375 3.776 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000592399606 1127373650 /nfs/dbraw/zinc/37/36/50/1127373650.db2.gz NYNAFWBXQQGEGR-REWJHTLYSA-N 1 0 274.364 3.742 20 5 CHBDRO Cc1ccncc1CCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000289266961 1127379021 /nfs/dbraw/zinc/37/90/21/1127379021.db2.gz NCLROSALROWLPI-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CCCCO1 ZINC000594521283 1127421663 /nfs/dbraw/zinc/42/16/63/1127421663.db2.gz TVYHBQOUYUOKSA-UHOFOFEASA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccsc1 ZINC000594504367 1127419038 /nfs/dbraw/zinc/41/90/38/1127419038.db2.gz OAPQENSOCVNNGI-HZMBPMFUSA-N 1 0 288.372 3.994 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000226761095 1127424737 /nfs/dbraw/zinc/42/47/37/1127424737.db2.gz QNDNBXCGNJERNT-ZKYQVNSYSA-N 1 0 280.393 3.530 20 5 CHBDRO C[C@@H]([NH2+]CC[C@]1(C)CC1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000594725395 1127429774 /nfs/dbraw/zinc/42/97/74/1127429774.db2.gz KCAAHBLWZMLFOW-ZWNOBZJWSA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1cc[nH+]c(NCc2cccc([N+](=O)[O-])c2)c1C1CC1 ZINC000594741648 1127431187 /nfs/dbraw/zinc/43/11/87/1127431187.db2.gz BHPSVGMSBZNGJH-UHFFFAOYSA-N 1 0 283.331 3.788 20 5 CHBDRO Cc1cc(C)cc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000595072389 1127448753 /nfs/dbraw/zinc/44/87/53/1127448753.db2.gz FOOSLIBNUCWMLR-QGZVFWFLSA-N 1 0 296.370 3.989 20 5 CHBDRO C[C@]1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1(F)F ZINC000595082759 1127453578 /nfs/dbraw/zinc/45/35/78/1127453578.db2.gz XCGNVGWCIMPEQC-ZIAGYGMSSA-N 1 0 296.317 3.607 20 5 CHBDRO C[C@]1(CC[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1(F)F ZINC000595081649 1127453612 /nfs/dbraw/zinc/45/36/12/1127453612.db2.gz TXSSTPFPXLNOHR-JSGCOSHPSA-N 1 0 296.317 3.607 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cccc([N+](=O)[O-])c1 ZINC000595090782 1127454159 /nfs/dbraw/zinc/45/41/59/1127454159.db2.gz QYLIPNWWCQRPQN-GTNSWQLSSA-N 1 0 298.342 3.639 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(C)F ZINC000595088342 1127454286 /nfs/dbraw/zinc/45/42/86/1127454286.db2.gz PLMZZMLGXWLOHT-LBPRGKRZSA-N 1 0 282.359 3.644 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cccc([N+](=O)[O-])c1 ZINC000595090783 1127454325 /nfs/dbraw/zinc/45/43/25/1127454325.db2.gz QYLIPNWWCQRPQN-PIGZYNQJSA-N 1 0 298.342 3.639 20 5 CHBDRO CC(C)(F)CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000595087694 1127454357 /nfs/dbraw/zinc/45/43/57/1127454357.db2.gz OFQYBEATKAEYNV-AWEZNQCLSA-N 1 0 294.370 3.644 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1=CCCC1 ZINC000595097380 1127455997 /nfs/dbraw/zinc/45/59/97/1127455997.db2.gz UYXGOKXLWFNNIZ-LBPRGKRZSA-N 1 0 260.337 3.664 20 5 CHBDRO CC(C)[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000359299325 1127457756 /nfs/dbraw/zinc/45/77/56/1127457756.db2.gz ASZTZPIHAZFWNE-KRWDZBQOSA-N 1 0 299.374 3.519 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CC1CC=CC1)C1CC1 ZINC000595387109 1127461708 /nfs/dbraw/zinc/46/17/08/1127461708.db2.gz OBXJZMZIIGSGBI-UHFFFAOYSA-N 1 0 272.348 3.525 20 5 CHBDRO CC[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CC(F)F ZINC000595413703 1127461915 /nfs/dbraw/zinc/46/19/15/1127461915.db2.gz GBQMSDZJDJOAJQ-MNOVXSKESA-N 1 0 286.322 3.927 20 5 CHBDRO CC(C)([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccs1 ZINC000595431342 1127462963 /nfs/dbraw/zinc/46/29/63/1127462963.db2.gz ZQOGYMBMRNRZEY-UHFFFAOYSA-N 1 0 294.351 3.820 20 5 CHBDRO Cc1noc(C[N@@H+](C)[C@H]2CCC[C@@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595553260 1127466749 /nfs/dbraw/zinc/46/67/49/1127466749.db2.gz WKWBBUIYEFISAH-RYUDHWBXSA-N 1 0 295.383 3.538 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)o1 ZINC000597222535 1127535889 /nfs/dbraw/zinc/53/58/89/1127535889.db2.gz FDEQLSWREIMFND-CHWSQXEVSA-N 1 0 298.342 3.697 20 5 CHBDRO CC1([NH2+]CCc2ccc([N+](=O)[O-])cc2)CCC(F)(F)CC1 ZINC000602609035 1127599339 /nfs/dbraw/zinc/59/93/39/1127599339.db2.gz PQTYLSWLKFGIHQ-UHFFFAOYSA-N 1 0 298.333 3.695 20 5 CHBDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)n1 ZINC000602802037 1127614783 /nfs/dbraw/zinc/61/47/83/1127614783.db2.gz OIARBOPFSZUJGM-ZDUSSCGKSA-N 1 0 299.374 3.766 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000598680110 1127631342 /nfs/dbraw/zinc/63/13/42/1127631342.db2.gz UJFWBQGRIPZHQV-JQWIXIFHSA-N 1 0 284.306 3.599 20 5 CHBDRO CCC[C@@H](C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)OCC ZINC000599057945 1127653913 /nfs/dbraw/zinc/65/39/13/1127653913.db2.gz CUJYMZIBXZLICT-ZFWWWQNUSA-N 1 0 294.395 3.759 20 5 CHBDRO Cc1ccc(C[NH+]2CCC3(CC3(F)F)CC2)cc1[N+](=O)[O-] ZINC000593674211 1127656062 /nfs/dbraw/zinc/65/60/62/1127656062.db2.gz VIBBEEQIZPUTJY-UHFFFAOYSA-N 1 0 296.317 3.524 20 5 CHBDRO Cc1cc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cs1 ZINC000296095991 1127662622 /nfs/dbraw/zinc/66/26/22/1127662622.db2.gz RLZHOFSYECSDDE-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO Cc1c(C[N@H+]2CCC(F)(F)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000599624845 1127686021 /nfs/dbraw/zinc/68/60/21/1127686021.db2.gz ZWINNZOZXWRRSB-SNVBAGLBSA-N 1 0 284.306 3.523 20 5 CHBDRO CC(F)(F)CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000297346186 1127694024 /nfs/dbraw/zinc/69/40/24/1127694024.db2.gz OVEBXRQYSGVNPX-ZDUSSCGKSA-N 1 0 298.333 3.952 20 5 CHBDRO CCC(CC)[N@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000604434779 1127705758 /nfs/dbraw/zinc/70/57/58/1127705758.db2.gz GVBRATGRPZWRHY-UHFFFAOYSA-N 1 0 268.382 3.809 20 5 CHBDRO CCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC(C)C ZINC000604492906 1127707807 /nfs/dbraw/zinc/70/78/07/1127707807.db2.gz SIXKMSPVUCJHIH-UHFFFAOYSA-N 1 0 264.369 3.505 20 5 CHBDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000076068570 1127933492 /nfs/dbraw/zinc/93/34/92/1127933492.db2.gz GTAYCWJYTPOKQW-ZFWWWQNUSA-N 1 0 294.420 3.701 20 5 CHBDRO C[C@@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000539826812 1127944227 /nfs/dbraw/zinc/94/42/27/1127944227.db2.gz ZBVOIPDTGWRQGG-WOLRVDTOSA-N 1 0 274.364 3.728 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000595080859 1127951393 /nfs/dbraw/zinc/95/13/93/1127951393.db2.gz OZWPRINGCWGQAT-ABAIWWIYSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]21 ZINC000543897983 1127952359 /nfs/dbraw/zinc/95/23/59/1127952359.db2.gz GHBHNVSRHPIAHA-UHOFOFEASA-N 1 0 274.364 3.605 20 5 CHBDRO CC(C)(C)[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000544188332 1127962603 /nfs/dbraw/zinc/96/26/03/1127962603.db2.gz YEIGUEFPFNLQAO-AWEZNQCLSA-N 1 0 276.380 3.505 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000544830502 1127984671 /nfs/dbraw/zinc/98/46/71/1127984671.db2.gz BOCUTTXBXUHNFH-KOLCDFICSA-N 1 0 290.285 3.976 20 5 CHBDRO Cc1ccsc1[C@@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468002602 1127987124 /nfs/dbraw/zinc/98/71/24/1127987124.db2.gz FBAFWGAVGIBOHA-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC[C@H](C)C1 ZINC000468260566 1128000387 /nfs/dbraw/zinc/00/03/87/1128000387.db2.gz KYKAOOKDXIHWFW-STQMWFEESA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1noc(C[N@H+]2CC[C@H](C(C)(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000595497492 1128003456 /nfs/dbraw/zinc/00/34/56/1128003456.db2.gz OOMVEWZUAQBGFU-JQWIXIFHSA-N 1 0 295.383 3.538 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C)[C@@H]1C ZINC000541770313 1128038886 /nfs/dbraw/zinc/03/88/86/1128038886.db2.gz FDVKOJSTSDDTCB-AAEUAGOBSA-N 1 0 262.353 3.524 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC(C)(C)C1 ZINC000470179260 1128064597 /nfs/dbraw/zinc/06/45/97/1128064597.db2.gz VJZQCDPPSSYIRX-LCYFTJDESA-N 1 0 274.364 3.730 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC(C)C ZINC000151772724 1128076352 /nfs/dbraw/zinc/07/63/52/1128076352.db2.gz DPIGKHNSDJSNEZ-LBPRGKRZSA-N 1 0 250.342 3.600 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2CC=CC2)o1 ZINC000151969011 1128087665 /nfs/dbraw/zinc/08/76/65/1128087665.db2.gz CLRFPVWPTPBABE-UHFFFAOYSA-N 1 0 284.315 3.663 20 5 CHBDRO CCOc1cc(C[N@@H+]2CC[C@@H](C)[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492816887 1128113744 /nfs/dbraw/zinc/11/37/44/1128113744.db2.gz JKZRDAPAURMGMC-TZMCWYRMSA-N 1 0 292.379 3.614 20 5 CHBDRO CC(C)[C@H](C)C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524295 1128132500 /nfs/dbraw/zinc/13/25/00/1128132500.db2.gz AVQWSLWNPITVQA-SNVBAGLBSA-N 1 0 270.760 3.630 20 5 CHBDRO CCCC1(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761526460 1128133004 /nfs/dbraw/zinc/13/30/04/1128133004.db2.gz DEOMPOFDXUYFRN-UHFFFAOYSA-N 1 0 282.771 3.918 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000493310852 1128138394 /nfs/dbraw/zinc/13/83/94/1128138394.db2.gz OPMMVYQCYPDMIJ-TXEJJXNPSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1 ZINC000152955525 1128158855 /nfs/dbraw/zinc/15/88/55/1128158855.db2.gz OMQVIGNPYSFKSX-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](C)C1 ZINC000609193718 1128170574 /nfs/dbraw/zinc/17/05/74/1128170574.db2.gz YOMKLKZOQVROCG-ZDUSSCGKSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609194478 1128170608 /nfs/dbraw/zinc/17/06/08/1128170608.db2.gz OHIWICHNTNMWTR-CQSZACIVSA-N 1 0 292.379 3.756 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)CCC=C(C)C ZINC000542483815 1128176044 /nfs/dbraw/zinc/17/60/44/1128176044.db2.gz QZFXJLBCQJLCLR-CYBMUJFWSA-N 1 0 292.379 3.828 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000089512598 1128295600 /nfs/dbraw/zinc/29/56/00/1128295600.db2.gz FJLKYTZXILJOJY-ZIAGYGMSSA-N 1 0 284.359 3.877 20 5 CHBDRO C[C@@H](CSC(C)(C)C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000089513210 1128297681 /nfs/dbraw/zinc/29/76/81/1128297681.db2.gz BULRRQMYUJMJEL-NSHDSACASA-N 1 0 282.409 3.605 20 5 CHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1ccccc1[N+](=O)[O-] ZINC000301069828 1128301711 /nfs/dbraw/zinc/30/17/11/1128301711.db2.gz DMBYVDILCAFYIE-AWEZNQCLSA-N 1 0 291.395 3.661 20 5 CHBDRO C/C(=C/c1ccccc1)C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000609222595 1128327245 /nfs/dbraw/zinc/32/72/45/1128327245.db2.gz SQPXFFAXTDSYKT-SQFISAMPSA-N 1 0 296.370 3.830 20 5 CHBDRO C[C@H]1CCC[N@H+](CCCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000301120286 1128403715 /nfs/dbraw/zinc/40/37/15/1128403715.db2.gz WJSDGEBMZHZPDL-AWEZNQCLSA-N 1 0 291.395 3.519 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](c2ccncc2)C2CC2)cc1[N+](=O)[O-] ZINC000934701250 1128467330 /nfs/dbraw/zinc/46/73/30/1128467330.db2.gz NLBJJFRXINDGOF-KRWDZBQOSA-N 1 0 297.358 3.539 20 5 CHBDRO CC(C)C[NH+](Cc1cc(F)ccc1[N+](=O)[O-])CC(C)C ZINC000917037764 1128468342 /nfs/dbraw/zinc/46/83/42/1128468342.db2.gz KGONDULVPKHSAG-UHFFFAOYSA-N 1 0 282.359 3.848 20 5 CHBDRO CCSCC[C@@H](C)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000556901442 1128636941 /nfs/dbraw/zinc/63/69/41/1128636941.db2.gz NMNOLZNUDUCBLB-CYBMUJFWSA-N 1 0 296.436 3.867 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2cccc([C@H]3CCC[NH2+]3)c2)cc1 ZINC000600786489 1128681226 /nfs/dbraw/zinc/68/12/26/1128681226.db2.gz QIDQPDXUCMKJRI-MRXNPFEDSA-N 1 0 268.316 3.686 20 5 CHBDRO Cc1cc([C@H]2CCC[NH2+]2)ccc1-c1ccc([N+](=O)[O-])cc1 ZINC000600786162 1128681358 /nfs/dbraw/zinc/68/13/58/1128681358.db2.gz NVWWBFCSEOBIOA-QGZVFWFLSA-N 1 0 282.343 3.995 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2ncccc21)c1cccc([N+](=O)[O-])c1 ZINC000601264619 1128707245 /nfs/dbraw/zinc/70/72/45/1128707245.db2.gz BJOCVMGZSAVZHJ-SJKOYZFVSA-N 1 0 297.358 3.718 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CC23CCCC3)cc1Cl ZINC000763456820 1128720711 /nfs/dbraw/zinc/72/07/11/1128720711.db2.gz HKUHXQNJGOQNBY-ZDUSSCGKSA-N 1 0 280.755 3.671 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000037668416 1128726095 /nfs/dbraw/zinc/72/60/95/1128726095.db2.gz GRQMSLTYBHXUNT-GFCCVEGCSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000034995741 1117757739 /nfs/dbraw/zinc/75/77/39/1117757739.db2.gz DYINLAJDRJSCCR-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610080166 1128737823 /nfs/dbraw/zinc/73/78/23/1128737823.db2.gz KRQYUHWHDJCPKB-CQSZACIVSA-N 1 0 292.379 3.628 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCCC[C@H]1C ZINC000430240065 1117908527 /nfs/dbraw/zinc/90/85/27/1117908527.db2.gz CBMBWCJDINZAEM-DOMZBBRYSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001307686301 1117928463 /nfs/dbraw/zinc/92/84/63/1117928463.db2.gz SPJRODKFXSNRBZ-BMIGLBTASA-N 1 0 298.333 3.884 20 5 CHBDRO C[C@H]1C[C@@H](c2cccnc2)[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000359877461 1118007950 /nfs/dbraw/zinc/00/79/50/1118007950.db2.gz PWTGDFWOYHFRJA-GUYCJALGSA-N 1 0 297.358 3.573 20 5 CHBDRO CC[NH+](CC)CCSc1ccc([N+](=O)[O-])cc1Cl ZINC000610258214 1118065020 /nfs/dbraw/zinc/06/50/20/1118065020.db2.gz NIOYCTYOECXPDK-UHFFFAOYSA-N 1 0 288.800 3.682 20 5 CHBDRO O=[N+]([O-])c1cccc(Nc2cc[nH+]c(C3CC3)c2)c1 ZINC001204449649 1118075041 /nfs/dbraw/zinc/07/50/41/1118075041.db2.gz BUXZCMWAZPUCNB-UHFFFAOYSA-N 1 0 255.277 3.611 20 5 CHBDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000112675820 1118084424 /nfs/dbraw/zinc/08/44/24/1118084424.db2.gz VCPGGAXAKODDNL-STQMWFEESA-N 1 0 282.409 3.961 20 5 CHBDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000112676020 1118085195 /nfs/dbraw/zinc/08/51/95/1118085195.db2.gz ZRAJQXNVDKEQSQ-HOTGVXAUSA-N 1 0 276.380 3.899 20 5 CHBDRO CC(C)C[N@H+](Cc1cc([O-])ccc1[N+](=O)[O-])C1CCCC1 ZINC001167218544 1118102490 /nfs/dbraw/zinc/10/24/90/1118102490.db2.gz PLWINEJWRYQRKG-UHFFFAOYSA-N 1 0 292.379 3.701 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)Cc2ccco2)cccc1[N+](=O)[O-] ZINC000764773449 1118112195 /nfs/dbraw/zinc/11/21/95/1118112195.db2.gz IRGBOCFARJPDAQ-WCQYABFASA-N 1 0 288.347 3.778 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)Cc1ccco1 ZINC000764774204 1118113090 /nfs/dbraw/zinc/11/30/90/1118113090.db2.gz NWNWVNCPTPSJSL-OLZOCXBDSA-N 1 0 288.347 3.778 20 5 CHBDRO C[C@H]1C[C@@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001648800233 1118125373 /nfs/dbraw/zinc/12/53/73/1118125373.db2.gz XZXLBKFKEVKLPT-WCQYABFASA-N 1 0 286.331 3.600 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[N@@H+]1CCCC2(CCCCC2)C1 ZINC001167341823 1118332885 /nfs/dbraw/zinc/33/28/85/1118332885.db2.gz LWKMKRFRXJDXPX-UHFFFAOYSA-N 1 0 289.379 3.536 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2C3CCCC2CCC3)cc1 ZINC000610370169 1118362520 /nfs/dbraw/zinc/36/25/20/1118362520.db2.gz YEWLAHVVTSGYPP-UHFFFAOYSA-N 1 0 260.337 3.502 20 5 CHBDRO CCCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000301454326 1118390596 /nfs/dbraw/zinc/39/05/96/1118390596.db2.gz VSRBPQPCGGFMQA-UHFFFAOYSA-N 1 0 291.395 3.580 20 5 CHBDRO CCn1ccc(C[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000616129702 1128776699 /nfs/dbraw/zinc/77/66/99/1128776699.db2.gz UYQBAQURGUWPQF-CYBMUJFWSA-N 1 0 287.363 3.609 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)C[C@H]1C ZINC000610133401 1118475256 /nfs/dbraw/zinc/47/52/56/1118475256.db2.gz MJQCNADJFPAFHX-QWHCGFSZSA-N 1 0 292.379 3.612 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001167457716 1118574562 /nfs/dbraw/zinc/57/45/62/1118574562.db2.gz JFHGEJBNFGSBLF-AWEZNQCLSA-N 1 0 280.343 3.889 20 5 CHBDRO Cc1c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000477222128 1118655674 /nfs/dbraw/zinc/65/56/74/1118655674.db2.gz MKTMLIHRTNBVQB-QGZVFWFLSA-N 1 0 296.370 3.893 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000098005626 1118686779 /nfs/dbraw/zinc/68/67/79/1118686779.db2.gz LNSOHVPZSDGHHI-VXGBXAGGSA-N 1 0 264.369 3.928 20 5 CHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccsc1 ZINC000090910225 1118688011 /nfs/dbraw/zinc/68/80/11/1118688011.db2.gz UWWOKYUFBJHUJY-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H]1CCC[C@@H]1CCCF ZINC000510671353 1118785519 /nfs/dbraw/zinc/78/55/19/1118785519.db2.gz ZLHCIONWOLPDSG-HIFRSBDPSA-N 1 0 294.370 3.645 20 5 CHBDRO CCC[C@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000610796078 1118872616 /nfs/dbraw/zinc/87/26/16/1118872616.db2.gz DYNVJEWWPMYOMR-NWDGAFQWSA-N 1 0 250.342 3.742 20 5 CHBDRO CSCCCCCC[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000230148642 1118879094 /nfs/dbraw/zinc/87/90/94/1118879094.db2.gz QCEWJIGSWIXZHE-UHFFFAOYSA-N 1 0 282.409 3.608 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000135462682 1118929340 /nfs/dbraw/zinc/92/93/40/1118929340.db2.gz JDGNWUKNDNPNIG-GHMZBOCLSA-N 1 0 250.342 3.680 20 5 CHBDRO C[C@H]1CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000538731203 1118949774 /nfs/dbraw/zinc/94/97/74/1118949774.db2.gz MRAUQPYFASXBHK-LBPRGKRZSA-N 1 0 286.331 3.839 20 5 CHBDRO COc1ccc(C[NH2+]CCC(C)(C)C2CC2)cc1[N+](=O)[O-] ZINC000328557192 1118952085 /nfs/dbraw/zinc/95/20/85/1118952085.db2.gz BHDNHYURKCHABI-UHFFFAOYSA-N 1 0 292.379 3.519 20 5 CHBDRO CC[C@H]([NH2+]C[C@H](C)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000342274635 1118965825 /nfs/dbraw/zinc/96/58/25/1118965825.db2.gz WPANWJNAPIVMJJ-CABZTGNLSA-N 1 0 290.285 3.834 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)Cc1cccnc1 ZINC000934234767 1118985088 /nfs/dbraw/zinc/98/50/88/1118985088.db2.gz QOMDWMUODUMWJR-KBPBESRZSA-N 1 0 299.374 3.580 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000071969847 1118990296 /nfs/dbraw/zinc/99/02/96/1118990296.db2.gz TXVVDROYSJPCIP-CYBMUJFWSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC12CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000395646365 1119061834 /nfs/dbraw/zinc/06/18/34/1119061834.db2.gz NQPIPAOAVGXKIU-BXUZGUMPSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccoc1 ZINC000582383538 1119064281 /nfs/dbraw/zinc/06/42/81/1119064281.db2.gz FIJGGIAGZIMOLR-NSHDSACASA-N 1 0 299.330 3.562 20 5 CHBDRO CC1=CCC[C@@H](C)[C@H]1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000479547359 1119124337 /nfs/dbraw/zinc/12/43/37/1119124337.db2.gz RIQJZNDIILJNQK-HIFRSBDPSA-N 1 0 274.364 3.677 20 5 CHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000479579253 1119125531 /nfs/dbraw/zinc/12/55/31/1119125531.db2.gz NTWFDMBBDZSRHX-DOMZBBRYSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1ccccc1CC[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000061014221 1119184584 /nfs/dbraw/zinc/18/45/84/1119184584.db2.gz YXRXWDPZEYHAOH-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000612144799 1119227583 /nfs/dbraw/zinc/22/75/83/1119227583.db2.gz RMOARFLNUAXRAK-GFCCVEGCSA-N 1 0 278.327 3.522 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000226178424 1119250978 /nfs/dbraw/zinc/25/09/78/1119250978.db2.gz TVZOHZGSCWTTRA-TYNCELHUSA-N 1 0 292.379 3.518 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCC(C)(C)C1 ZINC000149938740 1119272327 /nfs/dbraw/zinc/27/23/27/1119272327.db2.gz VHMUOUVOQKFIFB-ZDUSSCGKSA-N 1 0 292.379 3.662 20 5 CHBDRO CCN(Cc1cccs1)Cc1ccccc1[N+](=O)[O-] ZINC000248257779 1119337694 /nfs/dbraw/zinc/33/76/94/1119337694.db2.gz PHDUFSIBULKBTL-UHFFFAOYSA-N 1 0 276.361 3.678 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC000611802035 1119466986 /nfs/dbraw/zinc/46/69/86/1119466986.db2.gz GDUASRAUCDUJMM-TYNCELHUSA-N 1 0 292.354 3.744 20 5 CHBDRO CSCCC[N@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000343651142 1119480514 /nfs/dbraw/zinc/48/05/14/1119480514.db2.gz ADJJPYUOENVTGB-UHFFFAOYSA-N 1 0 296.436 3.903 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000601306351 1119532083 /nfs/dbraw/zinc/53/20/83/1119532083.db2.gz HAAOFLLARQOMNE-XXILOJSOSA-N 1 0 288.269 3.505 20 5 CHBDRO CC(C)[N@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC001167680263 1119675904 /nfs/dbraw/zinc/67/59/04/1119675904.db2.gz BSHDYIXHAJZVHJ-UHFFFAOYSA-N 1 0 292.379 3.627 20 5 CHBDRO CC1([NH2+]Cc2csc([N+](=O)[O-])c2)CCC(F)(F)CC1 ZINC000612192059 1119747808 /nfs/dbraw/zinc/74/78/08/1119747808.db2.gz RTKLHNWZBRNVCH-UHFFFAOYSA-N 1 0 290.335 3.714 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C1CC1 ZINC000615720417 1119791116 /nfs/dbraw/zinc/79/11/16/1119791116.db2.gz AGVAKCUPAONIAO-LLBKUYECSA-N 1 0 274.364 3.634 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccnc1 ZINC000273516895 1120130182 /nfs/dbraw/zinc/13/01/82/1120130182.db2.gz STBPIEKKLWNONL-QGZVFWFLSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000353665553 1120198712 /nfs/dbraw/zinc/19/87/12/1120198712.db2.gz LDXRQMKPCMFWGS-ZDUSSCGKSA-N 1 0 282.343 3.542 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000062726443 1120205393 /nfs/dbraw/zinc/20/53/93/1120205393.db2.gz XIRCARHSBMGUBF-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](C1CC1)C1CCCC1 ZINC000064808235 1120303216 /nfs/dbraw/zinc/30/32/16/1120303216.db2.gz XRBCQXDPAIGDDR-UHFFFAOYSA-N 1 0 260.337 3.502 20 5 CHBDRO Cc1c(C[N@@H+](C(C)C)C2CCC2)cccc1[N+](=O)[O-] ZINC000077357900 1120328749 /nfs/dbraw/zinc/32/87/49/1120328749.db2.gz FWORJRQNQVUZSL-UHFFFAOYSA-N 1 0 262.353 3.666 20 5 CHBDRO CCC1([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CCC1 ZINC000255126622 1120328834 /nfs/dbraw/zinc/32/88/34/1120328834.db2.gz FSKDIPSPDUEXGL-YVMONPNESA-N 1 0 260.337 3.530 20 5 CHBDRO CC(F)(F)CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417352906 1120434345 /nfs/dbraw/zinc/43/43/45/1120434345.db2.gz WBRAQCXPNYFKGI-AWEZNQCLSA-N 1 0 298.333 3.997 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CCC1 ZINC000618572282 1128918856 /nfs/dbraw/zinc/91/88/56/1128918856.db2.gz GZQVJVYMUQCZMJ-BDJLRTHQSA-N 1 0 274.364 3.750 20 5 CHBDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000068592625 1120479285 /nfs/dbraw/zinc/47/92/85/1120479285.db2.gz VUZCAKODVDYGFT-GXTWGEPZSA-N 1 0 292.379 3.662 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618561383 1128919307 /nfs/dbraw/zinc/91/93/07/1128919307.db2.gz CQQUECAQFZUKAM-ABAIWWIYSA-N 1 0 262.353 3.750 20 5 CHBDRO C[C@@H](c1ccncc1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350357673 1120650698 /nfs/dbraw/zinc/65/06/98/1120650698.db2.gz OZYXHTYTCBKHLD-VSKVDJIOSA-N 1 0 297.358 3.696 20 5 CHBDRO C[C@@H]([NH2+]CCCNc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000131995100 1120679052 /nfs/dbraw/zinc/67/90/52/1120679052.db2.gz KFXHXQLVQIXQJZ-CQSZACIVSA-N 1 0 299.374 3.748 20 5 CHBDRO CCSCC[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000132281466 1120686249 /nfs/dbraw/zinc/68/62/49/1120686249.db2.gz YCJAYJWAEOCNPS-NWDGAFQWSA-N 1 0 282.409 3.777 20 5 CHBDRO Cc1c(C[N@@H+]([C@@H](C)C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000047909007 1120797300 /nfs/dbraw/zinc/79/73/00/1120797300.db2.gz NIYMGDHRNYNZNF-LBPRGKRZSA-N 1 0 274.364 3.666 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000300409904 1120915910 /nfs/dbraw/zinc/91/59/10/1120915910.db2.gz CKTSNSINEHMNDS-KWCYVHTRSA-N 1 0 294.420 3.838 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000051574549 1120955877 /nfs/dbraw/zinc/95/58/77/1120955877.db2.gz GDWKDZPCNWYEGB-INIZCTEOSA-N 1 0 285.347 3.539 20 5 CHBDRO CC[C@@H]([NH2+]CCC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000163506637 1121024994 /nfs/dbraw/zinc/02/49/94/1121024994.db2.gz SDHLNEVZPRKXEE-OAHLLOKOSA-N 1 0 262.353 3.826 20 5 CHBDRO CCC[C@@H]([NH2+]CCC[C@H](O)CC)c1cccc([N+](=O)[O-])c1 ZINC000358175643 1121067472 /nfs/dbraw/zinc/06/74/72/1121067472.db2.gz ZBDPIXYBMGIOTC-HZPDHXFCSA-N 1 0 294.395 3.577 20 5 CHBDRO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CC1(C)C ZINC001174907157 1121085708 /nfs/dbraw/zinc/08/57/08/1121085708.db2.gz GTKLRMOLVZQQFD-NSHDSACASA-N 1 0 282.771 3.726 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)CCC2 ZINC000618574956 1121228897 /nfs/dbraw/zinc/22/88/97/1121228897.db2.gz QMPYRXDZRTUKNE-RISCZKNCSA-N 1 0 296.317 3.750 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NC(C)(C)C1CC1 ZINC001162517704 1121267431 /nfs/dbraw/zinc/26/74/31/1121267431.db2.gz DJQOWXZUJIYPTH-UHFFFAOYSA-N 1 0 261.433 3.883 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCCC23CC3)c1 ZINC000706934525 1121446185 /nfs/dbraw/zinc/44/61/85/1121446185.db2.gz DVYXAISQTOPBDM-CYBMUJFWSA-N 1 0 280.755 3.671 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC3(CC3)CC2)c1 ZINC000707163216 1121451534 /nfs/dbraw/zinc/45/15/34/1121451534.db2.gz PORHVJUWEPOJEV-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CC[C@@H](C)C1 ZINC000433038367 1121528449 /nfs/dbraw/zinc/52/84/49/1121528449.db2.gz JRPPGAYJAUCADH-BXUZGUMPSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H](C)C(C)C ZINC000543628649 1121534797 /nfs/dbraw/zinc/53/47/97/1121534797.db2.gz VNZKDAKYBQUYGW-CYBMUJFWSA-N 1 0 264.369 3.770 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000543631495 1121538681 /nfs/dbraw/zinc/53/86/81/1121538681.db2.gz NNLZYKUZOCVZCK-BBRMVZONSA-N 1 0 274.364 3.668 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC12CCCC2 ZINC000429434235 1121579983 /nfs/dbraw/zinc/57/99/83/1121579983.db2.gz HHKSZFVDRIMRIB-CJNGLKHVSA-N 1 0 288.391 3.838 20 5 CHBDRO CCC(C)(C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000429433975 1121580571 /nfs/dbraw/zinc/58/05/71/1121580571.db2.gz ZMOLFKFSLFBMBL-HNNXBMFYSA-N 1 0 290.407 3.942 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]C2CCCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433134900 1121589002 /nfs/dbraw/zinc/58/90/02/1121589002.db2.gz HNBOOZBWJYHNSJ-OAHLLOKOSA-N 1 0 274.364 3.849 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)C1CCC1 ZINC000611337294 1121638095 /nfs/dbraw/zinc/63/80/95/1121638095.db2.gz YDDPRWNAVNLRMN-NWDGAFQWSA-N 1 0 262.353 3.742 20 5 CHBDRO CC1CC([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433291507 1121639010 /nfs/dbraw/zinc/63/90/10/1121639010.db2.gz ZMUBDOOECUIXCZ-QKFMDRJYSA-N 1 0 274.364 3.705 20 5 CHBDRO CS[C@H](C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433297415 1121642873 /nfs/dbraw/zinc/64/28/73/1121642873.db2.gz LEJUUTNMUCOBDB-YGRLFVJLSA-N 1 0 294.420 3.658 20 5 CHBDRO CC[C@@H]([NH2+]CCCOC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000611403566 1121643590 /nfs/dbraw/zinc/64/35/90/1121643590.db2.gz SDKSEWNKOHIJRG-OAHLLOKOSA-N 1 0 294.395 3.841 20 5 CHBDRO C[C@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC001177712081 1121746028 /nfs/dbraw/zinc/74/60/28/1121746028.db2.gz DYKOYRNAPHKUBD-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO CC[C@@H]1CCC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC001178386798 1121782491 /nfs/dbraw/zinc/78/24/91/1121782491.db2.gz NCHYTENKUIVJOH-UKRRQHHQSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H]2C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC000619753696 1129010592 /nfs/dbraw/zinc/01/05/92/1129010592.db2.gz MANZMERTQLFBRT-MWNCTCPHSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000182627411 1121817258 /nfs/dbraw/zinc/81/72/58/1121817258.db2.gz YCIUGFOQFYADAR-CYBMUJFWSA-N 1 0 288.347 3.998 20 5 CHBDRO Cc1c(C[NH2+]CC[C@H]2CCCC2(F)F)cccc1[N+](=O)[O-] ZINC001179443304 1121877743 /nfs/dbraw/zinc/87/77/43/1121877743.db2.gz OCNGORMMMFOHDY-CYBMUJFWSA-N 1 0 298.333 3.818 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@H](C)[C@H](C)C1 ZINC001180199382 1121966815 /nfs/dbraw/zinc/96/68/15/1121966815.db2.gz RNGSGNNNEAYHLT-WCQYABFASA-N 1 0 276.380 3.690 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2CCC2)s1 ZINC000501349062 1121972399 /nfs/dbraw/zinc/97/23/99/1121972399.db2.gz SICJNNKAJKTLDB-UHFFFAOYSA-N 1 0 288.372 3.965 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000501871518 1122019500 /nfs/dbraw/zinc/01/95/00/1122019500.db2.gz PKBRQVOIVRKTHQ-KRWDZBQOSA-N 1 0 296.370 3.802 20 5 CHBDRO CC(C)C1(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])CC1 ZINC001181697126 1122073222 /nfs/dbraw/zinc/07/32/22/1122073222.db2.gz FPVRBBVIABKMBI-UHFFFAOYSA-N 1 0 276.380 3.505 20 5 CHBDRO Cc1cc(OCc2ccc(Cl)c([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC000774777761 1122295468 /nfs/dbraw/zinc/29/54/68/1122295468.db2.gz IURLWLHQINHSCT-UHFFFAOYSA-N 1 0 292.722 3.839 20 5 CHBDRO CCC[N@@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1Cl ZINC001186381660 1122390987 /nfs/dbraw/zinc/39/09/87/1122390987.db2.gz XAIXGIKZPQVGNZ-LBPRGKRZSA-N 1 0 297.786 3.535 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@@H]12 ZINC000515548291 1122509301 /nfs/dbraw/zinc/50/93/01/1122509301.db2.gz RHIXYHKHOLELLH-COXVUDFISA-N 1 0 288.391 3.995 20 5 CHBDRO CCC(CC)[C@H](CNc1ccc([N+](=O)[O-])c(C)c1)[NH+](C)C ZINC000515541296 1122510303 /nfs/dbraw/zinc/51/03/03/1122510303.db2.gz SVIVULDISIKFMS-INIZCTEOSA-N 1 0 293.411 3.682 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)CC(C)(C)C ZINC001190840299 1122557647 /nfs/dbraw/zinc/55/76/47/1122557647.db2.gz YRYKEDOCQOJOFU-UHFFFAOYSA-N 1 0 294.395 3.908 20 5 CHBDRO CC[C@@H](C)C[N@H+](CC)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001191374867 1122597639 /nfs/dbraw/zinc/59/76/39/1122597639.db2.gz KJNLVGKPXUDXFP-CQSZACIVSA-N 1 0 294.395 3.732 20 5 CHBDRO CC[C@H](C)c1ccc([C@H]([NH2+]CC[N+](=O)[O-])C(C)C)cc1 ZINC001191961625 1122625211 /nfs/dbraw/zinc/62/52/11/1122625211.db2.gz YYFAPZZCWYCSRF-XJKSGUPXSA-N 1 0 278.396 3.764 20 5 CHBDRO CC(C)C(C)(C)C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000438369922 1122697321 /nfs/dbraw/zinc/69/73/21/1122697321.db2.gz AGSFWZAMPNRKGL-CLFYSBASSA-N 1 0 276.380 3.880 20 5 CHBDRO Cc1nc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)cs1 ZINC000126584183 1122707221 /nfs/dbraw/zinc/70/72/21/1122707221.db2.gz KPMCPNDKNONTQH-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO CC(C)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000159441181 1122861576 /nfs/dbraw/zinc/86/15/76/1122861576.db2.gz AQXNQONGWCCFET-NSHDSACASA-N 1 0 282.771 3.726 20 5 CHBDRO Cc1cccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1C ZINC000507118154 1122927585 /nfs/dbraw/zinc/92/75/85/1122927585.db2.gz BIVVCNUREYTFSR-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO COc1ccc(C[N@@H+]2CCC[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000507136015 1122930970 /nfs/dbraw/zinc/93/09/70/1122930970.db2.gz WREPNHMKLZBENA-CQSZACIVSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1cc(C)cc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000507172931 1122934655 /nfs/dbraw/zinc/93/46/55/1122934655.db2.gz JILBQNUPKRVMPJ-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000507182056 1122935508 /nfs/dbraw/zinc/93/55/08/1122935508.db2.gz PCRCTOJLEZHZGU-INIZCTEOSA-N 1 0 296.370 3.893 20 5 CHBDRO CCC1(C)CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000507203388 1122936553 /nfs/dbraw/zinc/93/65/53/1122936553.db2.gz ITHFXSYHORXVPZ-UHFFFAOYSA-N 1 0 276.380 3.649 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000507672220 1122983259 /nfs/dbraw/zinc/98/32/59/1122983259.db2.gz JJJDTYTVLITASG-MRXNPFEDSA-N 1 0 296.370 3.659 20 5 CHBDRO Cc1cccc2c1CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C2 ZINC000729478006 1122998649 /nfs/dbraw/zinc/99/86/49/1122998649.db2.gz SHEJZYOGHCPCTO-UHFFFAOYSA-N 1 0 296.370 3.770 20 5 CHBDRO CC(C)(C)c1cc(Nc2cc(O)cc([N+](=O)[O-])c2)cc[nH+]1 ZINC001199813986 1123041973 /nfs/dbraw/zinc/04/19/73/1123041973.db2.gz AYIOCNSRSFCFGY-UHFFFAOYSA-N 1 0 287.319 3.737 20 5 CHBDRO Cc1ccc(C[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1C ZINC001201822881 1123153167 /nfs/dbraw/zinc/15/31/67/1123153167.db2.gz QVJPZCDYBZVBSX-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO CC1(C)C[C@@H]([NH2+][C@@H]2C=CCC2)c2cc([N+](=O)[O-])ccc21 ZINC000850506900 1123277171 /nfs/dbraw/zinc/27/71/71/1123277171.db2.gz CHAARMJDXFNILG-IAQYHMDHSA-N 1 0 272.348 3.625 20 5 CHBDRO Cc1cc(O[C@H](C)C[N+](C)(C)C)c(C(C)C)cc1N=O ZINC001226737380 1123304276 /nfs/dbraw/zinc/30/42/76/1123304276.db2.gz ZLFXYKWHQOZKQU-CYBMUJFWSA-N 1 0 279.404 3.990 20 5 CHBDRO C[C@@H]([NH2+]CCCOC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000173365537 1123598865 /nfs/dbraw/zinc/59/88/65/1123598865.db2.gz PEGYRSIKZZSRBW-CYBMUJFWSA-N 1 0 292.379 3.595 20 5 CHBDRO CC(C)(C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C(C)(F)F ZINC000865790289 1124015114 /nfs/dbraw/zinc/01/51/14/1124015114.db2.gz OWDLRFLCSBZLPB-SOFGYWHQSA-N 1 0 298.333 3.879 20 5 CHBDRO C[C@@H]1CCCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000088507310 1124061338 /nfs/dbraw/zinc/06/13/38/1124061338.db2.gz HKYHIRVTPWDDHJ-IUODEOHRSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC[C@@H]2CCSC2)cccc1[N+](=O)[O-] ZINC000866402523 1124062893 /nfs/dbraw/zinc/06/28/93/1124062893.db2.gz MHMGLEUEUMGZGO-QWHCGFSZSA-N 1 0 294.420 3.697 20 5 CHBDRO CCc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000037668639 1129164393 /nfs/dbraw/zinc/16/43/93/1129164393.db2.gz WJYNNDWDLZOMSM-UHFFFAOYSA-N 1 0 276.361 3.509 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccc(C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000268802054 1124073166 /nfs/dbraw/zinc/07/31/66/1124073166.db2.gz YZARDIFNRUQYHU-QGZVFWFLSA-N 1 0 299.374 3.929 20 5 CHBDRO C[C@@H](CC(C)(C)C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000384792880 1124076423 /nfs/dbraw/zinc/07/64/23/1124076423.db2.gz RJRUKAQDNVEADL-NSHDSACASA-N 1 0 250.342 3.509 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)C2CCSCC2)cc1[N+](=O)[O-] ZINC000866541133 1124080201 /nfs/dbraw/zinc/08/02/01/1124080201.db2.gz WVMJBLVPSNLCOL-GFCCVEGCSA-N 1 0 294.420 3.525 20 5 CHBDRO COc1ccc(C[N@@H+]2C[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000525637972 1124450620 /nfs/dbraw/zinc/45/06/20/1124450620.db2.gz MRVFYOWGTOFCKZ-STQMWFEESA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(C)C ZINC000449075847 1124645323 /nfs/dbraw/zinc/64/53/23/1124645323.db2.gz SENQXIHVBMSJHN-LBPRGKRZSA-N 1 0 264.369 3.552 20 5 CHBDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038076 1124662290 /nfs/dbraw/zinc/66/22/90/1124662290.db2.gz HRWJKGBFZMNZFS-WDEREUQCSA-N 1 0 298.358 3.588 20 5 CHBDRO C[C@H]([NH2+]CCCC(C)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872072847 1124674456 /nfs/dbraw/zinc/67/44/56/1124674456.db2.gz KQSNFVUPWIRVBD-VIFPVBQESA-N 1 0 290.285 3.820 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])CC(F)F ZINC000872081069 1124677020 /nfs/dbraw/zinc/67/70/20/1124677020.db2.gz FOBHAUZXTCCGPL-RKDXNWHRSA-N 1 0 290.285 3.676 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1c(F)cccc1[N+](=O)[O-] ZINC000872080426 1124677395 /nfs/dbraw/zinc/67/73/95/1124677395.db2.gz XGKIERMHCFTWLF-SRRSOLGSSA-N 1 0 278.327 3.573 20 5 CHBDRO COCC(C)(C)CC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000872105394 1124684117 /nfs/dbraw/zinc/68/41/17/1124684117.db2.gz IDMVONABMDGIDH-ZDUSSCGKSA-N 1 0 294.395 3.617 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cccc(F)c1 ZINC000873009156 1124733766 /nfs/dbraw/zinc/73/37/66/1124733766.db2.gz URQNJJUAHRQHBM-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO Cc1c(C[NH2+]C(C)(C)CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000873112181 1124737867 /nfs/dbraw/zinc/73/78/67/1124737867.db2.gz QEQKIMCMALWFJP-UHFFFAOYSA-N 1 0 290.285 3.724 20 5 CHBDRO CSC(C)(C)CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000877557424 1125044430 /nfs/dbraw/zinc/04/44/30/1125044430.db2.gz LYQVVDBEOQSHIF-NSHDSACASA-N 1 0 282.409 3.777 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H](C)CCCCO)c1cccc([N+](=O)[O-])c1 ZINC000295841994 1125164005 /nfs/dbraw/zinc/16/40/05/1125164005.db2.gz ANSOGGPODKUWTH-XJKSGUPXSA-N 1 0 294.395 3.577 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccc2)C2CC2)cc1 ZINC000035053166 1125234637 /nfs/dbraw/zinc/23/46/37/1125234637.db2.gz OMTNWRFXUUKFOE-QGZVFWFLSA-N 1 0 282.343 3.836 20 5 CHBDRO C[C@H](C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])CC(F)F ZINC000697352393 1125305689 /nfs/dbraw/zinc/30/56/89/1125305689.db2.gz SCHBNFMAZMPCKV-QMMMGPOBSA-N 1 0 292.713 3.629 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCCC(C)C)cccc1[N+](=O)[O-] ZINC000532453340 1125388811 /nfs/dbraw/zinc/38/88/11/1125388811.db2.gz MESVKGHETONXQZ-ZDUSSCGKSA-N 1 0 264.369 3.990 20 5 CHBDRO CC(C)(CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000614822452 1125389309 /nfs/dbraw/zinc/38/93/09/1125389309.db2.gz NHEYAEDUHRQPLJ-UHFFFAOYSA-N 1 0 294.248 3.555 20 5 CHBDRO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000883462126 1125411324 /nfs/dbraw/zinc/41/13/24/1125411324.db2.gz KQKZWLYIXMHLDK-INIZCTEOSA-N 1 0 297.358 3.630 20 5 CHBDRO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000883462127 1125411895 /nfs/dbraw/zinc/41/18/95/1125411895.db2.gz KQKZWLYIXMHLDK-MRXNPFEDSA-N 1 0 297.358 3.630 20 5 CHBDRO O[C@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)C1CC1 ZINC000734844187 1129324324 /nfs/dbraw/zinc/32/43/24/1129324324.db2.gz HLWOYAPRGFSCAM-HXUWFJFHSA-N 1 0 291.394 3.854 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000766224945 1129384074 /nfs/dbraw/zinc/38/40/74/1129384074.db2.gz NHUZRQSTMZGWQE-OUCADQQQSA-N 1 0 294.420 3.838 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000739926623 1129410006 /nfs/dbraw/zinc/41/00/06/1129410006.db2.gz IQGMNCWASUFXHF-CQSZACIVSA-N 1 0 280.343 3.889 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000739926622 1129410035 /nfs/dbraw/zinc/41/00/35/1129410035.db2.gz IQGMNCWASUFXHF-AWEZNQCLSA-N 1 0 280.343 3.889 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CCCC3)CC2)cc1F ZINC000094774794 1129452057 /nfs/dbraw/zinc/45/20/57/1129452057.db2.gz ODYWDCBCDYYXQU-UHFFFAOYSA-N 1 0 292.354 3.890 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000742377586 1129475973 /nfs/dbraw/zinc/47/59/73/1129475973.db2.gz WBZYHIOVONKDBO-JKSUJKDBSA-N 1 0 288.391 3.962 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])[C@H]1C ZINC000252438160 1129576648 /nfs/dbraw/zinc/57/66/48/1129576648.db2.gz ZVMAWDMFZNVNAK-SUNKGSAMSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2)C2CCC2)C1 ZINC001168977363 1129686272 /nfs/dbraw/zinc/68/62/72/1129686272.db2.gz AYRARSQEDPVENB-KBRIMQKVSA-N 1 0 288.391 3.563 20 5 CHBDRO CC(C)[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168981793 1129686812 /nfs/dbraw/zinc/68/68/12/1129686812.db2.gz HGUAUMWNWMHEMD-WQVCFCJDSA-N 1 0 294.370 3.558 20 5 CHBDRO CC(C)[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1F ZINC001168982834 1129686867 /nfs/dbraw/zinc/68/68/67/1129686867.db2.gz JBWXQVGEIXGDOT-WWGRRREGSA-N 1 0 294.370 3.558 20 5 CHBDRO CC(C)[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1F ZINC001168982833 1129687242 /nfs/dbraw/zinc/68/72/42/1129687242.db2.gz JBWXQVGEIXGDOT-IOASZLSFSA-N 1 0 294.370 3.558 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc2ccccc2c1 ZINC001168967493 1129687630 /nfs/dbraw/zinc/68/76/30/1129687630.db2.gz QENDDRUNGZJTCV-DEYYWGMASA-N 1 0 298.386 3.936 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C)cc1C ZINC001168991542 1129688398 /nfs/dbraw/zinc/68/83/98/1129688398.db2.gz HHNOTUXQVYWQSN-BFYDXBDKSA-N 1 0 290.407 3.790 20 5 CHBDRO CC(C)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168968753 1129688523 /nfs/dbraw/zinc/68/85/23/1129688523.db2.gz AEYOMJJQYPXLLO-RISCZKNCSA-N 1 0 296.798 3.610 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001169001265 1129688616 /nfs/dbraw/zinc/68/86/16/1129688616.db2.gz FBEDHCMVGMYSBR-FVQBIDKESA-N 1 0 276.380 3.563 20 5 CHBDRO CCCCC1CCC([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168987283 1129690052 /nfs/dbraw/zinc/69/00/52/1129690052.db2.gz HXONJTIKRFXONM-GRAKBVBRSA-N 1 0 282.428 3.770 20 5 CHBDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169012542 1129690144 /nfs/dbraw/zinc/69/01/44/1129690144.db2.gz QXBXTIXSMMUYRF-UXLLHSPISA-N 1 0 288.391 3.577 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1Cl ZINC001168988647 1129690206 /nfs/dbraw/zinc/69/02/06/1129690206.db2.gz UADYFJYDKQNEFQ-JMSVASOKSA-N 1 0 296.798 3.826 20 5 CHBDRO CC[C@H](c1ccccc1)[N@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169040125 1129690463 /nfs/dbraw/zinc/69/04/63/1129690463.db2.gz YAXHZEHYVCNEAN-VNQPRFMTSA-N 1 0 276.380 3.515 20 5 CHBDRO C[N@H+](Cc1cccc2ccccc21)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169023261 1129691375 /nfs/dbraw/zinc/69/13/75/1129691375.db2.gz DVLVVPWEWHUEEV-YOEHRIQHSA-N 1 0 298.386 3.717 20 5 CHBDRO CC(C)[N@H+]([C@@H](C)c1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169048723 1129692072 /nfs/dbraw/zinc/69/20/72/1129692072.db2.gz AXLMVPHBFVVJNI-ZOBUZTSGSA-N 1 0 290.407 3.903 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001169334339 1129719296 /nfs/dbraw/zinc/71/92/96/1129719296.db2.gz XTJLEUXQTPSSMD-HOCLYGCPSA-N 1 0 276.380 3.995 20 5 CHBDRO [NH3+]Cc1ccn(-c2ccc(-c3ccc([N+](=O)[O-])cc3)cc2)c1 ZINC001169725869 1129748031 /nfs/dbraw/zinc/74/80/31/1129748031.db2.gz PQMLRJOVJFOBFP-UHFFFAOYSA-N 1 0 293.326 3.511 20 5 CHBDRO C[C@H](C1CCCCC1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001169734139 1129753615 /nfs/dbraw/zinc/75/36/15/1129753615.db2.gz RSAOERPZBAQUJR-CYBMUJFWSA-N 1 0 276.380 3.995 20 5 CHBDRO CC(C)[N@H+](Cc1ccoc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000768336999 1129852034 /nfs/dbraw/zinc/85/20/34/1129852034.db2.gz FUHRHPIWRSZSCA-UHFFFAOYSA-N 1 0 274.320 3.598 20 5 CHBDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000050564683 1129972170 /nfs/dbraw/zinc/97/21/70/1129972170.db2.gz XVKOUWJXNCMXHX-WDEREUQCSA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC12CCC2 ZINC000771464619 1129983044 /nfs/dbraw/zinc/98/30/44/1129983044.db2.gz POZUKPNCCJLQAR-LBPRGKRZSA-N 1 0 292.354 3.746 20 5 CHBDRO CNc1ccc(C)cc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000902653420 1130033936 /nfs/dbraw/zinc/03/39/36/1130033936.db2.gz DKCPPOLIBDUGCL-CYBMUJFWSA-N 1 0 299.374 3.796 20 5 CHBDRO C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@H]1C ZINC001461846912 1130060388 /nfs/dbraw/zinc/06/03/88/1130060388.db2.gz CXLYGYBDLRBHCU-QWRGUYRKSA-N 1 0 282.771 3.869 20 5 CHBDRO CCO[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000902999362 1130098013 /nfs/dbraw/zinc/09/80/13/1130098013.db2.gz BLSLTKNGWPRANH-DUVNUKRYSA-N 1 0 292.379 3.593 20 5 CHBDRO COc1cc([C@@H](C)[NH2+]CCC2(F)CCC2)cc([N+](=O)[O-])c1 ZINC000903169702 1130123200 /nfs/dbraw/zinc/12/32/00/1130123200.db2.gz DDAMKLLVLAXXQC-LLVKDONJSA-N 1 0 296.342 3.536 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])c1nccs1 ZINC000903244932 1130134703 /nfs/dbraw/zinc/13/47/03/1130134703.db2.gz GQAMQUXKKHZNRK-GHMZBOCLSA-N 1 0 291.376 3.506 20 5 CHBDRO Cc1cncc([C@H](C)[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000903245178 1130135485 /nfs/dbraw/zinc/13/54/85/1130135485.db2.gz JRZRMCTWXKQFIV-KBPBESRZSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1cncc([C@@H](C)[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000903245180 1130136059 /nfs/dbraw/zinc/13/60/59/1130136059.db2.gz JRZRMCTWXKQFIV-UONOGXRCSA-N 1 0 299.374 3.753 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH+](CC1CC1)CC1CC1 ZINC000746674386 1130146011 /nfs/dbraw/zinc/14/60/11/1130146011.db2.gz VUSRGRHEPLGPGI-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO CCO[C@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000903286583 1130146963 /nfs/dbraw/zinc/14/69/63/1130146963.db2.gz BLSLTKNGWPRANH-XPKDYRNWSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000903428003 1130176032 /nfs/dbraw/zinc/17/60/32/1130176032.db2.gz LOQJJMUHNQNJDW-SJKOYZFVSA-N 1 0 297.358 3.792 20 5 CHBDRO CCc1cccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC001170195923 1130461216 /nfs/dbraw/zinc/46/12/16/1130461216.db2.gz WHVUNQKMYQNAHH-UHFFFAOYSA-N 1 0 298.386 3.832 20 5 CHBDRO CC(C)Oc1ccc(O[C@H](C)C[N+](C)(C)C)cc1Cl ZINC001234210760 1130616394 /nfs/dbraw/zinc/61/63/94/1130616394.db2.gz OCNJEIAJUGAOLG-GFCCVEGCSA-N 1 0 286.823 3.601 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2CN1C[C@H]2C[C@@H](C1)[NH2+]2 ZINC001235413955 1130740727 /nfs/dbraw/zinc/74/07/27/1130740727.db2.gz BDMWSGUUMISSKB-CALCHBBNSA-N 1 0 288.394 3.539 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCCCCC2)cc1Cl ZINC000783506221 1130830893 /nfs/dbraw/zinc/83/08/93/1130830893.db2.gz FMVVBABFGXDMDL-UHFFFAOYSA-N 1 0 268.744 3.624 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1(C)CC1 ZINC000783601904 1130841913 /nfs/dbraw/zinc/84/19/13/1130841913.db2.gz YDMOXFCUBYWEBK-VIFPVBQESA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccsc1 ZINC000815624438 1131010294 /nfs/dbraw/zinc/01/02/94/1131010294.db2.gz YNOHFQZGZAPSAP-NXEZZACHSA-N 1 0 291.376 3.650 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000799193237 1131075915 /nfs/dbraw/zinc/07/59/15/1131075915.db2.gz MFESSYTUKCUMPJ-KGLIPLIRSA-N 1 0 297.358 3.540 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1C ZINC000816648859 1131120893 /nfs/dbraw/zinc/12/08/93/1131120893.db2.gz QCEQSVUZROAMKV-VXGBXAGGSA-N 1 0 286.331 3.695 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000824462635 1131471615 /nfs/dbraw/zinc/47/16/15/1131471615.db2.gz HYGWSOSUOXUPCS-LRDDRELGSA-N 1 0 297.358 3.718 20 5 CHBDRO CC[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000835032971 1131760646 /nfs/dbraw/zinc/76/06/46/1131760646.db2.gz AXOCCZNYTDDEPM-SSDOTTSWSA-N 1 0 277.151 3.790 20 5 CHBDRO C[C@H](C[NH+](C)C)Oc1cccc2cc3ccccc3nc21 ZINC001228175314 1131823259 /nfs/dbraw/zinc/82/32/59/1131823259.db2.gz BXUTUUIKQXPEEN-CYBMUJFWSA-N 1 0 280.371 3.717 20 5 CHBDRO Cc1nc(-c2ccc(O[C@@H](C)C[N+](C)(C)C)cc2)cs1 ZINC001228630955 1131923847 /nfs/dbraw/zinc/92/38/47/1131923847.db2.gz VBVAFCJIHOXRQI-LBPRGKRZSA-N 1 0 291.440 3.592 20 5 CHBDRO C[C@@H](Cc1ccco1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036993671 1131986166 /nfs/dbraw/zinc/98/61/66/1131986166.db2.gz HXEBJRHVRQOLLJ-JTQLQIEISA-N 1 0 294.738 3.562 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000037011422 1131987705 /nfs/dbraw/zinc/98/77/05/1131987705.db2.gz NYOKDCVPJDXYHB-YWPYICTPSA-N 1 0 292.379 3.518 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)C1CCC1 ZINC000324675541 1132149719 /nfs/dbraw/zinc/14/97/19/1132149719.db2.gz MFFRRQXNYXZRHU-OAHLLOKOSA-N 1 0 276.380 3.962 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH+]1CC2(COC2)C1 ZINC001141722577 1132239061 /nfs/dbraw/zinc/23/90/61/1132239061.db2.gz DLMUGZWRJZMBBY-UHFFFAOYSA-N 1 0 289.378 3.825 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[N@@H+]1CCO[C@@H]2C[C@@H]21 ZINC001141728142 1132241870 /nfs/dbraw/zinc/24/18/70/1132241870.db2.gz NHASEEKMGNJMMH-VQTJNVASSA-N 1 0 289.378 3.966 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1C=CCCC1)CC2 ZINC001172903130 1132347297 /nfs/dbraw/zinc/34/72/97/1132347297.db2.gz FFSVROCYICKUFB-HZPDHXFCSA-N 1 0 286.375 3.541 20 5 CHBDRO C[C@H]1CCC[C@H]1[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172896026 1132359516 /nfs/dbraw/zinc/35/95/16/1132359516.db2.gz LCAFEBGTDLUGTD-XGWLTEMNSA-N 1 0 288.391 3.620 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911558 1132371606 /nfs/dbraw/zinc/37/16/06/1132371606.db2.gz JPGZYCCXOCTCNH-IUODEOHRSA-N 1 0 276.380 3.620 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC001173222505 1132411222 /nfs/dbraw/zinc/41/12/22/1132411222.db2.gz SMLROWCUTQZBTF-FVQBIDKESA-N 1 0 288.391 3.648 20 5 CHBDRO Cc1cccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173217279 1132411608 /nfs/dbraw/zinc/41/16/08/1132411608.db2.gz RKXVEXRZKJLXNQ-AWEZNQCLSA-N 1 0 284.359 3.624 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(C)CC(F)(F)C1 ZINC001173219186 1132411679 /nfs/dbraw/zinc/41/16/79/1132411679.db2.gz YORQLTRBRDBAQA-LLVKDONJSA-N 1 0 298.333 3.551 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@](C)(F)C1 ZINC001173221385 1132411866 /nfs/dbraw/zinc/41/18/66/1132411866.db2.gz HWZZSYPPQUDEEH-XJKSGUPXSA-N 1 0 294.370 3.740 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@H](C)C1 ZINC001173226050 1132412790 /nfs/dbraw/zinc/41/27/90/1132412790.db2.gz KXAXSWUDWPDTLK-KBPBESRZSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC(F)(F)CC1 ZINC001173228927 1132412909 /nfs/dbraw/zinc/41/29/09/1132412909.db2.gz NSHYUCTUIZHGPS-GFCCVEGCSA-N 1 0 298.333 3.647 20 5 CHBDRO CC(C)[C@@H]1CCC[N@@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230995 1132413712 /nfs/dbraw/zinc/41/37/12/1132413712.db2.gz IBGJWAJHBUDISM-CJNGLKHVSA-N 1 0 276.380 3.646 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173235408 1132414889 /nfs/dbraw/zinc/41/48/89/1132414889.db2.gz WSAJJNBAMKFIAF-DZGCQCFKSA-N 1 0 276.380 3.790 20 5 CHBDRO Cc1cccc(C)c1C[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173236234 1132416036 /nfs/dbraw/zinc/41/60/36/1132416036.db2.gz ZAGBQEFNTJUUGB-OAHLLOKOSA-N 1 0 298.386 3.932 20 5 CHBDRO Cc1cccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1C ZINC001173214230 1132416111 /nfs/dbraw/zinc/41/61/11/1132416111.db2.gz NOXLISDAUQMDPH-AWEZNQCLSA-N 1 0 298.386 3.932 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(F)CCCCC1 ZINC001173211408 1132416258 /nfs/dbraw/zinc/41/62/58/1132416258.db2.gz RRDWBXDONCHUQO-CYBMUJFWSA-N 1 0 294.370 3.788 20 5 CHBDRO CC[NH2+]Cc1cccc(Nc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC001159962251 1132929491 /nfs/dbraw/zinc/92/94/91/1132929491.db2.gz KGUJDLHROHZOPP-UHFFFAOYSA-N 1 0 289.310 3.587 20 5 CHBDRO C[C@@H](C[NH+](C)C)Nc1ccc(-c2ccc([N+](=O)[O-])cc2)cc1 ZINC001163782223 1133174532 /nfs/dbraw/zinc/17/45/32/1133174532.db2.gz CWKQUBWMXHBMEH-ZDUSSCGKSA-N 1 0 299.374 3.624 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC2=CCCC2)cc1[N+](=O)[O-] ZINC001203188823 1133304867 /nfs/dbraw/zinc/30/48/67/1133304867.db2.gz XZVCMEDDVMYBAZ-UHFFFAOYSA-N 1 0 274.364 3.918 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCCC12CC2 ZINC001203331859 1133315809 /nfs/dbraw/zinc/31/58/09/1133315809.db2.gz IQGACTUXOQUYSS-DDKJEQMHSA-N 1 0 286.375 3.920 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCc1ccc(C(C)(C)C)cc1 ZINC001204680988 1133475501 /nfs/dbraw/zinc/47/55/01/1133475501.db2.gz PDLQBXRWRSSOJC-CQSZACIVSA-N 1 0 264.433 3.595 20 5 CHBDRO C=C/C=C/CC[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC001207372939 1133796039 /nfs/dbraw/zinc/79/60/39/1133796039.db2.gz WMIAAJJNCBXLEN-NNTXTVRGSA-N 1 0 274.364 3.638 20 5 CHBDRO C[C@H](Cc1ccsc1)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000176444851 1134470056 /nfs/dbraw/zinc/47/00/56/1134470056.db2.gz VTFXQNQCNDTBBF-SNVBAGLBSA-N 1 0 296.417 3.781 20 5 CHBDRO C[C@@H]1C[C@H](Oc2cccc3ccc4cccnc4c32)C[NH2+]1 ZINC001218045806 1135048873 /nfs/dbraw/zinc/04/88/73/1135048873.db2.gz GLACNTLBIYHWIL-DOMZBBRYSA-N 1 0 278.355 3.517 20 5 CHBDRO C[C@H]1C[C@H](Oc2nc3ccccc3c3ccccc32)CC[NH2+]1 ZINC001218056855 1135051487 /nfs/dbraw/zinc/05/14/87/1135051487.db2.gz PQSYBPAKQVGDQX-UONOGXRCSA-N 1 0 292.382 3.907 20 5 CHBDRO c1ccc2c(c1)nc(O[C@H]1CCC[NH2+]C1)c1ccccc21 ZINC001218281781 1135077895 /nfs/dbraw/zinc/07/78/95/1135077895.db2.gz JXLDTZJBMYVGIX-ZDUSSCGKSA-N 1 0 278.355 3.519 20 5 CHBDRO C[C@H]1CC[C@@H](Oc2cccc3cc4ccccc4nc32)C[NH2+]1 ZINC001218401080 1135099284 /nfs/dbraw/zinc/09/92/84/1135099284.db2.gz XZFPCBYTZPAQJQ-XJKSGUPXSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H]1C[NH2+]CC[C@H]1Oc1cccc2ccc3cccnc3c21 ZINC001218419719 1135102071 /nfs/dbraw/zinc/10/20/71/1135102071.db2.gz OXYJVOJWCQVXTN-XJKSGUPXSA-N 1 0 292.382 3.765 20 5 CHBDRO c1ccc2c(c1)nc(O[C@@H]1C[C@@H]3CC[C@H]1[NH2+]3)c1ccccc21 ZINC001218474188 1135111213 /nfs/dbraw/zinc/11/12/13/1135111213.db2.gz IJJJOMMQFFEGDD-JBBXEZCESA-N 1 0 290.366 3.660 20 5 CHBDRO CC(C)[N@@H+]1CCC[C@@H](O[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC001223428017 1135345093 /nfs/dbraw/zinc/34/50/93/1135345093.db2.gz YSSXLPJBVAOMDR-CZUORRHYSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@@H](O[C@@H](C)C[N+](C)(C)C)c1ccc(Cl)cc1 ZINC001223961552 1135403047 /nfs/dbraw/zinc/40/30/47/1135403047.db2.gz BIJJGBHZVAMMOA-NWDGAFQWSA-N 1 0 256.797 3.512 20 5 CHBDRO C[N+](C)(C)CCCO[C@H]1CCCC[C@@H]1c1ccccc1 ZINC001224621104 1135462395 /nfs/dbraw/zinc/46/23/95/1135462395.db2.gz MDMJDQGXKHPLTN-MSOLQXFVSA-N 1 0 276.444 3.826 20 5 CHBDRO CCCC[C@@H](OCC[N+](C)(C)C)c1ccccc1 ZINC001224773229 1135480408 /nfs/dbraw/zinc/48/04/08/1135480408.db2.gz GNJUHJDYKTUTAQ-MRXNPFEDSA-N 1 0 250.406 3.641 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc(Nc2ccccc2)c1 ZINC001225232858 1135520931 /nfs/dbraw/zinc/52/09/31/1135520931.db2.gz XMGNKPMAPBXEEB-OAHLLOKOSA-N 1 0 285.411 3.904 20 5 CHBDRO Cc1cc(O[C@@H](C)C[N+](C)(C)C)nc2ccc(Cl)cc12 ZINC001226519687 1135707776 /nfs/dbraw/zinc/70/77/76/1135707776.db2.gz DJHCVJZBQVIVDE-LBPRGKRZSA-N 1 0 293.818 3.670 20 5 CHBDRO C[C@@H](C[NH+](C)C)Oc1nc2ccccc2c2ccccc21 ZINC001226992083 1135772014 /nfs/dbraw/zinc/77/20/14/1135772014.db2.gz HTVAVUXHJFNBSH-ZDUSSCGKSA-N 1 0 280.371 3.717 20 5 CHBDRO C[N@@H+]1CCC[C@@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001226992500 1135772417 /nfs/dbraw/zinc/77/24/17/1135772417.db2.gz KVHBWRZRWNGRBS-CQSZACIVSA-N 1 0 292.382 3.861 20 5 CHBDRO Cc1ccc(O[C@@H](C)C[N+](C)(C)C)c(C(C)(C)C)c1 ZINC001227449843 1135835503 /nfs/dbraw/zinc/83/55/03/1135835503.db2.gz IDAUXXLKZIHLER-AWEZNQCLSA-N 1 0 264.433 3.766 20 5 CHBDRO CCc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000352761597 529650699 /nfs/dbraw/zinc/65/06/99/529650699.db2.gz CFTDQKGDSJVCQS-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000573749728 334963607 /nfs/dbraw/zinc/96/36/07/334963607.db2.gz XHVGZGLDXYUQNW-CFVMTHIKSA-N 1 0 276.380 3.988 20 5 CHBDRO CC1CCC([N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000336839504 335049645 /nfs/dbraw/zinc/04/96/45/335049645.db2.gz OSJFZGMNLMVTET-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000519968897 260035535 /nfs/dbraw/zinc/03/55/35/260035535.db2.gz UFZFOHOFEHLEQK-SWLSCSKDSA-N 1 0 276.380 3.914 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000020085774 170987513 /nfs/dbraw/zinc/98/75/13/170987513.db2.gz QUJCZGFIMWSGEE-SMDDNHRTSA-N 1 0 250.342 3.824 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C(C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000020131480 171020280 /nfs/dbraw/zinc/02/02/80/171020280.db2.gz CCXYKKUBJCRXGH-NSHDSACASA-N 1 0 274.364 3.742 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000020148564 171036747 /nfs/dbraw/zinc/03/67/47/171036747.db2.gz GDPMMVKZMSIAPN-SNVBAGLBSA-N 1 0 262.334 3.507 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1 ZINC000020205129 171070221 /nfs/dbraw/zinc/07/02/21/171070221.db2.gz IIPGWCOFQNSIDB-XHDPSFHLSA-N 1 0 286.331 3.916 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)Cc2cccs2)cc1[N+](=O)[O-] ZINC000035254185 172084274 /nfs/dbraw/zinc/08/42/74/172084274.db2.gz KNTLLPSPNMLHFT-LBPRGKRZSA-N 1 0 290.388 3.686 20 5 CHBDRO CCC[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035368076 172159443 /nfs/dbraw/zinc/15/94/43/172159443.db2.gz NZUSDTVLTPTVFM-VIFPVBQESA-N 1 0 256.733 3.526 20 5 CHBDRO C[C@@H]1CCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000071206252 176080071 /nfs/dbraw/zinc/08/00/71/176080071.db2.gz CWMUWGJMBNBQNS-NOZJJQNGSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000347388957 226144620 /nfs/dbraw/zinc/14/46/20/226144620.db2.gz UKWRHUKWMYEBKV-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H]2C2CCC2)c(F)c1 ZINC000352043303 228176834 /nfs/dbraw/zinc/17/68/34/228176834.db2.gz BZDBYXWMFMKVNH-OAHLLOKOSA-N 1 0 296.317 3.638 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C(C2CCC2)C2CCC2)cc1 ZINC000312460223 260044739 /nfs/dbraw/zinc/04/47/39/260044739.db2.gz AOAOLURKGQWOHS-UHFFFAOYSA-N 1 0 274.364 3.653 20 5 CHBDRO CCSCC[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000080530542 260181146 /nfs/dbraw/zinc/18/11/46/260181146.db2.gz PSWNEEZPXJGILY-GFCCVEGCSA-N 1 0 282.409 3.525 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000090217511 260339193 /nfs/dbraw/zinc/33/91/93/260339193.db2.gz PABXHQSJWYANCN-VHRBIJSZSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000045628922 260652322 /nfs/dbraw/zinc/65/23/22/260652322.db2.gz QEKGOSMBTWPCKP-BBRMVZONSA-N 1 0 274.364 3.992 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000449058652 261137897 /nfs/dbraw/zinc/13/78/97/261137897.db2.gz LAEPCUOFTIRLRV-WCQYABFASA-N 1 0 288.347 3.778 20 5 CHBDRO Cc1cc(NCCc2ccco2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302177724 261349661 /nfs/dbraw/zinc/34/96/61/261349661.db2.gz NFZONNUFIHQWNC-UHFFFAOYSA-N 1 0 297.314 3.699 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000185935057 262072399 /nfs/dbraw/zinc/07/23/99/262072399.db2.gz CDXWUXYWJRUKRL-HNNXBMFYSA-N 1 0 285.347 3.621 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000411697401 262704349 /nfs/dbraw/zinc/70/43/49/262704349.db2.gz RKZQKSGRXVGQAB-QZTJIDSGSA-N 1 0 296.370 3.625 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000414584956 263000510 /nfs/dbraw/zinc/00/05/10/263000510.db2.gz NHFMAKXRJQRAFT-YHTPHNNESA-N 1 0 298.342 3.737 20 5 CHBDRO Cc1cc(NC2CC(F)(F)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000276996625 263038949 /nfs/dbraw/zinc/03/89/49/263038949.db2.gz HHWOTWKRXXQXFC-UHFFFAOYSA-N 1 0 293.273 3.661 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000280756434 263064146 /nfs/dbraw/zinc/06/41/46/263064146.db2.gz CEUCLJYDCWKKHB-MNOVXSKESA-N 1 0 284.306 3.681 20 5 CHBDRO COC1(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CCC1 ZINC000293864228 263151301 /nfs/dbraw/zinc/15/13/01/263151301.db2.gz ZDWGJXMYMNYUQP-ZDUSSCGKSA-N 1 0 292.379 3.513 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1cccc([N+](=O)[O-])c1 ZINC000187848209 263271671 /nfs/dbraw/zinc/27/16/71/263271671.db2.gz AYOBKFLYDBEJBR-LSDHHAIUSA-N 1 0 292.379 3.593 20 5 CHBDRO CCC(C)(C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000189994309 264345053 /nfs/dbraw/zinc/34/50/53/264345053.db2.gz KHYIODNDLZOGRC-NSHDSACASA-N 1 0 250.342 3.682 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1c2ccccc2O[C@@H]1C ZINC000367402350 267072101 /nfs/dbraw/zinc/07/21/01/267072101.db2.gz QWYDVUYDCVCCPG-SJKOYZFVSA-N 1 0 298.342 3.515 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000537980706 327660432 /nfs/dbraw/zinc/66/04/32/327660432.db2.gz JIYFDCMVIVNFKC-CYZMBNFOSA-N 1 0 264.369 3.988 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000062726296 327894531 /nfs/dbraw/zinc/89/45/31/327894531.db2.gz IHJURCNXVWKUFB-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO Cc1cc(N[C@@H]2CC=CCC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000228485340 327921198 /nfs/dbraw/zinc/92/11/98/327921198.db2.gz YAZVRPKYFHVXKQ-GFCCVEGCSA-N 1 0 283.331 3.972 20 5 CHBDRO C[C@H]1CCC[C@@](CNc2ccc([N+](=O)[O-])cc2)([NH+](C)C)C1 ZINC000040670116 328015252 /nfs/dbraw/zinc/01/52/52/328015252.db2.gz IFJDXORXWCNCBL-XJKSGUPXSA-N 1 0 291.395 3.517 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000040675996 328015512 /nfs/dbraw/zinc/01/55/12/328015512.db2.gz NXQRFSWTIKPRIN-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO CCCC(CCC)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000040675903 328015533 /nfs/dbraw/zinc/01/55/33/328015533.db2.gz GGDAHSUOCZPBCD-UHFFFAOYSA-N 1 0 264.369 3.696 20 5 CHBDRO CC(C)=CCC[C@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000531704578 328026536 /nfs/dbraw/zinc/02/65/36/328026536.db2.gz KOBHNLVUPXNTBJ-AWEZNQCLSA-N 1 0 276.380 3.862 20 5 CHBDRO CCCC[C@@H](COC)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000531714528 328028123 /nfs/dbraw/zinc/02/81/23/328028123.db2.gz BAZKTQRUAARKFU-KGLIPLIRSA-N 1 0 294.395 3.759 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCCC3)s2)cc1 ZINC000534329877 328046288 /nfs/dbraw/zinc/04/62/88/328046288.db2.gz SJJSDHQXGHJRTA-UHFFFAOYSA-N 1 0 288.372 3.919 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000534349896 328047572 /nfs/dbraw/zinc/04/75/72/328047572.db2.gz TYRYPIPPVLYICI-LBPRGKRZSA-N 1 0 264.369 3.770 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc2C1 ZINC000303512434 328352725 /nfs/dbraw/zinc/35/27/25/328352725.db2.gz BOKDKNRIWOCWDL-SFHVURJKSA-N 1 0 296.370 3.584 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000049577399 328372604 /nfs/dbraw/zinc/37/26/04/328372604.db2.gz XQWMJCSGANIWPR-JTQLQIEISA-N 1 0 292.285 3.724 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H](c2cccs2)C2CC2)c1 ZINC000049956811 328379788 /nfs/dbraw/zinc/37/97/88/328379788.db2.gz BUDMQIKYOSCIDN-HNNXBMFYSA-N 1 0 288.372 3.897 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000050015515 328381923 /nfs/dbraw/zinc/38/19/23/328381923.db2.gz ZIDJGAPKMGMXCC-RYUDHWBXSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)Cc1ccncc1 ZINC000531993920 328386260 /nfs/dbraw/zinc/38/62/60/328386260.db2.gz LTGNZJCURDDEPB-KGLIPLIRSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H](CC1CC1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000070102513 328393098 /nfs/dbraw/zinc/39/30/98/328393098.db2.gz GVPJWKNJOYFWBN-SECBINFHSA-N 1 0 268.744 3.526 20 5 CHBDRO CCC[NH+]1CCC(Nc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000050352203 328398157 /nfs/dbraw/zinc/39/81/57/328398157.db2.gz NKGMXXCQAZZTIM-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO C[C@@]1(c2ccccc2)CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532038688 328396925 /nfs/dbraw/zinc/39/69/25/328396925.db2.gz XUCGICOLXWAWFJ-GOSISDBHSA-N 1 0 296.370 3.758 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H]1CC[C@H](C)O1)c1cccc([N+](=O)[O-])c1 ZINC000398103847 326871506 /nfs/dbraw/zinc/87/15/06/326871506.db2.gz YMTGNGUBTZSOTD-RCBQFDQVSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)C2CCC2)cc1[N+](=O)[O-] ZINC000398183689 326873608 /nfs/dbraw/zinc/87/36/08/326873608.db2.gz UJRXIGFOIGUCKE-UHFFFAOYSA-N 1 0 262.353 3.572 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CSc3ccccc32)c1 ZINC000083748828 326937675 /nfs/dbraw/zinc/93/76/75/326937675.db2.gz MRYOBCGWGLXRAK-CQSZACIVSA-N 1 0 286.356 3.531 20 5 CHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000557462429 327006797 /nfs/dbraw/zinc/00/67/97/327006797.db2.gz AFUYPZCFELLJNN-YHAOYDPOSA-N 1 0 282.343 3.959 20 5 CHBDRO C[N@@H+](C/C=C\c1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000558737086 327118450 /nfs/dbraw/zinc/11/84/50/327118450.db2.gz WZHJJZJUCZQUJC-POHAHGRESA-N 1 0 296.370 3.783 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000558972850 327135591 /nfs/dbraw/zinc/13/55/91/327135591.db2.gz ZDAMJTBVYQYLEI-KKXDTOCCSA-N 1 0 296.370 3.877 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCCC23CCCC3)c1 ZINC000559790447 327261477 /nfs/dbraw/zinc/26/14/77/327261477.db2.gz XFDMRSRTXVMBQJ-MRXNPFEDSA-N 1 0 288.391 3.840 20 5 CHBDRO CC[C@H](C)[C@@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)OC ZINC000560348530 327301660 /nfs/dbraw/zinc/30/16/60/327301660.db2.gz OECVJIAIGODADN-NORZTCDRSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCCC1(F)F ZINC000560351035 327302271 /nfs/dbraw/zinc/30/22/71/327302271.db2.gz DATXZYZZWVYZJO-RYUDHWBXSA-N 1 0 298.333 3.989 20 5 CHBDRO CCC(C)(C)OCC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000562567615 327494681 /nfs/dbraw/zinc/49/46/81/327494681.db2.gz OIDRFQKRHPKKDD-ZDUSSCGKSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000300305556 332812073 /nfs/dbraw/zinc/81/20/73/332812073.db2.gz DPRWHOJWFAZFDI-MBNYWOFBSA-N 1 0 262.353 3.682 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000532198008 328704825 /nfs/dbraw/zinc/70/48/25/328704825.db2.gz PFZCHTLYDOUUHW-MRXNPFEDSA-N 1 0 288.347 3.780 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CC=CCC1 ZINC000532208852 328707315 /nfs/dbraw/zinc/70/73/15/328707315.db2.gz AOBQAWQQGDAKKR-UONOGXRCSA-N 1 0 274.364 3.910 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C2CC2)C2CCC2)cc1[N+](=O)[O-] ZINC000324721188 328786445 /nfs/dbraw/zinc/78/64/45/328786445.db2.gz YHRFHDZCGYTYHL-INIZCTEOSA-N 1 0 274.364 3.572 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C2CC2)C2CCC2)cc1[N+](=O)[O-] ZINC000324721189 328786455 /nfs/dbraw/zinc/78/64/55/328786455.db2.gz YHRFHDZCGYTYHL-MRXNPFEDSA-N 1 0 274.364 3.572 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCc2ccccc2CC1 ZINC000532586250 328791259 /nfs/dbraw/zinc/79/12/59/328791259.db2.gz WYQDZMUSJZBNHU-CQSZACIVSA-N 1 0 296.370 3.757 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc(F)cc3)CC2)cc1 ZINC000532721818 328807380 /nfs/dbraw/zinc/80/73/80/328807380.db2.gz UVPXNIJRWSREJP-UHFFFAOYSA-N 1 0 286.306 3.513 20 5 CHBDRO CSC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000193804187 329063050 /nfs/dbraw/zinc/06/30/50/329063050.db2.gz LEJURAHYSXLUNL-LLVKDONJSA-N 1 0 280.393 3.531 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1C[C@H]1C ZINC000321714462 329393260 /nfs/dbraw/zinc/39/32/60/329393260.db2.gz VQQIVOGQCCWIIR-FKGLVLAHSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000050345064 329647132 /nfs/dbraw/zinc/64/71/32/329647132.db2.gz UOXXBTIWPOKQIB-SNVBAGLBSA-N 1 0 262.334 3.507 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000421870638 330100194 /nfs/dbraw/zinc/10/01/94/330100194.db2.gz FTFLOKVPTQWBOL-DOMZBBRYSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000433035691 330128479 /nfs/dbraw/zinc/12/84/79/330128479.db2.gz NRGAOLBONJSEKA-RISCZKNCSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1c(C[NH2+]CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000035648908 330248448 /nfs/dbraw/zinc/24/84/48/330248448.db2.gz SKDBHAKDEHLIQF-UHFFFAOYSA-N 1 0 262.353 3.573 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H](c2cccs2)C2CC2)cs1 ZINC000537213117 330419737 /nfs/dbraw/zinc/41/97/37/330419737.db2.gz QZAPFPXCWWKKGV-ZDUSSCGKSA-N 1 0 294.401 3.959 20 5 CHBDRO CC[C@@H]([NH2+]CC1(OC)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000315466518 330475959 /nfs/dbraw/zinc/47/59/59/330475959.db2.gz LGHWSNTWBSBTFN-OAHLLOKOSA-N 1 0 292.379 3.595 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H]1CCCc2ccccc21 ZINC000315506511 330476731 /nfs/dbraw/zinc/47/67/31/330476731.db2.gz CSGATIMNYBOGAS-KRWDZBQOSA-N 1 0 296.370 3.805 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1cccs1 ZINC000430204355 330563918 /nfs/dbraw/zinc/56/39/18/330563918.db2.gz HILHRVCPQTWYRC-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO CC[C@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144262 330618151 /nfs/dbraw/zinc/61/81/51/330618151.db2.gz BPPFHBLVBHHZND-HZMBPMFUSA-N 1 0 262.353 3.705 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC(C)(C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000434754618 330644273 /nfs/dbraw/zinc/64/42/73/330644273.db2.gz GKLVNFIZQSNVFV-WCQYABFASA-N 1 0 292.379 3.518 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@@H](C)C1 ZINC000437044211 330691787 /nfs/dbraw/zinc/69/17/87/330691787.db2.gz LEZLCPZIOFNTQM-VNHYZAJKSA-N 1 0 276.380 3.694 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC13CCCC3)CCC2 ZINC000447598871 330872922 /nfs/dbraw/zinc/87/29/22/330872922.db2.gz IODNHCUPKCBYCP-CVEARBPZSA-N 1 0 286.375 3.895 20 5 CHBDRO Cc1ccc(CCC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000449347127 330916773 /nfs/dbraw/zinc/91/67/73/330916773.db2.gz FOHUIOIYVSWHQU-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000449740033 330947509 /nfs/dbraw/zinc/94/75/09/330947509.db2.gz DFOMSGTYDCVKOY-KCXAZCMYSA-N 1 0 288.391 3.552 20 5 CHBDRO CC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccsc1 ZINC000453166896 331096344 /nfs/dbraw/zinc/09/63/44/331096344.db2.gz CZTPLEZJDRWFMV-HNNXBMFYSA-N 1 0 290.388 3.940 20 5 CHBDRO CC[C@H](N[C@@H](CC)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000453242963 331106383 /nfs/dbraw/zinc/10/63/83/331106383.db2.gz IRHHIWFCRJWPGM-RYUDHWBXSA-N 1 0 272.295 3.679 20 5 CHBDRO CCC[C@H]([NH2+]C1CC(C)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000453258511 331108403 /nfs/dbraw/zinc/10/84/03/331108403.db2.gz WIRUHWCHJZWSIM-BLZCZZARSA-N 1 0 280.343 3.916 20 5 CHBDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000453419504 331130539 /nfs/dbraw/zinc/13/05/39/331130539.db2.gz VOYIYCDECDYCTB-BZUAXINKSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459753330 331298552 /nfs/dbraw/zinc/29/85/52/331298552.db2.gz IXUAMFVRXHDKKV-DMRZNYOFSA-N 1 0 288.391 3.694 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000166565853 331307369 /nfs/dbraw/zinc/30/73/69/331307369.db2.gz QBAAKKLDBBGGQJ-OAHLLOKOSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])C(C)(C)C ZINC000464488464 331361393 /nfs/dbraw/zinc/36/13/93/331361393.db2.gz ASSGAQSDXGOOTH-AWEZNQCLSA-N 1 0 298.358 3.657 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@@H](C)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000464815902 331369322 /nfs/dbraw/zinc/36/93/22/331369322.db2.gz VIWAXFUZDCPGQG-RYUDHWBXSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]1CC[C@H](C)C[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464822215 331369866 /nfs/dbraw/zinc/36/98/66/331369866.db2.gz KXGIUFYLDKHJPN-WDEREUQCSA-N 1 0 282.771 3.869 20 5 CHBDRO CCSCC[C@H](C)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000464856936 331371485 /nfs/dbraw/zinc/37/14/85/331371485.db2.gz MZGSJBROOSATMV-ZDUSSCGKSA-N 1 0 296.436 3.601 20 5 CHBDRO C[C@@H]1CCC[C@H]1C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000466421677 331396314 /nfs/dbraw/zinc/39/63/14/331396314.db2.gz NOVHKMMSOOFAOL-JSHITJIMSA-N 1 0 274.364 3.634 20 5 CHBDRO CC1=CCC[C@@H](C)[C@H]1C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468003095 331426539 /nfs/dbraw/zinc/42/65/39/331426539.db2.gz HPPIDHCTGHWSSP-ZBFHGGJFSA-N 1 0 288.391 3.719 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C(C)C ZINC000468656647 331438407 /nfs/dbraw/zinc/43/84/07/331438407.db2.gz YNQUSVGTUARFFA-MQJVFOOVSA-N 1 0 276.380 3.880 20 5 CHBDRO CC[NH+](CC)CCSc1ccc(Cl)cc1[N+](=O)[O-] ZINC000471520269 331509831 /nfs/dbraw/zinc/50/98/31/331509831.db2.gz CRZMTARXTVERCX-UHFFFAOYSA-N 1 0 288.800 3.682 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC12CCCC2)c1ccccc1[N+](=O)[O-] ZINC000474042292 331564825 /nfs/dbraw/zinc/56/48/25/331564825.db2.gz DKINFOVNNLEIEP-IUODEOHRSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000474066803 331567222 /nfs/dbraw/zinc/56/72/22/331567222.db2.gz QRNSKDPJSCAYFA-NSHDSACASA-N 1 0 298.333 3.898 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CC[C@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000510991652 332923062 /nfs/dbraw/zinc/92/30/62/332923062.db2.gz JOSPKFCZWTUESP-LSDHHAIUSA-N 1 0 274.364 3.572 20 5 CHBDRO CC(C)=CCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000479301019 331723393 /nfs/dbraw/zinc/72/33/93/331723393.db2.gz OWUDJOCPHSPPCU-ZDUSSCGKSA-N 1 0 262.353 3.910 20 5 CHBDRO CC(C)=CCC[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000480301741 331766964 /nfs/dbraw/zinc/76/69/64/331766964.db2.gz QNBPOTKQQLBDFG-RMKNXTFCSA-N 1 0 260.337 3.554 20 5 CHBDRO COc1cc(C[NH2+][C@@H]2CC[C@H](C)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000481171556 331799735 /nfs/dbraw/zinc/79/97/35/331799735.db2.gz FHYKBECNDNCWBU-SGMGOOAPSA-N 1 0 292.379 3.518 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000481185839 331800633 /nfs/dbraw/zinc/80/06/33/331800633.db2.gz FLQIULXFETZTBM-ZIAGYGMSSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1cccc2c1CC[C@H]2[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000482512111 331836121 /nfs/dbraw/zinc/83/61/21/331836121.db2.gz QYYMTQHPYOHAEN-GOSISDBHSA-N 1 0 296.370 3.723 20 5 CHBDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000483750494 331884308 /nfs/dbraw/zinc/88/43/08/331884308.db2.gz VLVAQAJOBINXLN-XNRPHZJLSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](C)C(C)C)cccc1[N+](=O)[O-] ZINC000484183358 331893735 /nfs/dbraw/zinc/89/37/35/331893735.db2.gz ZVAPDWYKELRFHE-YPMHNXCESA-N 1 0 264.369 3.846 20 5 CHBDRO Cc1cscc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000487183449 331958529 /nfs/dbraw/zinc/95/85/29/331958529.db2.gz DCHLGQLVZXDLMB-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C/C=C\c2ccncc2)cc1[N+](=O)[O-] ZINC000487279389 331962546 /nfs/dbraw/zinc/96/25/46/331962546.db2.gz VSVUIMQWWFOJTM-VQTKUKTRSA-N 1 0 297.358 3.662 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CS[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000488541573 332016448 /nfs/dbraw/zinc/01/64/48/332016448.db2.gz IHQTULRRNPVSSC-DZGCQCFKSA-N 1 0 294.420 3.523 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CC(C)(C)C ZINC000489142078 332042107 /nfs/dbraw/zinc/04/21/07/332042107.db2.gz UVGUAEXOOWXDCC-LBPRGKRZSA-N 1 0 264.369 3.942 20 5 CHBDRO COc1cc(C[N@H+](C(C)C)C2CCCC2)ccc1[N+](=O)[O-] ZINC000490006781 332076356 /nfs/dbraw/zinc/07/63/56/332076356.db2.gz UPNGUIHQBCYQPC-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO CCCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000490823266 332118048 /nfs/dbraw/zinc/11/80/48/332118048.db2.gz SNWXEOVXLIOYBT-UHFFFAOYSA-N 1 0 262.353 3.749 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1(C)CC1 ZINC000495379492 332516389 /nfs/dbraw/zinc/51/63/89/332516389.db2.gz KPYJSXFGBHDHRL-SNVBAGLBSA-N 1 0 282.771 3.569 20 5 CHBDRO CCCCC[NH2+][C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000504927214 332725325 /nfs/dbraw/zinc/72/53/25/332725325.db2.gz NTVFKEHLBPUMKN-LBPRGKRZSA-N 1 0 280.368 3.834 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000505640171 332747819 /nfs/dbraw/zinc/74/78/19/332747819.db2.gz YEFHRARDNQWLFF-XJKSGUPXSA-N 1 0 296.370 3.975 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1cccc(C)c1[N+](=O)[O-] ZINC000218824454 333136677 /nfs/dbraw/zinc/13/66/77/333136677.db2.gz JUNFIGUNXWKHDI-CQSZACIVSA-N 1 0 293.411 3.826 20 5 CHBDRO CC(C)C(C)(C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000219272374 333145929 /nfs/dbraw/zinc/14/59/29/333145929.db2.gz RJCOQIXFHPQCLX-LBPRGKRZSA-N 1 0 264.369 3.928 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000219473972 333150562 /nfs/dbraw/zinc/15/05/62/333150562.db2.gz OFZIRFCCNNPEJZ-TZMCWYRMSA-N 1 0 276.380 3.819 20 5 CHBDRO C[C@@H](CCC1CC1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000186279690 333157874 /nfs/dbraw/zinc/15/78/74/333157874.db2.gz XXQRPZCEKZCFFX-RYUDHWBXSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc(C[NH2+]CCCC2CCCC2)cc1[N+](=O)[O-] ZINC000220720887 333168572 /nfs/dbraw/zinc/16/85/72/333168572.db2.gz MCOWVGNEPBHNFS-UHFFFAOYSA-N 1 0 276.380 3.963 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@](C)(O)CCC)c1cccc([N+](=O)[O-])c1 ZINC000223508172 333208733 /nfs/dbraw/zinc/20/87/33/333208733.db2.gz RJXKLOKIEUIVBP-HOTGVXAUSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000522046688 333231598 /nfs/dbraw/zinc/23/15/98/333231598.db2.gz DWXOHDHFIUCIPT-AAEUAGOBSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000226165295 333252251 /nfs/dbraw/zinc/25/22/51/333252251.db2.gz OOJRRGUPKLBNIY-MBNYWOFBSA-N 1 0 262.353 3.509 20 5 CHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000522268114 333277022 /nfs/dbraw/zinc/27/70/22/333277022.db2.gz QZCOESKULBKTHR-QGZVFWFLSA-N 1 0 296.370 3.584 20 5 CHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522466260 333287406 /nfs/dbraw/zinc/28/74/06/333287406.db2.gz IGCYBEARAOFYAP-RHSMWYFYSA-N 1 0 296.370 3.973 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CCCC2CC2)cc1[N+](=O)[O-] ZINC000522963516 333301804 /nfs/dbraw/zinc/30/18/04/333301804.db2.gz ZDQDTXZXNAZYRO-UHFFFAOYSA-N 1 0 276.380 3.998 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)c2cccs2)cc1[N+](=O)[O-] ZINC000523974988 333350482 /nfs/dbraw/zinc/35/04/82/333350482.db2.gz SYBAARDBIWONIY-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO CC(C)CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000524424514 333361874 /nfs/dbraw/zinc/36/18/74/333361874.db2.gz COOQBRBUCVIDFF-UHFFFAOYSA-N 1 0 276.380 3.648 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000322863674 333415744 /nfs/dbraw/zinc/41/57/44/333415744.db2.gz USITYSQYECZRCL-CQSZACIVSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@@H](Cc1cccs1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000036992515 333452320 /nfs/dbraw/zinc/45/23/20/333452320.db2.gz RSIQJONBLAXKNS-RYUDHWBXSA-N 1 0 290.388 3.938 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000037775708 333539375 /nfs/dbraw/zinc/53/93/75/333539375.db2.gz IEYDXLSMNXNLEF-STQMWFEESA-N 1 0 260.337 3.602 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000538280496 333582615 /nfs/dbraw/zinc/58/26/15/333582615.db2.gz SYYQYGCTRRPGMV-UWVGGRQHSA-N 1 0 290.285 3.752 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(Cc3ccccc3)CCC2)cc1 ZINC000538413215 333589659 /nfs/dbraw/zinc/58/96/59/333589659.db2.gz HTVHCRGQOPKGHV-UHFFFAOYSA-N 1 0 296.370 3.850 20 5 CHBDRO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000539050522 333651605 /nfs/dbraw/zinc/65/16/05/333651605.db2.gz HXNAILAJEZAUGZ-ACJLOTCBSA-N 1 0 296.370 3.660 20 5 CHBDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000068590656 333709951 /nfs/dbraw/zinc/70/99/51/333709951.db2.gz UJKQIGRMTFUKSK-UKRRQHHQSA-N 1 0 276.380 3.962 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000540165119 333716516 /nfs/dbraw/zinc/71/65/16/333716516.db2.gz VPZQEOCOCHIWCW-ZYHUDNBSSA-N 1 0 284.306 3.823 20 5 CHBDRO CC(C)[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000541846163 333794222 /nfs/dbraw/zinc/79/42/22/333794222.db2.gz OXAPIWHXWPVVGQ-OAHLLOKOSA-N 1 0 296.798 3.815 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000070112493 333799467 /nfs/dbraw/zinc/79/94/67/333799467.db2.gz XOXSDEGMCHOOOO-JMSVASOKSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@H]1CCC[C@@H](CC[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000070546760 333815796 /nfs/dbraw/zinc/81/57/96/333815796.db2.gz RSEGVJKABLJCEX-KBPBESRZSA-N 1 0 276.380 3.901 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(C)(C)CC1 ZINC000544606411 333939794 /nfs/dbraw/zinc/93/97/94/333939794.db2.gz RUQDKRUZGZFPBY-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@H]([NH2+]CCCNc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000132103218 333972162 /nfs/dbraw/zinc/97/21/62/333972162.db2.gz RALBQPMYTPCUGS-AWEZNQCLSA-N 1 0 299.374 3.748 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000545470283 333983973 /nfs/dbraw/zinc/98/39/73/333983973.db2.gz JXVMBIPWVIEJEM-NSHDSACASA-N 1 0 290.285 3.724 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCCC[C@H]1C ZINC000548586793 334163109 /nfs/dbraw/zinc/16/31/09/334163109.db2.gz JNHRDIVDKOBTJL-CYBMUJFWSA-N 1 0 262.353 3.668 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H](C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000081046041 334177271 /nfs/dbraw/zinc/17/72/71/334177271.db2.gz ZLPUPJNCKNGHHS-IUODEOHRSA-N 1 0 264.369 3.928 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(NCCCCC[NH+]2CCCC2)c1 ZINC000549244104 334188664 /nfs/dbraw/zinc/18/86/64/334188664.db2.gz CGFCGIHZHJYAJV-UHFFFAOYSA-N 1 0 291.395 3.581 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)cc1 ZINC000081637097 334201407 /nfs/dbraw/zinc/20/14/07/334201407.db2.gz QZCVCWNNVLODHL-HZPDHXFCSA-N 1 0 288.391 3.696 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCC[C@H](C2CC2)C1 ZINC000081638241 334201664 /nfs/dbraw/zinc/20/16/64/334201664.db2.gz BDBXVWQFIOGXBO-ZFWWWQNUSA-N 1 0 274.364 3.653 20 5 CHBDRO C[C@H](F)CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000550883572 334231651 /nfs/dbraw/zinc/23/16/51/334231651.db2.gz XEQLIRVKSLWDTI-KCQAQPDRSA-N 1 0 294.370 3.644 20 5 CHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000551825324 334263515 /nfs/dbraw/zinc/26/35/15/334263515.db2.gz FBRMESFVOCPZFW-CLFYSBASSA-N 1 0 274.364 3.873 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000251287223 334359311 /nfs/dbraw/zinc/35/93/11/334359311.db2.gz RAXHZAWITMDASI-UGFHNGPFSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000251855982 334370995 /nfs/dbraw/zinc/37/09/95/334370995.db2.gz NSSYBWRYOPKLFK-WCFLWFBJSA-N 1 0 264.369 3.988 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H]1C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000252715877 334386242 /nfs/dbraw/zinc/38/62/42/334386242.db2.gz WYLOAOIMPLLMTD-ZLDLUXBVSA-N 1 0 262.353 3.682 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CC[C@@H]2C2CC2)c(Cl)c1 ZINC000554089473 334411267 /nfs/dbraw/zinc/41/12/67/334411267.db2.gz SWJPOCREQHBVRP-OCCSQVGLSA-N 1 0 280.755 3.526 20 5 CHBDRO CC[C@@H]1CC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000554371342 334425321 /nfs/dbraw/zinc/42/53/21/334425321.db2.gz LIRAZYPRRAJALQ-NOZJJQNGSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000324327598 334884311 /nfs/dbraw/zinc/88/43/11/334884311.db2.gz PTKQSQCSWWJDJR-BXUZGUMPSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccccc1C[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000175986643 335226200 /nfs/dbraw/zinc/22/62/00/335226200.db2.gz XTESARAAVXHOLA-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO CC(C)CCC[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000579167484 335717610 /nfs/dbraw/zinc/71/76/10/335717610.db2.gz QYPSRECBXCEYGC-UHFFFAOYSA-N 1 0 289.379 3.644 20 5 CHBDRO CC(C)[NH+]1CCC(Nc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000387431044 336193991 /nfs/dbraw/zinc/19/39/91/336193991.db2.gz QCOVVBFSIDJRCC-UHFFFAOYSA-N 1 0 297.786 3.533 20 5 CHBDRO CCCC[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000050888498 521149140 /nfs/dbraw/zinc/14/91/40/521149140.db2.gz AQQQZTXIQLWURR-NSHDSACASA-N 1 0 250.342 3.572 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c1 ZINC000282094270 518203146 /nfs/dbraw/zinc/20/31/46/518203146.db2.gz SAXMPFDZLBBVPU-GFCCVEGCSA-N 1 0 284.306 3.510 20 5 CHBDRO CCC[C@H]([NH2+]C1CC(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000163379817 521154511 /nfs/dbraw/zinc/15/45/11/521154511.db2.gz IBNJHUWCCYELMZ-HGMXIMQMSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000053036058 522647423 /nfs/dbraw/zinc/64/74/23/522647423.db2.gz PEZJZVXUGGAJFD-HNNXBMFYSA-N 1 0 274.320 3.737 20 5 CHBDRO CC[C@H]([NH2+]Cc1ncccc1C)c1cccc([N+](=O)[O-])c1 ZINC000071339511 522669673 /nfs/dbraw/zinc/66/96/73/522669673.db2.gz QVJIVHRGHNSLGZ-HNNXBMFYSA-N 1 0 285.347 3.539 20 5 CHBDRO CC[C@@H]([NH2+]CCc1cccc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000280016719 522843148 /nfs/dbraw/zinc/84/31/48/522843148.db2.gz HCEIHTUYPLHABH-QGZVFWFLSA-N 1 0 299.374 3.582 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000051626678 522885177 /nfs/dbraw/zinc/88/51/77/522885177.db2.gz RQIUJOSSWKRVRA-MRXNPFEDSA-N 1 0 270.332 3.836 20 5 CHBDRO COc1ccc(C[N@H+](C)C2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000338394819 524002164 /nfs/dbraw/zinc/00/21/64/524002164.db2.gz OYZVJKYLCXEZRH-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO COc1ccc(C[NH2+][C@H](C)c2ccsc2)cc1[N+](=O)[O-] ZINC000061363444 524090505 /nfs/dbraw/zinc/09/05/05/524090505.db2.gz YGQGRIGGHCLXGI-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000049956723 524765835 /nfs/dbraw/zinc/76/58/35/524765835.db2.gz DUDYFFRJOSNGEP-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]([NH2+]CCCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000098005692 525432539 /nfs/dbraw/zinc/43/25/39/525432539.db2.gz XFSCMRSVTOFFQL-SECBINFHSA-N 1 0 276.258 3.588 20 5 CHBDRO CSC[C@@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000292353677 525652682 /nfs/dbraw/zinc/65/26/82/525652682.db2.gz HONKQYYCTMDVFB-CHWSQXEVSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@]2(C)CCCS2)cccc1[N+](=O)[O-] ZINC000120443802 525919342 /nfs/dbraw/zinc/91/93/42/525919342.db2.gz RKPIEPPSTSTOHP-WFASDCNBSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000156729101 525940448 /nfs/dbraw/zinc/94/04/48/525940448.db2.gz FEHVGBPRKHXJJV-IPYPFGDCSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000280597540 527401516 /nfs/dbraw/zinc/40/15/16/527401516.db2.gz JBYMQVZAFYJKTL-WKILWMFISA-N 1 0 282.343 3.631 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCCC23CC3)c1 ZINC000706934526 1121446315 /nfs/dbraw/zinc/44/63/15/1121446315.db2.gz DVYXAISQTOPBDM-ZDUSSCGKSA-N 1 0 280.755 3.671 20 5 CHBDRO C[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC001190661913 1122548836 /nfs/dbraw/zinc/54/88/36/1122548836.db2.gz VSOHEJCOYJFPQV-NSHDSACASA-N 1 0 282.771 3.870 20 5 CHBDRO Cc1cccc(C(C)(C)C)c1O[C@H](C)C[N+](C)(C)C ZINC001227991413 1131784734 /nfs/dbraw/zinc/78/47/34/1131784734.db2.gz FAXBQALDVLKQHR-CQSZACIVSA-N 1 0 264.433 3.766 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000251862657 1125517281 /nfs/dbraw/zinc/51/72/81/1125517281.db2.gz PYUBXOYTGMPMES-UMVBOHGHSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1cccnc1[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000118839780 1125526426 /nfs/dbraw/zinc/52/64/26/1125526426.db2.gz UNFOTSLKEODLHJ-INIZCTEOSA-N 1 0 299.374 3.785 20 5 CHBDRO Cc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1F ZINC000296389245 1125580414 /nfs/dbraw/zinc/58/04/14/1125580414.db2.gz KWSBRENCMGVRSJ-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H](C)C(C)C ZINC000065299126 1125584724 /nfs/dbraw/zinc/58/47/24/1125584724.db2.gz OLUYLVTVCKNXLG-SNVBAGLBSA-N 1 0 256.371 3.523 20 5 CHBDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC000885926575 1125627330 /nfs/dbraw/zinc/62/73/30/1125627330.db2.gz GAASNDKQRVQHRM-INIZCTEOSA-N 1 0 297.358 3.635 20 5 CHBDRO CC(C)[C@@H](c1ccccc1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886008615 1125635527 /nfs/dbraw/zinc/63/55/27/1125635527.db2.gz QZSQJUJOQFLRMJ-INIZCTEOSA-N 1 0 299.374 3.819 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC000886105217 1125650282 /nfs/dbraw/zinc/65/02/82/1125650282.db2.gz USLXRFQNPDMJLZ-OAHLLOKOSA-N 1 0 285.347 3.621 20 5 CHBDRO Cc1ccccc1[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C(C)C ZINC000886111927 1125651456 /nfs/dbraw/zinc/65/14/56/1125651456.db2.gz LFIHQVNXJFKPOS-MRXNPFEDSA-N 1 0 299.374 3.785 20 5 CHBDRO C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886205090 1125661714 /nfs/dbraw/zinc/66/17/14/1125661714.db2.gz ZLNNMXKYECYVTL-XJKSGUPXSA-N 1 0 297.358 3.573 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C1(C2CC2)CCC1 ZINC000886825411 1125720996 /nfs/dbraw/zinc/72/09/96/1125720996.db2.gz SGRMRSVEYRWCIW-CQSZACIVSA-N 1 0 272.348 3.504 20 5 CHBDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000121990042 1125781984 /nfs/dbraw/zinc/78/19/84/1125781984.db2.gz XYANAXZWLQOXEY-DGCLKSJQSA-N 1 0 294.395 3.757 20 5 CHBDRO CCCC[C@H](CCC)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819133749 1131232589 /nfs/dbraw/zinc/23/25/89/1131232589.db2.gz CDRPJPJFQFOFOP-HOCLYGCPSA-N 1 0 294.395 3.577 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000138872009 1126747481 /nfs/dbraw/zinc/74/74/81/1126747481.db2.gz ZLGJRVIXJCIIKE-INIZCTEOSA-N 1 0 298.342 3.638 20 5 CHBDRO CCCC[N@H+](CC)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000485143564 1126888553 /nfs/dbraw/zinc/88/85/53/1126888553.db2.gz JKDDKSCGSQYZIE-LBPRGKRZSA-N 1 0 250.342 3.778 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)C1CCCCC1 ZINC000485707088 1126944096 /nfs/dbraw/zinc/94/40/96/1126944096.db2.gz IYKDRKBJQWKBHC-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO O=[N+]([O-])c1ccc(CN2CCCC3(CC3)C2)cc1Cl ZINC000783679335 1130846258 /nfs/dbraw/zinc/84/62/58/1130846258.db2.gz OBFIKIDALDOJDB-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000323745324 1127055067 /nfs/dbraw/zinc/05/50/67/1127055067.db2.gz QZEZZDJCPBUMMP-GFCCVEGCSA-N 1 0 268.744 3.526 20 5 CHBDRO CC(C)C([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)C(C)C ZINC000815597142 1131005623 /nfs/dbraw/zinc/00/56/23/1131005623.db2.gz NUBXUHSPGHLTBB-NSHDSACASA-N 1 0 279.384 3.508 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000042814593 1127076505 /nfs/dbraw/zinc/07/65/05/1127076505.db2.gz FTTYANXRPQTOMD-JKSUJKDBSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000570248420 1127082003 /nfs/dbraw/zinc/08/20/03/1127082003.db2.gz MEBPJNAPJZNBHL-KRWDZBQOSA-N 1 0 299.374 3.881 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271486011 1127086082 /nfs/dbraw/zinc/08/60/82/1127086082.db2.gz DWSOLOBGHXOZCF-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271487102 1127086109 /nfs/dbraw/zinc/08/61/09/1127086109.db2.gz DWSOLOBGHXOZCF-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000350046541 1127170859 /nfs/dbraw/zinc/17/08/59/1127170859.db2.gz FDXQIIPVUHQOPJ-ZDUSSCGKSA-N 1 0 299.374 3.711 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000588978210 1127208919 /nfs/dbraw/zinc/20/89/19/1127208919.db2.gz PWHWELTWPIZTBN-LBPRGKRZSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C(C1CC1)C1CC1 ZINC000157544834 1127328544 /nfs/dbraw/zinc/32/85/44/1127328544.db2.gz DAORVTMUSXIGRA-LLVKDONJSA-N 1 0 274.364 3.742 20 5 CHBDRO CC(C)[C@H]1N(Cc2csc([N+](=O)[O-])c2)CC12CC=CC2 ZINC000592529033 1127353013 /nfs/dbraw/zinc/35/30/13/1127353013.db2.gz WBMBXYNLECQLOX-CQSZACIVSA-N 1 0 292.404 3.833 20 5 CHBDRO Cc1c(C[NH+]2CC(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000761062086 1127415830 /nfs/dbraw/zinc/41/58/30/1127415830.db2.gz YQQNUEWAEVYVNJ-UHFFFAOYSA-N 1 0 296.370 3.578 20 5 CHBDRO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000358351836 1127416808 /nfs/dbraw/zinc/41/68/08/1127416808.db2.gz LLTPHQRRRHOFBO-SJCJKPOMSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C)SC1)c1cccc([N+](=O)[O-])c1 ZINC000594503202 1127418901 /nfs/dbraw/zinc/41/89/01/1127418901.db2.gz GRTDYOPTBACICH-WZRBSPASSA-N 1 0 280.393 3.530 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000358408195 1127419909 /nfs/dbraw/zinc/41/99/09/1127419909.db2.gz SBQJEXZGCHWPQT-KBPBESRZSA-N 1 0 299.374 3.580 20 5 CHBDRO COC[C@@H](CC(C)(C)C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000594519155 1127420890 /nfs/dbraw/zinc/42/08/90/1127420890.db2.gz DWIONFKWJZWFLM-TZMCWYRMSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)Cc1ccccn1 ZINC000594516568 1127421198 /nfs/dbraw/zinc/42/11/98/1127421198.db2.gz XKXXRBGNKWVBAI-KGLIPLIRSA-N 1 0 299.374 3.580 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@]34C[C@@H]3CCC4)o2)c1 ZINC000594949592 1127439209 /nfs/dbraw/zinc/43/92/09/1127439209.db2.gz FCNIHTFIKQXTGB-GUYCJALGSA-N 1 0 298.342 3.887 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3[C@@H]4CCC[C@@H]43)o2)cc1 ZINC000594983769 1127443942 /nfs/dbraw/zinc/44/39/42/1127443942.db2.gz FEZMLMBXWNITHF-SCAQPMJSSA-N 1 0 298.342 3.743 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CC=CCC1 ZINC000595005229 1127445322 /nfs/dbraw/zinc/44/53/22/1127445322.db2.gz FJNPBDMDEPQHDT-QWHCGFSZSA-N 1 0 290.363 3.610 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1F ZINC000595051256 1127451257 /nfs/dbraw/zinc/45/12/57/1127451257.db2.gz MQLQLPGWPFZPFZ-LERXQTSPSA-N 1 0 296.342 3.535 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000595081160 1127453747 /nfs/dbraw/zinc/45/37/47/1127453747.db2.gz QHKPCSNUKMEWDU-SWLSCSKDSA-N 1 0 276.380 3.694 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H](C)O2)cc1[N+](=O)[O-] ZINC000595078906 1127453756 /nfs/dbraw/zinc/45/37/56/1127453756.db2.gz HGPNAELRXDIQKP-IPYPFGDCSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595091436 1127454020 /nfs/dbraw/zinc/45/40/20/1127454020.db2.gz IFPYBIWUGIWGBI-QWHCGFSZSA-N 1 0 298.333 3.927 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)cc1[N+](=O)[O-] ZINC000595095006 1127455277 /nfs/dbraw/zinc/45/52/77/1127455277.db2.gz SNBSGQRRBXBVAH-ZWNOBZJWSA-N 1 0 298.333 3.845 20 5 CHBDRO CC(C)CC1([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000595095851 1127455333 /nfs/dbraw/zinc/45/53/33/1127455333.db2.gz RFGAVRRTXTWSTG-GFCCVEGCSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1=CCCC1 ZINC000595097610 1127455785 /nfs/dbraw/zinc/45/57/85/1127455785.db2.gz ZYOLTQWPQHMNRM-ZDUSSCGKSA-N 1 0 274.364 3.616 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595408214 1127461753 /nfs/dbraw/zinc/46/17/53/1127461753.db2.gz JTTTZFINTKMSER-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3C[C@H]3C2)o1 ZINC000597222538 1127536748 /nfs/dbraw/zinc/53/67/48/1127536748.db2.gz FDEQLSWREIMFND-STQMWFEESA-N 1 0 298.342 3.697 20 5 CHBDRO CC[C@@H](C)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602503468 1127588125 /nfs/dbraw/zinc/58/81/25/1127588125.db2.gz JYICCXMXQHVCKN-MRVPVSSYSA-N 1 0 276.258 3.502 20 5 CHBDRO C[C@@H]1C[C@@H](NCc2ccccc2[N+](=O)[O-])c2ccccc2O1 ZINC000295077207 1127618934 /nfs/dbraw/zinc/61/89/34/1127618934.db2.gz PWNTXSQONSKTBY-IUODEOHRSA-N 1 0 298.342 3.597 20 5 CHBDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000598959957 1127646906 /nfs/dbraw/zinc/64/69/06/1127646906.db2.gz OPFJGBDVSDOWHE-UHFFFAOYSA-N 1 0 286.322 3.756 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CC=CC1 ZINC000598991678 1127650750 /nfs/dbraw/zinc/65/07/50/1127650750.db2.gz ANSPWDMOGPNVDD-LCYFTJDESA-N 1 0 272.348 3.554 20 5 CHBDRO CCC[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)OCC ZINC000599057955 1127653739 /nfs/dbraw/zinc/65/37/39/1127653739.db2.gz DGHSZYKQCUJJSX-KGLIPLIRSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@H](C)C(F)(F)[C@@H](C)C1 ZINC000599060168 1127654770 /nfs/dbraw/zinc/65/47/70/1127654770.db2.gz TXSLFLDKYUDKCD-SDDRHHMPSA-N 1 0 298.333 3.879 20 5 CHBDRO Cc1c(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000599512463 1127676656 /nfs/dbraw/zinc/67/66/56/1127676656.db2.gz JXJIOGIIIKFJHS-QWRGUYRKSA-N 1 0 298.333 3.626 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@H](C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000603873315 1127679549 /nfs/dbraw/zinc/67/95/49/1127679549.db2.gz LLWGTBCSOULYPZ-GFCCVEGCSA-N 1 0 264.369 3.770 20 5 CHBDRO CC(F)(F)CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000296639297 1127679971 /nfs/dbraw/zinc/67/99/71/1127679971.db2.gz BYEFJZGWCLOZKI-CQSZACIVSA-N 1 0 298.333 3.997 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(C)cc1 ZINC000604491869 1127707845 /nfs/dbraw/zinc/70/78/45/1127707845.db2.gz MASUVKHUVJKTSX-UHFFFAOYSA-N 1 0 298.386 3.968 20 5 CHBDRO C[C@H]1CCC[C@](CNc2ccsc2[N+](=O)[O-])([NH+](C)C)C1 ZINC000063264811 1127803887 /nfs/dbraw/zinc/80/38/87/1127803887.db2.gz ZPCQAXCXLUGSQJ-FZMZJTMJSA-N 1 0 297.424 3.579 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CC(C)(C)C ZINC000075767256 1127874062 /nfs/dbraw/zinc/87/40/62/1127874062.db2.gz UWWZELSTTLYYFM-LLVKDONJSA-N 1 0 250.342 3.634 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C)(C)CC1 ZINC000608886191 1127893780 /nfs/dbraw/zinc/89/37/80/1127893780.db2.gz HREXWENQAIMHKP-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@H](C[N@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000608977263 1127896474 /nfs/dbraw/zinc/89/64/74/1127896474.db2.gz WKZSUSWFCJKPLH-CQSZACIVSA-N 1 0 284.359 3.830 20 5 CHBDRO CCC1(C)CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774792 1127931321 /nfs/dbraw/zinc/93/13/21/1127931321.db2.gz ACJDVEKYYXXLNZ-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000076068567 1127934238 /nfs/dbraw/zinc/93/42/38/1127934238.db2.gz GTAYCWJYTPOKQW-DZGCQCFKSA-N 1 0 294.420 3.701 20 5 CHBDRO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000543979972 1127954035 /nfs/dbraw/zinc/95/40/35/1127954035.db2.gz BCIUSASXWDJJEY-OLZOCXBDSA-N 1 0 299.374 3.964 20 5 CHBDRO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000543979971 1127954431 /nfs/dbraw/zinc/95/44/31/1127954431.db2.gz BCIUSASXWDJJEY-CHWSQXEVSA-N 1 0 299.374 3.964 20 5 CHBDRO CC/C=C\CC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000467454364 1127969467 /nfs/dbraw/zinc/96/94/67/1127969467.db2.gz PABYFKKGYDUCHK-SZZPACECSA-N 1 0 262.353 3.910 20 5 CHBDRO COC[C@@H](CC(C)C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000540222022 1127970453 /nfs/dbraw/zinc/97/04/53/1127970453.db2.gz LUGLCZNKRKJSRY-UKRRQHHQSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(C)CCCCC1 ZINC000544612618 1127978987 /nfs/dbraw/zinc/97/89/87/1127978987.db2.gz JPCCCGMWWMLWAQ-UHFFFAOYSA-N 1 0 262.353 3.716 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000541774614 1128038167 /nfs/dbraw/zinc/03/81/67/1128038167.db2.gz XQQPQVCICLDXRA-ZDUSSCGKSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000542049197 1128049667 /nfs/dbraw/zinc/04/96/67/1128049667.db2.gz VXCOUYCRGUQXOD-XPKDYRNWSA-N 1 0 274.364 3.605 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000470184731 1128064637 /nfs/dbraw/zinc/06/46/37/1128064637.db2.gz WNZDCHDDSDZOLQ-ZFSVZOPNSA-N 1 0 286.375 3.586 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC(C)C ZINC000151772649 1128076029 /nfs/dbraw/zinc/07/60/29/1128076029.db2.gz DPIGKHNSDJSNEZ-GFCCVEGCSA-N 1 0 250.342 3.600 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@@H](C)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000492788328 1128113089 /nfs/dbraw/zinc/11/30/89/1128113089.db2.gz IFNVYXNOICICCG-QWHCGFSZSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000492785035 1128113104 /nfs/dbraw/zinc/11/31/04/1128113104.db2.gz RWKPQAQALHQXDJ-GXTWGEPZSA-N 1 0 274.364 3.696 20 5 CHBDRO CC(C)C1(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761524336 1128132269 /nfs/dbraw/zinc/13/22/69/1128132269.db2.gz BJWQXOVPWIQBHI-UHFFFAOYSA-N 1 0 282.771 3.774 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761523766 1128132349 /nfs/dbraw/zinc/13/23/49/1128132349.db2.gz XHQNPDGIKIZIOW-PWSUYJOCSA-N 1 0 282.771 3.917 20 5 CHBDRO CC1(C)CCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526482 1128132946 /nfs/dbraw/zinc/13/29/46/1128132946.db2.gz NDTQUADOVKBBPQ-ZDUSSCGKSA-N 1 0 282.771 3.917 20 5 CHBDRO CC(C)CN(Cc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000493923872 1128151754 /nfs/dbraw/zinc/15/17/54/1128151754.db2.gz FPQUQEUGZMOISP-UHFFFAOYSA-N 1 0 282.771 3.869 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000324229371 1128161240 /nfs/dbraw/zinc/16/12/40/1128161240.db2.gz XKRKWTNZOFUZMN-CYBMUJFWSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@]2(C)CCCCO2)cccc1[N+](=O)[O-] ZINC000927025384 1128208741 /nfs/dbraw/zinc/20/87/41/1128208741.db2.gz YKAUQMYKUOMONI-CZUORRHYSA-N 1 0 292.379 3.513 20 5 CHBDRO CC(C)[NH+](CCSCc1cccc([N+](=O)[O-])c1)C(C)C ZINC000762199843 1128279952 /nfs/dbraw/zinc/27/99/52/1128279952.db2.gz ZJBIXPJFPKGTEN-UHFFFAOYSA-N 1 0 296.436 3.947 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000330373725 1128325370 /nfs/dbraw/zinc/32/53/70/1128325370.db2.gz DHORFPWWKZENPN-SCDSUCTJSA-N 1 0 262.353 3.742 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2CCSC2)cc1[N+](=O)[O-] ZINC000562617834 1128413593 /nfs/dbraw/zinc/41/35/93/1128413593.db2.gz VQZCPXBWVNAKBM-ZDUSSCGKSA-N 1 0 294.420 3.561 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2CCSC2)cc1[N+](=O)[O-] ZINC000562617831 1128413611 /nfs/dbraw/zinc/41/36/11/1128413611.db2.gz VQZCPXBWVNAKBM-CYBMUJFWSA-N 1 0 294.420 3.561 20 5 CHBDRO CC(C)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000324478007 1128384025 /nfs/dbraw/zinc/38/40/25/1128384025.db2.gz BLQQECYVBSUJIF-AWEZNQCLSA-N 1 0 282.771 3.772 20 5 CHBDRO CSCC1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000932592281 1128416978 /nfs/dbraw/zinc/41/69/78/1128416978.db2.gz SIVZJEZOUINXNY-GFCCVEGCSA-N 1 0 294.420 3.731 20 5 CHBDRO C[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000798962433 1128422334 /nfs/dbraw/zinc/42/23/34/1128422334.db2.gz MGDDNDUWAJNSDO-PWSUYJOCSA-N 1 0 282.771 3.774 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1cccc(F)c1[N+](=O)[O-] ZINC000037420648 1128519465 /nfs/dbraw/zinc/51/94/65/1128519465.db2.gz SSOYXBZVZCAXGI-LBPRGKRZSA-N 1 0 297.374 3.656 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](F)C2)cc1[N+](=O)[O-] ZINC000567269582 1128561774 /nfs/dbraw/zinc/56/17/74/1128561774.db2.gz NNEPDTRZSMIGDL-FPMFFAJLSA-N 1 0 280.343 3.835 20 5 CHBDRO CC1(C)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@H]1C1CC1 ZINC000565984240 1128536928 /nfs/dbraw/zinc/53/69/28/1128536928.db2.gz SPRWGVDLRFMWLV-WRLNGNIRSA-N 1 0 286.375 3.728 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000556958664 1128651835 /nfs/dbraw/zinc/65/18/35/1128651835.db2.gz JZJFWKVQMFEKTO-SJDLMVEWSA-N 1 0 286.375 3.730 20 5 CHBDRO CN(Cc1cccc(F)c1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000047540518 1128671412 /nfs/dbraw/zinc/67/14/12/1128671412.db2.gz UPGLKXKYAJHUDO-UHFFFAOYSA-N 1 0 292.285 3.505 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2ncccc21)c1cccc([N+](=O)[O-])c1 ZINC000601264617 1128707535 /nfs/dbraw/zinc/70/75/35/1128707535.db2.gz BJOCVMGZSAVZHJ-PXAZEXFGSA-N 1 0 297.358 3.718 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000609440711 1128714291 /nfs/dbraw/zinc/71/42/91/1128714291.db2.gz ITNVFKHHSXLHCN-QGZVFWFLSA-N 1 0 296.370 3.989 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000578403734 1128716999 /nfs/dbraw/zinc/71/69/99/1128716999.db2.gz RXINZOYANGBZFK-LBPRGKRZSA-N 1 0 250.342 3.605 20 5 CHBDRO C[C@@H]1CCCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609625627 1128719475 /nfs/dbraw/zinc/71/94/75/1128719475.db2.gz DTWMCPDSYRKRAB-CQSZACIVSA-N 1 0 292.379 3.628 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609631960 1128721352 /nfs/dbraw/zinc/72/13/52/1128721352.db2.gz YMYUDXVMYBYYLU-CQSZACIVSA-N 1 0 276.380 3.853 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705381 1128722747 /nfs/dbraw/zinc/72/27/47/1128722747.db2.gz XTALTLVWLRGYFA-NSHDSACASA-N 1 0 282.771 3.870 20 5 CHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609767008 1128724351 /nfs/dbraw/zinc/72/43/51/1128724351.db2.gz FMHZGIUMPYPWNF-AWEZNQCLSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609846149 1128728682 /nfs/dbraw/zinc/72/86/82/1128728682.db2.gz HSTXBMTUANMIFS-XUJVJEKNSA-N 1 0 292.354 3.887 20 5 CHBDRO Cc1ccoc1C[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000430152709 1117786701 /nfs/dbraw/zinc/78/67/01/1117786701.db2.gz XFIVYPMTAJVWKZ-ALCCZGGFSA-N 1 0 286.331 3.641 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000072727644 1117812168 /nfs/dbraw/zinc/81/21/68/1117812168.db2.gz BIRVHIKKYKSFAK-ZDUSSCGKSA-N 1 0 299.374 3.964 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215374 1117882080 /nfs/dbraw/zinc/88/20/80/1117882080.db2.gz JIPDYLPUUDZLAQ-CHWSQXEVSA-N 1 0 262.353 3.605 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)C1CCCCC1 ZINC000430217684 1117886711 /nfs/dbraw/zinc/88/67/11/1117886711.db2.gz KDBLBWDZDGNOEK-GFCCVEGCSA-N 1 0 292.379 3.662 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)C(C)(C)C ZINC000430225815 1117896358 /nfs/dbraw/zinc/89/63/58/1117896358.db2.gz ZAHIQZLTWWUFMD-CQSZACIVSA-N 1 0 280.368 3.518 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC000471168028 1117910013 /nfs/dbraw/zinc/91/00/13/1117910013.db2.gz GLPCEDFCRUFKBR-QGZVFWFLSA-N 1 0 282.343 3.584 20 5 CHBDRO CC1=C[C@@H](C)CN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000430272079 1117974165 /nfs/dbraw/zinc/97/41/65/1117974165.db2.gz ZOBVCJGMLDAVPL-SNVBAGLBSA-N 1 0 280.755 3.646 20 5 CHBDRO C[C@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000359877465 1118008375 /nfs/dbraw/zinc/00/83/75/1118008375.db2.gz PWTGDFWOYHFRJA-SUMWQHHRSA-N 1 0 297.358 3.573 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)Cc1ccco1 ZINC000764774202 1118113211 /nfs/dbraw/zinc/11/32/11/1118113211.db2.gz NWNWVNCPTPSJSL-CHWSQXEVSA-N 1 0 288.347 3.778 20 5 CHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000610275455 1118173092 /nfs/dbraw/zinc/17/30/92/1118173092.db2.gz QPFDVKBPHNJJHO-GFCCVEGCSA-N 1 0 297.424 3.579 20 5 CHBDRO CC(C)[C@H](C)C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000084440243 1118356810 /nfs/dbraw/zinc/35/68/10/1118356810.db2.gz SYWJKSLVSORUHL-SNVBAGLBSA-N 1 0 270.760 3.630 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(C2CCCC2)CC1 ZINC000610370813 1118363220 /nfs/dbraw/zinc/36/32/20/1118363220.db2.gz LZVJUXNXTBNORT-UHFFFAOYSA-N 1 0 288.391 3.997 20 5 CHBDRO CC(C)C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000307837791 1118472183 /nfs/dbraw/zinc/47/21/83/1118472183.db2.gz RRJRIHVZLSOXTN-ZDUSSCGKSA-N 1 0 280.343 3.602 20 5 CHBDRO CC[C@@H]([NH2+]CCSC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000311833273 1118532833 /nfs/dbraw/zinc/53/28/33/1118532833.db2.gz KVSRDMSRYFJVQH-CQSZACIVSA-N 1 0 282.409 3.777 20 5 CHBDRO COc1ccc(C[NH2+]CCCCC(C)C)cc1[N+](=O)[O-] ZINC000096867566 1118561596 /nfs/dbraw/zinc/56/15/96/1118561596.db2.gz VXTZCNLEOJUYLP-UHFFFAOYSA-N 1 0 280.368 3.519 20 5 CHBDRO Cc1c(C[N@@H+](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000051127553 1118643690 /nfs/dbraw/zinc/64/36/90/1118643690.db2.gz IGXUABCCWJYONO-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)s1 ZINC000090910029 1118689308 /nfs/dbraw/zinc/68/93/08/1118689308.db2.gz WGEQCKZYGFXKJF-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cscc2Cl)cc1 ZINC000610930563 1118909707 /nfs/dbraw/zinc/90/97/07/1118909707.db2.gz PLAGUDKVSZUBJJ-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC2(CC2)C1 ZINC000274563995 1118929153 /nfs/dbraw/zinc/92/91/53/1118929153.db2.gz XXIGVZQSVBZMSO-GFCCVEGCSA-N 1 0 260.337 3.532 20 5 CHBDRO C[C@H]1CC([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@H](C)C1 ZINC000084469027 1118946510 /nfs/dbraw/zinc/94/65/10/1118946510.db2.gz JFMFKNQCOWCUGN-CHWSQXEVSA-N 1 0 276.380 3.552 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C(C)(C)CF)cc1[N+](=O)[O-] ZINC000472128358 1118984700 /nfs/dbraw/zinc/98/47/00/1118984700.db2.gz ORYBZUGBPWLUAY-UHFFFAOYSA-N 1 0 268.332 3.556 20 5 CHBDRO CC(C)(CF)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000472136510 1118987998 /nfs/dbraw/zinc/98/79/98/1118987998.db2.gz MRQSBSBQSRRFMI-UHFFFAOYSA-N 1 0 292.310 3.693 20 5 CHBDRO Cc1ccc(CC[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511140873 1119098249 /nfs/dbraw/zinc/09/82/49/1119098249.db2.gz VEAPDJJBRJSHNE-UHFFFAOYSA-N 1 0 298.386 3.620 20 5 CHBDRO CCCCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479868731 1119145333 /nfs/dbraw/zinc/14/53/33/1119145333.db2.gz UAJPHGUVRAMXID-HNNXBMFYSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@@H](C)[C@@H](C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)OC ZINC000362978400 1119251772 /nfs/dbraw/zinc/25/17/72/1119251772.db2.gz ZUXRHXRRZIORPO-UHOFOFEASA-N 1 0 294.395 3.697 20 5 CHBDRO CS[C@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000235146770 1119318767 /nfs/dbraw/zinc/31/87/67/1119318767.db2.gz RMTFIQNYENRLTL-KGLIPLIRSA-N 1 0 294.420 3.667 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccncc2)C1 ZINC000583603107 1119384360 /nfs/dbraw/zinc/38/43/60/1119384360.db2.gz UUMXNDKARUPQEH-ZFWWWQNUSA-N 1 0 297.358 3.540 20 5 CHBDRO CC1=C[C@H](C)C[C@@H](C[NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000583901330 1119432003 /nfs/dbraw/zinc/43/20/03/1119432003.db2.gz YIKQYMNAVCUTKH-DZGCQCFKSA-N 1 0 288.391 3.719 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC23CCCCC3)cs1 ZINC000536181704 1119448694 /nfs/dbraw/zinc/44/86/94/1119448694.db2.gz SWVZJIWMABQHAM-UHFFFAOYSA-N 1 0 280.393 3.955 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000708503115 1119501198 /nfs/dbraw/zinc/50/11/98/1119501198.db2.gz ODFMMMACYVQLPF-LBPRGKRZSA-N 1 0 280.343 3.746 20 5 CHBDRO Cc1nc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000090888699 1119546806 /nfs/dbraw/zinc/54/68/06/1119546806.db2.gz KUAWAJKOHKENPE-SECBINFHSA-N 1 0 291.376 3.519 20 5 CHBDRO C[C@H]([N@H+](C)Cc1ccc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000311865463 1119571712 /nfs/dbraw/zinc/57/17/12/1119571712.db2.gz KSIZSJJTDUUPPA-JTQLQIEISA-N 1 0 268.332 3.600 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2C[C@H]2C)cc1[N+](=O)[O-] ZINC000414105068 1119900469 /nfs/dbraw/zinc/90/04/69/1119900469.db2.gz ZRMRXOSITKXOLH-CZXHOFHRSA-N 1 0 262.353 3.598 20 5 CHBDRO COC1([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CCC1 ZINC000414307091 1119974410 /nfs/dbraw/zinc/97/44/10/1119974410.db2.gz OSBARWHAJOYEIE-CHWSQXEVSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCC(F)(F)C1 ZINC000311841485 1120112282 /nfs/dbraw/zinc/11/22/82/1120112282.db2.gz HOVFLRHJRWIUDG-SNVBAGLBSA-N 1 0 290.697 3.526 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CC1CC1)C(C)C ZINC000542702481 1120123411 /nfs/dbraw/zinc/12/34/11/1120123411.db2.gz HVGQVAQABASSSX-UHFFFAOYSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@H]21 ZINC000541111792 1120148403 /nfs/dbraw/zinc/14/84/03/1120148403.db2.gz SLLAIUKFRXSVJR-UHOFOFEASA-N 1 0 274.364 3.605 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000062726455 1120205870 /nfs/dbraw/zinc/20/58/70/1120205870.db2.gz KEXHROPTGLNTLO-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@H](c1ccccc1)N(C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103465211 1120252983 /nfs/dbraw/zinc/25/29/83/1120252983.db2.gz VVLFGMMILRAUNU-GFCCVEGCSA-N 1 0 288.322 3.927 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000104323354 1120288975 /nfs/dbraw/zinc/28/89/75/1120288975.db2.gz JAAOGAJWCBSQSZ-GWCFXTLKSA-N 1 0 282.771 3.917 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCCF)CCCC2 ZINC000417354437 1120434149 /nfs/dbraw/zinc/43/41/49/1120434149.db2.gz ZJFSNDBPKBKIIG-HNNXBMFYSA-N 1 0 280.343 3.702 20 5 CHBDRO CCC(C)(CC)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000116359435 1120468170 /nfs/dbraw/zinc/46/81/70/1120468170.db2.gz RTGFADQIYCFPEJ-CSKARUKUSA-N 1 0 262.353 3.776 20 5 CHBDRO Cc1cc(Nc2ccc(CC[NH+](C)C)cc2)ccc1[N+](=O)[O-] ZINC000301956384 1120488919 /nfs/dbraw/zinc/48/89/19/1120488919.db2.gz MLSBOMLFZLJKHF-UHFFFAOYSA-N 1 0 299.374 3.751 20 5 CHBDRO C[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000618567146 1128919881 /nfs/dbraw/zinc/91/98/81/1128919881.db2.gz ZBERBSMEWSANEA-BZNIZROVSA-N 1 0 274.364 3.608 20 5 CHBDRO CS[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000117393176 1120499239 /nfs/dbraw/zinc/49/92/39/1120499239.db2.gz JSHUQAMPNORMHB-UONOGXRCSA-N 1 0 294.420 3.667 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CC2 ZINC000468004659 1120527209 /nfs/dbraw/zinc/52/72/09/1120527209.db2.gz MBOXIOCWEHDRGN-KRWDZBQOSA-N 1 0 296.370 3.723 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](c2ccccn2)C2CC2)cc1[N+](=O)[O-] ZINC000922586503 1120558734 /nfs/dbraw/zinc/55/87/34/1120558734.db2.gz XPKVCVXFEIYSMK-QGZVFWFLSA-N 1 0 297.358 3.539 20 5 CHBDRO CC[C@H]([NH2+]C[C@H](OC)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000154967462 1120565195 /nfs/dbraw/zinc/56/51/95/1120565195.db2.gz KSCWBPAKGLAJJP-GJZGRUSLSA-N 1 0 294.395 3.697 20 5 CHBDRO COCC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000508992803 1120578321 /nfs/dbraw/zinc/57/83/21/1120578321.db2.gz BSKZILMATMIKQE-IUODEOHRSA-N 1 0 294.395 3.697 20 5 CHBDRO CCSCCC[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000500366635 1120598463 /nfs/dbraw/zinc/59/84/63/1120598463.db2.gz IKXYKYXWGKGAGT-RAXLEYEMSA-N 1 0 294.420 3.731 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCSC3(CCC3)C2)c1 ZINC000922843205 1120609928 /nfs/dbraw/zinc/60/99/28/1120609928.db2.gz SRCXOJYHFSEQKA-CYBMUJFWSA-N 1 0 292.404 3.503 20 5 CHBDRO Cc1cccc(NCCCCc2ccc([N+](=O)[O-])cc2)[nH+]1 ZINC000302252291 1120650852 /nfs/dbraw/zinc/65/08/52/1120650852.db2.gz XDXDHMRGNIQKKA-UHFFFAOYSA-N 1 0 285.347 3.733 20 5 CHBDRO CC[C@@H]([NH2+]CCOCCC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000045093964 1120745874 /nfs/dbraw/zinc/74/58/74/1120745874.db2.gz ODJHFDPLBWOTFJ-MRXNPFEDSA-N 1 0 294.395 3.698 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000048348875 1120811545 /nfs/dbraw/zinc/81/15/45/1120811545.db2.gz DORUHPUQLFBLLH-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)CCc2ccco2)cccc1[N+](=O)[O-] ZINC000049566360 1120860037 /nfs/dbraw/zinc/86/00/37/1120860037.db2.gz WIZIPYMGNQYYLC-GFCCVEGCSA-N 1 0 288.347 3.607 20 5 CHBDRO CCCCCC[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000070197070 1128952682 /nfs/dbraw/zinc/95/26/82/1128952682.db2.gz LXNGYXSKCSTPQQ-UHFFFAOYSA-N 1 0 250.342 3.573 20 5 CHBDRO Cc1cc(N2C[C@H]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302107828 1120988548 /nfs/dbraw/zinc/98/85/48/1120988548.db2.gz YFIVIYKWPYGDRI-CHWSQXEVSA-N 1 0 297.358 3.688 20 5 CHBDRO CC(C)C[C@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001167897129 1121257260 /nfs/dbraw/zinc/25/72/60/1121257260.db2.gz DRCDFFUTNMRCKV-OAHLLOKOSA-N 1 0 276.380 3.995 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000500501388 1121288679 /nfs/dbraw/zinc/28/86/79/1121288679.db2.gz MCVMNUGCPVMWGQ-INIZCTEOSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1ccsc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549808640 1121452171 /nfs/dbraw/zinc/45/21/71/1121452171.db2.gz VHKXEVIEWKVACJ-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO CCCC[NH+](CCCC)Cc1cccc([N+](=O)[O-])c1 ZINC000222277438 1121484705 /nfs/dbraw/zinc/48/47/05/1121484705.db2.gz HUZFAFSGQKXADR-UHFFFAOYSA-N 1 0 264.369 3.997 20 5 CHBDRO c1c[nH+]c(Nc2ccc3nc4ccccc4cc3c2)[nH]1 ZINC001176084643 1121534842 /nfs/dbraw/zinc/53/48/42/1121534842.db2.gz AKVGQRGIORBJTA-UHFFFAOYSA-N 1 0 260.300 3.855 20 5 CHBDRO CC[C@H](C)C[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000509377980 1121558973 /nfs/dbraw/zinc/55/89/73/1121558973.db2.gz GZKWOTGRBCCWCN-XOVSCCBYSA-N 1 0 262.353 3.586 20 5 CHBDRO CCC(CC)C[N@H+](CC)CCc1ccc([N+](=O)[O-])cc1 ZINC000512774055 1121590798 /nfs/dbraw/zinc/59/07/98/1121590798.db2.gz VRKUPGHEZHQMOW-UHFFFAOYSA-N 1 0 278.396 3.895 20 5 CHBDRO C[C@@H]([NH2+]C1CCC(F)(F)CC1)c1ccccc1[N+](=O)[O-] ZINC000611181453 1121629361 /nfs/dbraw/zinc/62/93/61/1121629361.db2.gz JTMOWZPHDDIPCT-SNVBAGLBSA-N 1 0 284.306 3.823 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000611248258 1121632220 /nfs/dbraw/zinc/63/22/20/1121632220.db2.gz ZTORTDQRXXYLCP-VXGBXAGGSA-N 1 0 292.379 3.690 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)C1CCC1 ZINC000611337293 1121637980 /nfs/dbraw/zinc/63/79/80/1121637980.db2.gz YDDPRWNAVNLRMN-NEPJUHHUSA-N 1 0 262.353 3.742 20 5 CHBDRO CO[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000611337057 1121638066 /nfs/dbraw/zinc/63/80/66/1121638066.db2.gz KNYLHSSKJBBKBB-AEGPPILISA-N 1 0 292.379 3.511 20 5 CHBDRO CC1(C)C[C@@H]1[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000611468903 1121650473 /nfs/dbraw/zinc/65/04/73/1121650473.db2.gz GROPBOVEGBPPGK-NOLJZWGESA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC(F)(F)C1 ZINC000611475834 1121651648 /nfs/dbraw/zinc/65/16/48/1121651648.db2.gz JLRNTNAIJUZBJV-WDEREUQCSA-N 1 0 284.306 3.742 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CS[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000397941647 1121702885 /nfs/dbraw/zinc/70/28/85/1121702885.db2.gz VAJDLQSAJUHFEL-QKCSRTOESA-N 1 0 280.393 3.530 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)CCC2CC2)cccc1[N+](=O)[O-] ZINC000398057231 1121704459 /nfs/dbraw/zinc/70/44/59/1121704459.db2.gz ZIAOEFDICNBKOJ-LLVKDONJSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1ccc(C[NH2+]CCCSCC(C)C)cc1[N+](=O)[O-] ZINC001178203217 1121770762 /nfs/dbraw/zinc/77/07/62/1121770762.db2.gz BILUBOTXFXKPOF-UHFFFAOYSA-N 1 0 296.436 3.772 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000619785418 1129013496 /nfs/dbraw/zinc/01/34/96/1129013496.db2.gz QYJBZZBBXPNIPV-SFHVURJKSA-N 1 0 296.370 3.757 20 5 CHBDRO Cc1ccc(C[NH2+]C/C=C\c2ccccc2)cc1[N+](=O)[O-] ZINC000732986636 1121950132 /nfs/dbraw/zinc/95/01/32/1121950132.db2.gz GMEBHZPYZGXVOM-YVMONPNESA-N 1 0 282.343 3.706 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC1CCCCC1 ZINC000501834538 1122014363 /nfs/dbraw/zinc/01/43/63/1122014363.db2.gz XUPHHASQWXHDCP-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000502056166 1122032108 /nfs/dbraw/zinc/03/21/08/1122032108.db2.gz HNADYMCMUAZMOH-HOCLYGCPSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC001182951229 1122196994 /nfs/dbraw/zinc/19/69/94/1122196994.db2.gz ZJOKQWKLABIBJP-AWEZNQCLSA-N 1 0 282.771 3.917 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C2CCCCC2)cc1[N+](=O)[O-] ZINC000504886800 1122308841 /nfs/dbraw/zinc/30/88/41/1122308841.db2.gz DJLIQANKSHLNOG-GFCCVEGCSA-N 1 0 292.379 3.977 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CC2CCCC2)cc1[N+](=O)[O-] ZINC000504911481 1122309778 /nfs/dbraw/zinc/30/97/78/1122309778.db2.gz GWEVGAXZXYMNNY-LBPRGKRZSA-N 1 0 292.379 3.834 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505307360 1122356674 /nfs/dbraw/zinc/35/66/74/1122356674.db2.gz DSTJLOULXXIYCO-CQSZACIVSA-N 1 0 262.353 3.668 20 5 CHBDRO Cc1ccc(C[NH+]2CCC(C)(C)CC2)cc1[N+](=O)[O-] ZINC000514105594 1122377537 /nfs/dbraw/zinc/37/75/37/1122377537.db2.gz SIQCQAPPMMGZQR-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])CC1CCCCC1 ZINC000505563973 1122420622 /nfs/dbraw/zinc/42/06/22/1122420622.db2.gz KLCVFWRPSCDFMS-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO CC[N@H+](CCc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001190356618 1122534900 /nfs/dbraw/zinc/53/49/00/1122534900.db2.gz RSFDARABSLBVCP-UHFFFAOYSA-N 1 0 298.386 3.968 20 5 CHBDRO CC[C@H](C)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001190528832 1122541707 /nfs/dbraw/zinc/54/17/07/1122541707.db2.gz MQRPOJDZRJQTGP-ZDUSSCGKSA-N 1 0 264.369 3.851 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001190771099 1122555378 /nfs/dbraw/zinc/55/53/78/1122555378.db2.gz XIZQFFFDLQECHO-NSHDSACASA-N 1 0 298.333 3.884 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000505898560 1122593849 /nfs/dbraw/zinc/59/38/49/1122593849.db2.gz PYZVJMBTYRURRV-HNNXBMFYSA-N 1 0 292.354 3.889 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000437049690 1122607654 /nfs/dbraw/zinc/60/76/54/1122607654.db2.gz YPJBRPSSYJVHAQ-DYEKYZERSA-N 1 0 292.379 3.833 20 5 CHBDRO Cc1ccsc1C[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506064948 1122639000 /nfs/dbraw/zinc/63/90/00/1122639000.db2.gz ZXNHPXUSRCXKIJ-UHFFFAOYSA-N 1 0 290.388 3.905 20 5 CHBDRO Cc1c(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC001192481524 1122649511 /nfs/dbraw/zinc/64/95/11/1122649511.db2.gz NCVPHPDEZOWGAS-NUTKFTJISA-N 1 0 288.391 3.914 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@@H]1C ZINC001193413271 1122690367 /nfs/dbraw/zinc/69/03/67/1122690367.db2.gz MJIUBKZDGMADSN-BBRMVZONSA-N 1 0 276.380 3.995 20 5 CHBDRO CC[N@H+](CCc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC000054175574 1122755085 /nfs/dbraw/zinc/75/50/85/1122755085.db2.gz FKFSGOQQSCBMQH-UHFFFAOYSA-N 1 0 290.388 3.721 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000507140837 1122774786 /nfs/dbraw/zinc/77/47/86/1122774786.db2.gz DYYUDNAEPDQIFY-LBPRGKRZSA-N 1 0 268.382 3.667 20 5 CHBDRO C[C@@H](c1cccs1)N(C)Cc1csc([N+](=O)[O-])c1 ZINC000054173021 1122791936 /nfs/dbraw/zinc/79/19/36/1122791936.db2.gz JSADUCVIHREJER-VIFPVBQESA-N 1 0 282.390 3.911 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC001195147162 1122848968 /nfs/dbraw/zinc/84/89/68/1122848968.db2.gz KJTSRZBNKABHBE-HNNXBMFYSA-N 1 0 274.364 3.525 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507020291 1122919434 /nfs/dbraw/zinc/91/94/34/1122919434.db2.gz HHMQZBAGYQPYBH-UTSBKAFOSA-N 1 0 262.353 3.728 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000507114824 1122927462 /nfs/dbraw/zinc/92/74/62/1122927462.db2.gz CGRLDUJVDKGXBG-AWEZNQCLSA-N 1 0 262.353 3.524 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@@H]1c1ccccc1 ZINC000507162059 1122932400 /nfs/dbraw/zinc/93/24/00/1122932400.db2.gz UANIIZGPPHEXKL-DLBZAZTESA-N 1 0 296.370 3.830 20 5 CHBDRO Cc1ccccc1[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000507194402 1122937522 /nfs/dbraw/zinc/93/75/22/1122937522.db2.gz FZGCYJJZWYBYCD-MRXNPFEDSA-N 1 0 296.370 3.893 20 5 CHBDRO CC(C)[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000507319161 1122947621 /nfs/dbraw/zinc/94/76/21/1122947621.db2.gz OHFANYYGQNXZMC-UHFFFAOYSA-N 1 0 262.353 3.748 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CC(F)(F)C1 ZINC000519679471 1123014274 /nfs/dbraw/zinc/01/42/74/1123014274.db2.gz UYXRAWDEUVDBLO-SNVBAGLBSA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)s1 ZINC000049158833 1123132983 /nfs/dbraw/zinc/13/29/83/1123132983.db2.gz GFQHBBVKDYQTFD-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc(C[N@@H+](CC(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000508012049 1123254966 /nfs/dbraw/zinc/25/49/66/1123254966.db2.gz CFWYSKGLACKDJW-UHFFFAOYSA-N 1 0 262.353 3.524 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@@H]2C=CCC2)c2cc([N+](=O)[O-])ccc21 ZINC000850506896 1123276800 /nfs/dbraw/zinc/27/68/00/1123276800.db2.gz CHAARMJDXFNILG-ABAIWWIYSA-N 1 0 272.348 3.625 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000070305859 1123405554 /nfs/dbraw/zinc/40/55/54/1123405554.db2.gz PHVALFVUPBCNMO-NEPJUHHUSA-N 1 0 262.353 3.824 20 5 CHBDRO CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000219208494 1123443140 /nfs/dbraw/zinc/44/31/40/1123443140.db2.gz YRMWAIWOEKDXGC-CORIIIEPSA-N 1 0 294.420 3.920 20 5 CHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000542631611 1129129619 /nfs/dbraw/zinc/12/96/19/1129129619.db2.gz HCKWPEGSKGIJOD-CQSZACIVSA-N 1 0 292.379 3.758 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)C2(C)CC2)cccc1[N+](=O)[O-] ZINC000776884044 1123559492 /nfs/dbraw/zinc/55/94/92/1123559492.db2.gz WMQMJWSFUVTDAH-VXGBXAGGSA-N 1 0 262.353 3.742 20 5 CHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000542631609 1129129898 /nfs/dbraw/zinc/12/98/98/1129129898.db2.gz HCKWPEGSKGIJOD-AWEZNQCLSA-N 1 0 292.379 3.758 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000858169937 1123636110 /nfs/dbraw/zinc/63/61/10/1123636110.db2.gz FNNMTQMMPOKLBV-GREKMHCPSA-N 1 0 274.364 3.680 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1ccns1 ZINC000858575785 1123663924 /nfs/dbraw/zinc/66/39/24/1123663924.db2.gz DTMMWJBKCUCJTN-GHMZBOCLSA-N 1 0 291.376 3.772 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCC(C)C)cccc1[N+](=O)[O-] ZINC000151772808 1123781574 /nfs/dbraw/zinc/78/15/74/1123781574.db2.gz GNFKEAHQFASVTB-GFCCVEGCSA-N 1 0 250.342 3.600 20 5 CHBDRO C[C@@H]([NH2+]CCCCOC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000475312049 1123839219 /nfs/dbraw/zinc/83/92/19/1123839219.db2.gz KBSZLFTXYJLENK-CYBMUJFWSA-N 1 0 294.395 3.841 20 5 CHBDRO C[C@H](CCc1cccnc1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000866243521 1124040505 /nfs/dbraw/zinc/04/05/05/1124040505.db2.gz RSTPATGNTQODLG-KGLIPLIRSA-N 1 0 299.374 3.662 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@@H]1CCSC1 ZINC000866403834 1124063777 /nfs/dbraw/zinc/06/37/77/1124063777.db2.gz WTXPEEFXBQKAIK-CHWSQXEVSA-N 1 0 294.420 3.697 20 5 CHBDRO CC[N@H+](Cc1ccc(C)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000519917665 1124068820 /nfs/dbraw/zinc/06/88/20/1124068820.db2.gz BVUSUJFHXWPUST-UHFFFAOYSA-N 1 0 284.359 3.925 20 5 CHBDRO CCC[C@H]([NH2+]CCCCOCC)c1cccc([N+](=O)[O-])c1 ZINC000268869936 1124080327 /nfs/dbraw/zinc/08/03/27/1124080327.db2.gz OYKARVZDNRORDY-INIZCTEOSA-N 1 0 294.395 3.842 20 5 CHBDRO COc1cc(C[N@@H+]2CCCCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000446063497 1124108714 /nfs/dbraw/zinc/10/87/14/1124108714.db2.gz QWWDFKXRGMJUIK-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO CC[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000446722391 1124120255 /nfs/dbraw/zinc/12/02/55/1124120255.db2.gz FLCIEXGGXBRJAM-CYBMUJFWSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H](CC1CC1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447535881 1124484585 /nfs/dbraw/zinc/48/45/85/1124484585.db2.gz JCIYJBNOEYPXBA-MEDUHNTESA-N 1 0 274.364 3.750 20 5 CHBDRO CC(C)=CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447596109 1124496181 /nfs/dbraw/zinc/49/61/81/1124496181.db2.gz BIFGEDBMGXMXIC-INIZCTEOSA-N 1 0 274.364 3.918 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC(C)(C)C1 ZINC000526108414 1124507287 /nfs/dbraw/zinc/50/72/87/1124507287.db2.gz OKSTXFZBLBRDPD-CYBMUJFWSA-N 1 0 290.407 3.942 20 5 CHBDRO Cc1ccsc1C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449106212 1124647668 /nfs/dbraw/zinc/64/76/68/1124647668.db2.gz LBQZEWGFWJVLQJ-GFCCVEGCSA-N 1 0 290.388 3.686 20 5 CHBDRO CC(C)OC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000871933708 1124653522 /nfs/dbraw/zinc/65/35/22/1124653522.db2.gz WTWFHORJRIOBMP-CYBMUJFWSA-N 1 0 292.379 3.593 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1C=CCC1 ZINC000872086158 1124679662 /nfs/dbraw/zinc/67/96/62/1124679662.db2.gz UKDBUQLPUJNJOJ-QWRGUYRKSA-N 1 0 278.377 3.686 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)s1 ZINC000873013811 1124734348 /nfs/dbraw/zinc/73/43/48/1124734348.db2.gz ICKKRPMQDFXAIK-UHFFFAOYSA-N 1 0 290.388 3.871 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccccc1F ZINC000873007601 1124734574 /nfs/dbraw/zinc/73/45/74/1124734574.db2.gz WPKNZDROBSZTNW-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000873105870 1124737756 /nfs/dbraw/zinc/73/77/56/1124737756.db2.gz BRTKYOFYEOJSDU-NSHDSACASA-N 1 0 290.285 3.724 20 5 CHBDRO CC(C)=CCC[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000449442189 1124749860 /nfs/dbraw/zinc/74/98/60/1124749860.db2.gz KATAFGSPSUNVDM-NSHDSACASA-N 1 0 268.382 3.881 20 5 CHBDRO CC[N@H+](Cc1ccccn1)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000876725938 1124971984 /nfs/dbraw/zinc/97/19/84/1124971984.db2.gz QTMCAJJDXCICTI-UHFFFAOYSA-N 1 0 299.374 3.629 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000532072963 1125232517 /nfs/dbraw/zinc/23/25/17/1125232517.db2.gz AXHCTTGTWNISSM-NSHDSACASA-N 1 0 268.382 3.668 20 5 CHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000212970249 1125357291 /nfs/dbraw/zinc/35/72/91/1125357291.db2.gz IRYMPEBZKSADFE-ZDUSSCGKSA-N 1 0 280.343 3.889 20 5 CHBDRO CC(C)(C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])CC(F)F ZINC000883251743 1125385098 /nfs/dbraw/zinc/38/50/98/1125385098.db2.gz AUOLZPZBVAWPDT-FNORWQNLSA-N 1 0 298.333 3.879 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000171130836 1125404452 /nfs/dbraw/zinc/40/44/52/1125404452.db2.gz HVBABJITCIOSLI-CYBMUJFWSA-N 1 0 299.374 3.512 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000132493215 1125419338 /nfs/dbraw/zinc/41/93/38/1125419338.db2.gz OFDPOFTXEVKADN-IAQYHMDHSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)C1CC(F)(F)C1)c1ccccc1[N+](=O)[O-] ZINC000897461884 1125424047 /nfs/dbraw/zinc/42/40/47/1125424047.db2.gz ZUEFBJPMXFFOQN-MNOVXSKESA-N 1 0 298.333 3.722 20 5 CHBDRO CCC1CCC(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000037905215 1129289750 /nfs/dbraw/zinc/28/97/50/1129289750.db2.gz SQNFBCARAXQLDL-UHFFFAOYSA-N 1 0 276.380 3.901 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC2(CCCC2)C1 ZINC000743864080 1129542538 /nfs/dbraw/zinc/54/25/38/1129542538.db2.gz UUNZZWYYAHSVCW-CYBMUJFWSA-N 1 0 274.364 3.922 20 5 CHBDRO CC1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000303862473 1129576294 /nfs/dbraw/zinc/57/62/94/1129576294.db2.gz GTLKAPPGUNAUKZ-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CC12CC2 ZINC000822497935 1131384382 /nfs/dbraw/zinc/38/43/82/1131384382.db2.gz OQUCBYQQHQRCQB-SNVBAGLBSA-N 1 0 287.146 3.544 20 5 CHBDRO CSC1CCC(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000720565905 1129662957 /nfs/dbraw/zinc/66/29/57/1129662957.db2.gz CZPHESRKDFTOJE-UHFFFAOYSA-N 1 0 294.420 3.606 20 5 CHBDRO CC(C)[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1F ZINC001168982835 1129686971 /nfs/dbraw/zinc/68/69/71/1129686971.db2.gz JBWXQVGEIXGDOT-XEZPLFJOSA-N 1 0 294.370 3.558 20 5 CHBDRO CC1(C)C[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001169004704 1129688955 /nfs/dbraw/zinc/68/89/55/1129688955.db2.gz ODPFBHOBFKJXRX-UHFFFAOYSA-N 1 0 294.370 3.992 20 5 CHBDRO CCCCC1CCC([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168987281 1129689780 /nfs/dbraw/zinc/68/97/80/1129689780.db2.gz HXONJTIKRFXONM-BHDPWAOGSA-N 1 0 282.428 3.770 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168987178 1129689962 /nfs/dbraw/zinc/68/99/62/1129689962.db2.gz HGUAUMWNWMHEMD-APHBMKBZSA-N 1 0 294.370 3.558 20 5 CHBDRO CCCC[N@H+](Cc1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169030251 1129690623 /nfs/dbraw/zinc/69/06/23/1129690623.db2.gz XJUBTDQGFYXXBO-DLBZAZTESA-N 1 0 290.407 3.734 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001169334338 1129718828 /nfs/dbraw/zinc/71/88/28/1129718828.db2.gz XTJLEUXQTPSSMD-GOEBONIOSA-N 1 0 276.380 3.995 20 5 CHBDRO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC000796524675 1129773280 /nfs/dbraw/zinc/77/32/80/1129773280.db2.gz DFLCBMBAQYFGHD-ZDUSSCGKSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1ccc(C[NH+]2[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000768137330 1129835398 /nfs/dbraw/zinc/83/53/98/1129835398.db2.gz MAFCKASKHHMHPV-CHWSQXEVSA-N 1 0 262.353 3.666 20 5 CHBDRO CCO[C@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000902999359 1130098232 /nfs/dbraw/zinc/09/82/32/1130098232.db2.gz BLSLTKNGWPRANH-BJJXKVORSA-N 1 0 292.379 3.593 20 5 CHBDRO CCCC[N@H+](CC)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746656434 1130135315 /nfs/dbraw/zinc/13/53/15/1130135315.db2.gz XXQFZPGWQXGEDL-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000903245847 1130135790 /nfs/dbraw/zinc/13/57/90/1130135790.db2.gz OWSLSVQNPLNIED-UONOGXRCSA-N 1 0 299.374 3.753 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C1CCSCC1)c1ccc([N+](=O)[O-])cc1 ZINC000903288590 1130146443 /nfs/dbraw/zinc/14/64/43/1130146443.db2.gz ZUQHGYDNIZEHIX-VXGBXAGGSA-N 1 0 294.420 3.777 20 5 CHBDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000903338542 1130161601 /nfs/dbraw/zinc/16/16/01/1130161601.db2.gz IQXNDGQYVOCLBT-YVEFUNNKSA-N 1 0 297.358 3.792 20 5 CHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1C=CCCCCC1 ZINC001170192571 1130457226 /nfs/dbraw/zinc/45/72/26/1130457226.db2.gz AFXSKHSYSFXIFI-INIZCTEOSA-N 1 0 288.391 3.958 20 5 CHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)CC(C)C)c([N+](=O)[O-])c1 ZINC001170310428 1130481148 /nfs/dbraw/zinc/48/11/48/1130481148.db2.gz VUBBBJNTEYGWSA-QWHCGFSZSA-N 1 0 294.395 3.559 20 5 CHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)CC(C)C)c([N+](=O)[O-])c1 ZINC001170310427 1130484100 /nfs/dbraw/zinc/48/41/00/1130484100.db2.gz VUBBBJNTEYGWSA-OLZOCXBDSA-N 1 0 294.395 3.559 20 5 CHBDRO C[N@H+](CCCCCF)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000792869070 1130503443 /nfs/dbraw/zinc/50/34/43/1130503443.db2.gz ACBBUQQYSRIEQA-UHFFFAOYSA-N 1 0 288.750 3.820 20 5 CHBDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000782107228 1130755482 /nfs/dbraw/zinc/75/54/82/1130755482.db2.gz LFQHECREIDQWIP-LRDDRELGSA-N 1 0 292.354 3.746 20 5 CHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000782107230 1130755743 /nfs/dbraw/zinc/75/57/43/1130755743.db2.gz LFQHECREIDQWIP-MLGOLLRUSA-N 1 0 292.354 3.746 20 5 CHBDRO CC(C)[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783527033 1130834755 /nfs/dbraw/zinc/83/47/55/1130834755.db2.gz UNTQRXNKDRFKIO-CYBMUJFWSA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@H]([NH2+]C1CCCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815553404 1130998211 /nfs/dbraw/zinc/99/82/11/1130998211.db2.gz ZCUHOTIXZVQKRV-NSHDSACASA-N 1 0 277.368 3.550 20 5 CHBDRO C[C@H](CCc1ccccc1)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116330152 1131141169 /nfs/dbraw/zinc/14/11/69/1131141169.db2.gz WJIPSBBZHSHIKS-CQSZACIVSA-N 1 0 296.370 3.932 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C/C=C/C2CC2)cc1[N+](=O)[O-] ZINC001117712174 1131193653 /nfs/dbraw/zinc/19/36/53/1131193653.db2.gz CTMSSWUGJDYIFK-ITKZLYELSA-N 1 0 290.363 3.610 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000844440928 1131564946 /nfs/dbraw/zinc/56/49/46/1131564946.db2.gz WUDNGKNVWGRDLW-CQSZACIVSA-N 1 0 296.317 3.524 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc2c(c1)[nH]c1ccccc12 ZINC001228487192 1131893060 /nfs/dbraw/zinc/89/30/60/1131893060.db2.gz SDVPRWSPCLSCBM-ZDUSSCGKSA-N 1 0 283.395 3.795 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000773122463 1131951768 /nfs/dbraw/zinc/95/17/68/1131951768.db2.gz UABKRYRGDRXJPS-RYUDHWBXSA-N 1 0 273.336 3.643 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000037011421 1131987785 /nfs/dbraw/zinc/98/77/85/1131987785.db2.gz NYOKDCVPJDXYHB-LALPHHSUSA-N 1 0 292.379 3.518 20 5 CHBDRO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC(C)C ZINC000037111562 1131996815 /nfs/dbraw/zinc/99/68/15/1131996815.db2.gz BFHQYFGRWRMGDY-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[N@@H+]1CC[C@@H](Oc2c3ccccc3c(O)c3ccccc32)C1 ZINC001229025666 1132001737 /nfs/dbraw/zinc/00/17/37/1132001737.db2.gz XLLSBPMAWXHODI-CYBMUJFWSA-N 1 0 293.366 3.782 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000037253578 1132024448 /nfs/dbraw/zinc/02/44/48/1132024448.db2.gz SZCGAHQZXRTWFN-MBNYWOFBSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(-c2ccc(F)cc2)cc1 ZINC001229448519 1132068742 /nfs/dbraw/zinc/06/87/42/1132068742.db2.gz CAQRNQXPIGBMDB-CQSZACIVSA-N 1 0 288.386 3.966 20 5 CHBDRO CC1(O)C[NH+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001141723394 1132239659 /nfs/dbraw/zinc/23/96/59/1132239659.db2.gz WGQUMAUFEOKXIX-UHFFFAOYSA-N 1 0 277.367 3.560 20 5 CHBDRO CCCc1ccc2cccnc2c1O[C@@H](C)C[N+](C)(C)C ZINC001231328205 1132282836 /nfs/dbraw/zinc/28/28/36/1132282836.db2.gz YXXZQZJRJYEYRJ-AWEZNQCLSA-N 1 0 287.427 3.661 20 5 CHBDRO C[C@H]1CCC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909242 1132371088 /nfs/dbraw/zinc/37/10/88/1132371088.db2.gz RJXKRMMNARCDSE-BBRMVZONSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC(C)(C)C1 ZINC001173221745 1132411071 /nfs/dbraw/zinc/41/10/71/1132411071.db2.gz POZHRKSTDKHDLT-OCCSQVGLSA-N 1 0 276.380 3.694 20 5 CHBDRO CCC1CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173223139 1132412489 /nfs/dbraw/zinc/41/24/89/1132412489.db2.gz YMGNPPMTOYCBCS-CYBMUJFWSA-N 1 0 276.380 3.648 20 5 CHBDRO CCC[N@H+](CC1CC1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173226584 1132412501 /nfs/dbraw/zinc/41/25/01/1132412501.db2.gz MRACCAAZZHIDLQ-ZDUSSCGKSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1Cc2ccccc2C1 ZINC001173230046 1132413654 /nfs/dbraw/zinc/41/36/54/1132413654.db2.gz XLJDGYWGGDDJCJ-ZDUSSCGKSA-N 1 0 282.343 3.542 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001173233975 1132413955 /nfs/dbraw/zinc/41/39/55/1132413955.db2.gz NKEMCYFJAOZGFC-MGPQQGTHSA-N 1 0 276.380 3.504 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC1CCCC1 ZINC001173235669 1132414839 /nfs/dbraw/zinc/41/48/39/1132414839.db2.gz YKAUQLIBNRDLHL-ZDUSSCGKSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1cc(C)cc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173213178 1132416199 /nfs/dbraw/zinc/41/61/99/1132416199.db2.gz GCGFARHHXXTAEH-OAHLLOKOSA-N 1 0 298.386 3.932 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(C)CCCC1 ZINC001173210378 1132416283 /nfs/dbraw/zinc/41/62/83/1132416283.db2.gz KALMDFVOGVMIBN-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO CC(C)[N@H+](C)Cc1ccc2ccc3cccnc3c2n1 ZINC001232219168 1132439094 /nfs/dbraw/zinc/43/90/94/1132439094.db2.gz MCPZYUWQKLOYHZ-UHFFFAOYSA-N 1 0 265.360 3.623 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232218687 1132439601 /nfs/dbraw/zinc/43/96/01/1132439601.db2.gz JYSKWHCTAVUUQV-CYBMUJFWSA-N 1 0 277.371 3.625 20 5 CHBDRO CC(C)(C[NH3+])c1ccc(Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC001159579718 1132866396 /nfs/dbraw/zinc/86/63/96/1132866396.db2.gz HHTMAXUZJUUXMJ-UHFFFAOYSA-N 1 0 285.347 3.575 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2ccccc2C[NH+]2CCCC2)cc1 ZINC001174478685 1132882441 /nfs/dbraw/zinc/88/24/41/1132882441.db2.gz VUNNXNGPWKOIJX-UHFFFAOYSA-N 1 0 297.358 3.934 20 5 CHBDRO c1ccc2nc3ccc(NC4=CCC[NH2+]C4)cc3cc2c1 ZINC001159742110 1132902709 /nfs/dbraw/zinc/90/27/09/1132902709.db2.gz VMEGDRWRJOKEMK-UHFFFAOYSA-N 1 0 275.355 3.677 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCc1ncccc1C ZINC001161883647 1133038305 /nfs/dbraw/zinc/03/83/05/1133038305.db2.gz RIMLILSEPKRJJV-UHFFFAOYSA-N 1 0 284.427 3.598 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H](C)[N@@H+]2CCCC[C@@H]2C)c1 ZINC001162152891 1133054374 /nfs/dbraw/zinc/05/43/74/1133054374.db2.gz JKJVHHQQVCEHAL-KBPBESRZSA-N 1 0 291.395 3.578 20 5 CHBDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001205489672 1133582567 /nfs/dbraw/zinc/58/25/67/1133582567.db2.gz WVLZQHRUDVDPMW-SWLSCSKDSA-N 1 0 276.380 3.832 20 5 CHBDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001205489671 1133582698 /nfs/dbraw/zinc/58/26/98/1133582698.db2.gz WVLZQHRUDVDPMW-IUODEOHRSA-N 1 0 276.380 3.832 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@@H](C3CC3)[C@@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001205875831 1133625462 /nfs/dbraw/zinc/62/54/62/1133625462.db2.gz PNHOAPBNFIKFGD-RDJZCZTQSA-N 1 0 286.375 3.524 20 5 CHBDRO C[C@H]([NH2+]Cc1cccn1C(F)F)c1ccccc1[N+](=O)[O-] ZINC001207433553 1133802459 /nfs/dbraw/zinc/80/24/59/1133802459.db2.gz MBLIZLOSDOLVTJ-JTQLQIEISA-N 1 0 295.289 3.642 20 5 CHBDRO Cc1ccc(Nc2cc[nH+]c(C3CC3)c2)cc1[N+](=O)[O-] ZINC001213665822 1134476532 /nfs/dbraw/zinc/47/65/32/1134476532.db2.gz NDOQUBQWUWYAJK-UHFFFAOYSA-N 1 0 269.304 3.919 20 5 CHBDRO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1cccc([N+](=O)[O-])c1 ZINC000403504429 1134790796 /nfs/dbraw/zinc/79/07/96/1134790796.db2.gz JCCUROGBBSFHNB-WAEYWBMLSA-N 1 0 292.404 3.672 20 5 CHBDRO C[C@H]1[NH2+]C[C@@H]1OCc1c2ccccc2cc2ccccc21 ZINC001217905622 1135021670 /nfs/dbraw/zinc/02/16/70/1135021670.db2.gz AIDNLYLAJPTRBU-YJYMSZOUSA-N 1 0 277.367 3.870 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@@H]1CCCC[NH2+]C1 ZINC001217972006 1135033952 /nfs/dbraw/zinc/03/39/52/1135033952.db2.gz BJLCDMGCUZYRSV-OAHLLOKOSA-N 1 0 292.382 3.909 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2O[C@@H]1CC[NH2+]C1 ZINC001218035396 1135046669 /nfs/dbraw/zinc/04/66/69/1135046669.db2.gz CDXNASCIXOPTBU-OAHLLOKOSA-N 1 0 263.340 3.734 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@H]3CCC34C[NH2+]C4)cc2c1 ZINC001218241361 1135073071 /nfs/dbraw/zinc/07/30/71/1135073071.db2.gz SWDQQKPRBBPZFZ-KRWDZBQOSA-N 1 0 290.366 3.519 20 5 CHBDRO C[C@@H]1C[NH2+]CC[C@@H]1Oc1nc2ccccc2c2ccccc21 ZINC001218419252 1135102365 /nfs/dbraw/zinc/10/23/65/1135102365.db2.gz LNTUTKQIDWYWGJ-ACJLOTCBSA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OC(Cl)(Cl)c1ccccc1F ZINC001223768058 1135380570 /nfs/dbraw/zinc/38/05/70/1135380570.db2.gz CGNFJUAGXSMOSG-JTQLQIEISA-N 1 0 295.205 3.525 20 5 CHBDRO CC(C)[N@@H+]1CCC[C@H](O[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001224024708 1135412031 /nfs/dbraw/zinc/41/20/31/1135412031.db2.gz KTKVZOWWGQXVPR-BBRMVZONSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H](OCCC[N+](C)(C)C)c1ccc(Cl)cc1 ZINC001224623649 1135462447 /nfs/dbraw/zinc/46/24/47/1135462447.db2.gz OZGFPIOPWPRGRW-LBPRGKRZSA-N 1 0 256.797 3.514 20 5 CHBDRO CCCCC[C@H]1CC[C@H](OCC[N+](C)(C)C)CC1 ZINC001224772593 1135480541 /nfs/dbraw/zinc/48/05/41/1135480541.db2.gz AUCVBMUAZIPJSI-WKILWMFISA-N 1 0 256.454 3.848 20 5 CHBDRO CCC(C)(C)c1ccc(O[C@H](C)C[N+](C)(C)C)cc1 ZINC001225532771 1135584864 /nfs/dbraw/zinc/58/48/64/1135584864.db2.gz AYUJTCREBGPGJY-CQSZACIVSA-N 1 0 264.433 3.848 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1nc2ccccc2c2ccccc21 ZINC001226992648 1135772144 /nfs/dbraw/zinc/77/21/44/1135772144.db2.gz NEJMDSOAEALLEV-AWEZNQCLSA-N 1 0 295.406 3.862 20 5 CHBDRO CCc1ccc(C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)cn1 ZINC000352753295 529654992 /nfs/dbraw/zinc/65/49/92/529654992.db2.gz DHLYUGYDYAEDGC-KRWDZBQOSA-N 1 0 299.374 3.793 20 5 CHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC000344460645 530004461 /nfs/dbraw/zinc/00/44/61/530004461.db2.gz IYTUGASOXBOYSP-ZDUSSCGKSA-N 1 0 262.353 3.605 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000020085776 170987645 /nfs/dbraw/zinc/98/76/45/170987645.db2.gz QUJCZGFIMWSGEE-FZMZJTMJSA-N 1 0 250.342 3.824 20 5 CHBDRO CCC[C@@H]([NH2+]CC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000037179406 173013023 /nfs/dbraw/zinc/01/30/23/173013023.db2.gz XCVICSCOISHKKQ-OAHLLOKOSA-N 1 0 262.353 3.826 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000071205887 176080212 /nfs/dbraw/zinc/08/02/12/176080212.db2.gz YCDYNJQNFDWGBI-VHRBIJSZSA-N 1 0 262.353 3.742 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000348338228 226455976 /nfs/dbraw/zinc/45/59/76/226455976.db2.gz VBNILXJEGBPOLA-CYZMBNFOSA-N 1 0 296.342 3.535 20 5 CHBDRO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H]2C2CCC2)c(F)c1 ZINC000352043302 228176748 /nfs/dbraw/zinc/17/67/48/228176748.db2.gz BZDBYXWMFMKVNH-HNNXBMFYSA-N 1 0 296.317 3.638 20 5 CHBDRO Cc1ccccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000037488633 260110405 /nfs/dbraw/zinc/11/04/05/260110405.db2.gz XPJSJEYYQLKUJQ-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1ccsc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000075675546 260166201 /nfs/dbraw/zinc/16/62/01/260166201.db2.gz IGDWSQZUUUZFDG-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO O=[N+]([O-])c1ccccc1CNc1cc[nH+]c2ccccc12 ZINC000050015867 260677644 /nfs/dbraw/zinc/67/76/44/260677644.db2.gz QGSITBIHRBGAPU-UHFFFAOYSA-N 1 0 279.299 3.755 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1ccccn1 ZINC000152366545 261063468 /nfs/dbraw/zinc/06/34/68/261063468.db2.gz GPIOEYGOWKVQQX-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1cccnc1 ZINC000158517801 261166691 /nfs/dbraw/zinc/16/66/91/261166691.db2.gz FLZIHZHMYFWMOH-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@H]([NH2+]CCc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000020088801 262228315 /nfs/dbraw/zinc/22/83/15/262228315.db2.gz FMCLFJASGRWBQQ-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000020473273 262240290 /nfs/dbraw/zinc/24/02/90/262240290.db2.gz RDJURVWEWDZUDC-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000020526059 262245885 /nfs/dbraw/zinc/24/58/85/262245885.db2.gz CPWSVEAEZBBUFG-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1nccs1 ZINC000186733459 262321329 /nfs/dbraw/zinc/32/13/29/262321329.db2.gz OEXDRXCKDQIDRI-GHMZBOCLSA-N 1 0 291.376 3.506 20 5 CHBDRO CCCC[C@H](CC)C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000021508413 262389780 /nfs/dbraw/zinc/38/97/80/262389780.db2.gz RTUUKVZYJIREHQ-ZDUSSCGKSA-N 1 0 264.369 3.901 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCc3sccc32)cs1 ZINC000061360215 262394931 /nfs/dbraw/zinc/39/49/31/262394931.db2.gz MQGLTAXGVQFRPO-LLVKDONJSA-N 1 0 294.401 3.885 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000284047756 263085423 /nfs/dbraw/zinc/08/54/23/263085423.db2.gz KCGOVUWJIZJVNM-RYUDHWBXSA-N 1 0 285.347 3.589 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)cc1[N+](=O)[O-] ZINC000187861063 263280699 /nfs/dbraw/zinc/28/06/99/263280699.db2.gz HLCYRONMGPJBHR-OCCSQVGLSA-N 1 0 292.379 3.511 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@H](OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000188830967 264247994 /nfs/dbraw/zinc/24/79/94/264247994.db2.gz FPAVGILOVANMNA-BPUTZDHNSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000094266088 265233984 /nfs/dbraw/zinc/23/39/84/265233984.db2.gz OVQZXOOBPOELRH-CQSZACIVSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000226173828 266031504 /nfs/dbraw/zinc/03/15/04/266031504.db2.gz XOXSDEGMCHOOOO-TYNCELHUSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1occc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000358011654 266396518 /nfs/dbraw/zinc/39/65/18/266396518.db2.gz GRDGKZQOHMJUCZ-LLVKDONJSA-N 1 0 274.320 3.655 20 5 CHBDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000359293446 266561034 /nfs/dbraw/zinc/56/10/34/266561034.db2.gz FLEHWNOBCZSDNQ-XJKSGUPXSA-N 1 0 274.364 3.607 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)CC(C)(C)OC)c1cccc([N+](=O)[O-])c1 ZINC000122032133 267797194 /nfs/dbraw/zinc/79/71/94/267797194.db2.gz BUGZMOSSWSICHM-DOMZBBRYSA-N 1 0 294.395 3.839 20 5 CHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000062726442 327894545 /nfs/dbraw/zinc/89/45/45/327894545.db2.gz XIRCARHSBMGUBF-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000040675995 328015606 /nfs/dbraw/zinc/01/56/06/328015606.db2.gz NXQRFSWTIKPRIN-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000049119637 328339934 /nfs/dbraw/zinc/33/99/34/328339934.db2.gz MIODRWHIKCJBCE-GDBMZVCRSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000049120321 328340139 /nfs/dbraw/zinc/34/01/39/328340139.db2.gz ZWSDZZJUMCKDOO-ZIAGYGMSSA-N 1 0 292.379 3.662 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000049155833 328350632 /nfs/dbraw/zinc/35/06/32/328350632.db2.gz GBVWLPGCZCIUCJ-NWDGAFQWSA-N 1 0 290.388 3.938 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532038788 328396958 /nfs/dbraw/zinc/39/69/58/328396958.db2.gz BCLCWNCHEYHANI-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H](c2ccccc2)C2CC2)cs1 ZINC000037562974 326855396 /nfs/dbraw/zinc/85/53/96/326855396.db2.gz RSOOLOCYTXOUFH-OAHLLOKOSA-N 1 0 288.372 3.897 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000558220503 327079160 /nfs/dbraw/zinc/07/91/60/327079160.db2.gz QFVMBGKRWUPKSZ-OLZOCXBDSA-N 1 0 262.353 3.509 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000558220502 327079248 /nfs/dbraw/zinc/07/92/48/327079248.db2.gz QFVMBGKRWUPKSZ-CHWSQXEVSA-N 1 0 262.353 3.509 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000558259593 327082949 /nfs/dbraw/zinc/08/29/49/327082949.db2.gz UJZAHGLDUHYAFM-GJZGRUSLSA-N 1 0 276.380 3.552 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000558257077 327083397 /nfs/dbraw/zinc/08/33/97/327083397.db2.gz LPTQGPDLBRSFFD-GDBMZVCRSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@H]([NH2+]C1CC(C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000558293435 327085933 /nfs/dbraw/zinc/08/59/33/327085933.db2.gz GEQVLRCQCYSVCD-MFAVDMRSSA-N 1 0 288.269 3.586 20 5 CHBDRO C[N@H+](CCCc1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000558740173 327118465 /nfs/dbraw/zinc/11/84/65/327118465.db2.gz WSCUZGIQRYZTNW-UHFFFAOYSA-N 1 0 298.386 3.702 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@@H]2F)c2cc([N+](=O)[O-])ccc21 ZINC000559917523 327271137 /nfs/dbraw/zinc/27/11/37/327271137.db2.gz QJFNGAKWURYCOD-ZNMIVQPWSA-N 1 0 292.354 3.797 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000532269694 328710796 /nfs/dbraw/zinc/71/07/96/328710796.db2.gz PDQXTXSAAVSKLH-GFCCVEGCSA-N 1 0 284.306 3.571 20 5 CHBDRO CSCC1CCC([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000395456666 328738333 /nfs/dbraw/zinc/73/83/33/328738333.db2.gz QACAPMNNWODLFL-UHFFFAOYSA-N 1 0 294.420 3.606 20 5 CHBDRO CC1=CC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000582537108 329108497 /nfs/dbraw/zinc/10/84/97/329108497.db2.gz NYDWIIPVAAIQSW-JSGCOSHPSA-N 1 0 260.337 3.744 20 5 CHBDRO CCC[C@H]([NH2+]Cc1cncc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000181827529 329237681 /nfs/dbraw/zinc/23/76/81/329237681.db2.gz IQZUREFEPMTGPB-KRWDZBQOSA-N 1 0 299.374 3.929 20 5 CHBDRO CCC1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000230144439 329362860 /nfs/dbraw/zinc/36/28/60/329362860.db2.gz NFGUAWZHNWVRGM-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1C[C@@H]1C ZINC000321713800 329393290 /nfs/dbraw/zinc/39/32/90/329393290.db2.gz VQQIVOGQCCWIIR-DRABBMOASA-N 1 0 262.353 3.680 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000222029396 329619196 /nfs/dbraw/zinc/61/91/96/329619196.db2.gz WBFTXMDZMYINBD-WCQYABFASA-N 1 0 262.353 3.600 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H]1CC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000222055242 329656989 /nfs/dbraw/zinc/65/69/89/329656989.db2.gz GXYGJKUMRNVODP-GXTWGEPZSA-N 1 0 262.353 3.682 20 5 CHBDRO CC(C)=CCC[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000571796751 329921443 /nfs/dbraw/zinc/92/14/43/329921443.db2.gz ARSMDCKFTVKUMD-CYBMUJFWSA-N 1 0 262.353 3.819 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@H]2c2cccn2C)cccc1[N+](=O)[O-] ZINC000079865247 330063047 /nfs/dbraw/zinc/06/30/47/330063047.db2.gz PHNHNFYMWZIGQZ-KRWDZBQOSA-N 1 0 299.374 3.579 20 5 CHBDRO CC[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CCO1 ZINC000421854586 330088499 /nfs/dbraw/zinc/08/84/99/330088499.db2.gz KWLSFCFZUOAPOR-MGPQQGTHSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000396933641 330231636 /nfs/dbraw/zinc/23/16/36/330231636.db2.gz BWIWFHUHNHVNAT-ZJUUUORDSA-N 1 0 290.285 3.834 20 5 CHBDRO CC1(C)C[C@@H]1C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000536865778 330253908 /nfs/dbraw/zinc/25/39/08/330253908.db2.gz WUPLNNZSQQFHGF-CABCVRRESA-N 1 0 288.391 3.552 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000536870727 330263878 /nfs/dbraw/zinc/26/38/78/330263878.db2.gz PLKWMXKLVDJUKJ-UHTWSYAYSA-N 1 0 264.369 3.988 20 5 CHBDRO CC(C)[C@H](C)[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000536873618 330281767 /nfs/dbraw/zinc/28/17/67/330281767.db2.gz ZFQSDXSKOQOBAJ-ZDUSSCGKSA-N 1 0 264.369 3.552 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC(F)(F)F ZINC000536879721 330318088 /nfs/dbraw/zinc/31/80/88/330318088.db2.gz ZPYLAWYPSSTOSW-SECBINFHSA-N 1 0 276.258 3.506 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H]1C1CCC1 ZINC000424284387 330334062 /nfs/dbraw/zinc/33/40/62/330334062.db2.gz CKBJZBOXFWIVPE-KCXAZCMYSA-N 1 0 288.391 3.552 20 5 CHBDRO CC(C)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000445436429 330342618 /nfs/dbraw/zinc/34/26/18/330342618.db2.gz RBVJCHYPCCCBOQ-QWHCGFSZSA-N 1 0 262.353 3.634 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000045628992 330347285 /nfs/dbraw/zinc/34/72/85/330347285.db2.gz NXJUDYMCCJNWQP-QWHCGFSZSA-N 1 0 260.337 3.602 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](C)CC1 ZINC000533247090 330355177 /nfs/dbraw/zinc/35/51/77/330355177.db2.gz LMQZXEYFOYAJKK-STQMWFEESA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](C)CC1 ZINC000533247088 330355276 /nfs/dbraw/zinc/35/52/76/330355276.db2.gz LMQZXEYFOYAJKK-OLZOCXBDSA-N 1 0 262.353 3.778 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC000120184343 330386188 /nfs/dbraw/zinc/38/61/88/330386188.db2.gz QQBKLTGQXJPXMP-HNNXBMFYSA-N 1 0 282.343 3.584 20 5 CHBDRO C[C@H](CC[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000060394184 330415297 /nfs/dbraw/zinc/41/52/97/330415297.db2.gz BCRODNJLRGCIIJ-GFCCVEGCSA-N 1 0 290.388 3.940 20 5 CHBDRO C[C@H]1CC([NH2+]Cc2cccc([N+](=O)[O-])c2)C[C@H](C)C1 ZINC000084461585 330485780 /nfs/dbraw/zinc/48/57/80/330485780.db2.gz WNLDDEKBTUYHEQ-VXGBXAGGSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@H](Nc1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)[NH+](C)C ZINC000439132104 330734281 /nfs/dbraw/zinc/73/42/81/330734281.db2.gz WSOXQTWQKPEWDB-GUYCJALGSA-N 1 0 299.374 3.698 20 5 CHBDRO CC(C)(C)C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447544186 330869493 /nfs/dbraw/zinc/86/94/93/330869493.db2.gz UQSHPOJSGQPLFU-CQSZACIVSA-N 1 0 262.353 3.608 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H]1C(C)C ZINC000470175504 331042197 /nfs/dbraw/zinc/04/21/97/331042197.db2.gz ZBZHAUSLVKYSCM-WQMJKPAKSA-N 1 0 274.364 3.728 20 5 CHBDRO CC[C@H](C)[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)OC ZINC000453267045 331109202 /nfs/dbraw/zinc/10/92/02/331109202.db2.gz LOLADXKATPCOGW-GHJWDPDVSA-N 1 0 294.395 3.615 20 5 CHBDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453419527 331130553 /nfs/dbraw/zinc/13/05/53/331130553.db2.gz VPUPBTFZIDJESR-JGGQBBKZSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H](C1CC1)C1CCC1 ZINC000453627169 331137106 /nfs/dbraw/zinc/13/71/06/331137106.db2.gz UUNYJKIIGDQWHR-RLXIPRIJSA-N 1 0 286.375 3.776 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000164091136 331161219 /nfs/dbraw/zinc/16/12/19/331161219.db2.gz NQEQKODHDWNNEK-YPMHNXCESA-N 1 0 282.409 3.695 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464777033 331367516 /nfs/dbraw/zinc/36/75/16/331367516.db2.gz LTYFZNCYVXIPRS-MRXNPFEDSA-N 1 0 276.380 3.649 20 5 CHBDRO CC(C)[C@H]1C[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CCS1 ZINC000464779744 331367827 /nfs/dbraw/zinc/36/78/27/331367827.db2.gz ZJZHMMDEWFFGRY-IUODEOHRSA-N 1 0 294.420 3.729 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1sccc1Cl ZINC000468010374 331426619 /nfs/dbraw/zinc/42/66/19/331426619.db2.gz XMFDURSBEHLRPB-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO CCCCC[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000468642460 331438158 /nfs/dbraw/zinc/43/81/58/331438158.db2.gz RMHZHAHAQUFBHN-JLHYYAGUSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC000477741264 331689718 /nfs/dbraw/zinc/68/97/18/331689718.db2.gz IDFCDWQMBGGCKF-LSDHHAIUSA-N 1 0 274.364 3.572 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@@H]1C ZINC000481179388 331799991 /nfs/dbraw/zinc/79/99/91/331799991.db2.gz IJMLABOWZFFIPG-GYSYKLTISA-N 1 0 280.343 3.648 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000482896201 331851458 /nfs/dbraw/zinc/85/14/58/331851458.db2.gz FLLGIKHDCNHOHE-XJKSGUPXSA-N 1 0 296.370 3.975 20 5 CHBDRO CC(C)(C)C[C@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000488402591 332004181 /nfs/dbraw/zinc/00/41/81/332004181.db2.gz KFGIJTHZXSMHEK-OAHLLOKOSA-N 1 0 276.380 3.995 20 5 CHBDRO Cc1ccc(C(C)(C)C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000488490515 332013371 /nfs/dbraw/zinc/01/33/71/332013371.db2.gz IGTQWMITWINTDG-UHFFFAOYSA-N 1 0 298.386 3.971 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](C2CC2)[C@H]2C=CCCC2)c1 ZINC000490043757 332077999 /nfs/dbraw/zinc/07/79/99/332077999.db2.gz KLFMSKVIIDZERL-AWEZNQCLSA-N 1 0 272.348 3.668 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCCOC(C)C ZINC000490091339 332081222 /nfs/dbraw/zinc/08/12/22/332081222.db2.gz XDKYAWFIZSKYFD-AWEZNQCLSA-N 1 0 294.395 3.711 20 5 CHBDRO CC(C)[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494520820 332477007 /nfs/dbraw/zinc/47/70/07/332477007.db2.gz DZQWJQHPGLOZGR-SECBINFHSA-N 1 0 290.285 3.748 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000247305303 334278787 /nfs/dbraw/zinc/27/87/87/334278787.db2.gz GTJYGIXPFIYVCY-GOSISDBHSA-N 1 0 296.370 3.802 20 5 CHBDRO CCCC[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504912524 332724795 /nfs/dbraw/zinc/72/47/95/332724795.db2.gz XEMJFHXXRFRIBL-LBPRGKRZSA-N 1 0 282.409 3.855 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CC ZINC000504925471 332725357 /nfs/dbraw/zinc/72/53/57/332725357.db2.gz CDVKAIDQVCZGQJ-NWDGAFQWSA-N 1 0 282.409 3.854 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000513069999 333002740 /nfs/dbraw/zinc/00/27/40/333002740.db2.gz QMIVFCBBIFDHAH-ABAIWWIYSA-N 1 0 286.331 3.743 20 5 CHBDRO CCC(CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000513101870 333004338 /nfs/dbraw/zinc/00/43/38/333004338.db2.gz IRAMLCZHGWELJO-OAHLLOKOSA-N 1 0 297.374 3.512 20 5 CHBDRO C[C@H]1CC[C@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000513106068 333004639 /nfs/dbraw/zinc/00/46/39/333004639.db2.gz GMPFRUQFOPVTTP-XHDPSFHLSA-N 1 0 286.331 3.743 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000310903597 333062476 /nfs/dbraw/zinc/06/24/76/333062476.db2.gz FSYLBBVPNFFEQR-LBPRGKRZSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1cc(NCC[NH+]2[C@H](C)CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000517393910 333098747 /nfs/dbraw/zinc/09/87/47/333098747.db2.gz WBYBMXPXSZGCLR-ZIAGYGMSSA-N 1 0 291.395 3.578 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC000182842742 333117845 /nfs/dbraw/zinc/11/78/45/333117845.db2.gz LCKGTBWBHRWFFD-BFHYXJOUSA-N 1 0 274.364 3.696 20 5 CHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000522268113 333276967 /nfs/dbraw/zinc/27/69/67/333276967.db2.gz QZCOESKULBKTHR-KRWDZBQOSA-N 1 0 296.370 3.584 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2C2CCCC2)cc1 ZINC000522269176 333277263 /nfs/dbraw/zinc/27/72/63/333277263.db2.gz YXLYLBLZJUYCMH-QGZVFWFLSA-N 1 0 288.391 3.792 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](C)CC2)cc1[N+](=O)[O-] ZINC000227310181 333280085 /nfs/dbraw/zinc/28/00/85/333280085.db2.gz SMADDBHZJMNDSW-GXTWGEPZSA-N 1 0 292.379 3.662 20 5 CHBDRO CC[C@H]1CCC[C@@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000231884369 333330987 /nfs/dbraw/zinc/33/09/87/333330987.db2.gz KCTGGQJFIOUQAA-JSGCOSHPSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1C ZINC000231884117 333330994 /nfs/dbraw/zinc/33/09/94/333330994.db2.gz ANEHSVHDFSQCPW-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000523550813 333332649 /nfs/dbraw/zinc/33/26/49/333332649.db2.gz ALJOFIOCYAMEPZ-CQSZACIVSA-N 1 0 262.353 3.749 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000524609367 333368434 /nfs/dbraw/zinc/36/84/34/333368434.db2.gz VEIFKNIRXQMRMY-HNNXBMFYSA-N 1 0 276.380 3.792 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000235579500 333370903 /nfs/dbraw/zinc/37/09/03/333370903.db2.gz ASTYUWBEDQQDOX-WCQYABFASA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000237817335 333381613 /nfs/dbraw/zinc/38/16/13/333381613.db2.gz KRWKGVKURWZHNI-KRWDZBQOSA-N 1 0 296.370 3.550 20 5 CHBDRO CC[C@H](Cc1ccccc1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000316608365 333401837 /nfs/dbraw/zinc/40/18/37/333401837.db2.gz QGRJEXIBQAOGDB-QGZVFWFLSA-N 1 0 298.386 3.748 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CS[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000397812194 333429297 /nfs/dbraw/zinc/42/92/97/333429297.db2.gz GUTQXQRWQSKCDG-KYOSRNDESA-N 1 0 294.420 3.920 20 5 CHBDRO CC[C@@H]1CC[C@H](C)[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000576021256 335142377 /nfs/dbraw/zinc/14/23/77/335142377.db2.gz WSYYFIBKHHIYAU-FZSTZKMBSA-N 1 0 274.364 3.871 20 5 CHBDRO CCCC(CCC)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000037668231 333536000 /nfs/dbraw/zinc/53/60/00/333536000.db2.gz KTHHGTAMEVVYHS-UHFFFAOYSA-N 1 0 250.342 3.653 20 5 CHBDRO COc1ccc(C[NH2+]CCC2CCCCC2)cc1[N+](=O)[O-] ZINC000037741951 333537285 /nfs/dbraw/zinc/53/72/85/333537285.db2.gz APCSHCQHXWPFMA-UHFFFAOYSA-N 1 0 292.379 3.663 20 5 CHBDRO CC(C)=CCC[C@@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000537968097 333552086 /nfs/dbraw/zinc/55/20/86/333552086.db2.gz QDNNNZILQLWOFK-CQSZACIVSA-N 1 0 292.379 3.698 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCCC2CC2)cccc1[N+](=O)[O-] ZINC000537971590 333552619 /nfs/dbraw/zinc/55/26/19/333552619.db2.gz XUSHDAKCPAFARI-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO CC1([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CCCCC1 ZINC000538402704 333588905 /nfs/dbraw/zinc/58/89/05/333588905.db2.gz PBGZYNPSVDLSDJ-CLFYSBASSA-N 1 0 274.364 3.920 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000539020245 333649211 /nfs/dbraw/zinc/64/92/11/333649211.db2.gz WCLIVDHEXUZRLT-KRWDZBQOSA-N 1 0 296.370 3.706 20 5 CHBDRO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000539214288 333661285 /nfs/dbraw/zinc/66/12/85/333661285.db2.gz GVETVSRWTAAWNS-STQMWFEESA-N 1 0 299.374 3.964 20 5 CHBDRO C[C@H]1CCC[C@H](CC[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000070546758 333815862 /nfs/dbraw/zinc/81/58/62/333815862.db2.gz RSEGVJKABLJCEX-UONOGXRCSA-N 1 0 276.380 3.901 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2CCCCS2)cccc1[N+](=O)[O-] ZINC000542500339 333828717 /nfs/dbraw/zinc/82/87/17/333828717.db2.gz UGFYRHJXYUPVGB-QWHCGFSZSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCCOC(C)C ZINC000543088373 333856353 /nfs/dbraw/zinc/85/63/53/333856353.db2.gz AWRJVKLZQOAFLJ-CQSZACIVSA-N 1 0 294.395 3.759 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000546172662 334018157 /nfs/dbraw/zinc/01/81/57/334018157.db2.gz PBCLJJUHMVQHSM-NSHDSACASA-N 1 0 290.285 3.724 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000081045977 334177282 /nfs/dbraw/zinc/17/72/82/334177282.db2.gz XUTODIQKGJXKIH-OLZOCXBDSA-N 1 0 264.369 3.846 20 5 CHBDRO Cc1c(C[N@@H+]2CC[C@@H](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000550051468 334211921 /nfs/dbraw/zinc/21/19/21/334211921.db2.gz VGGSWVPSVIQAAR-AWEZNQCLSA-N 1 0 274.364 3.525 20 5 CHBDRO C[C@@H]([NH2+]CC12CCC(CC1)C2)c1ccc([N+](=O)[O-])cc1 ZINC000550126487 334213681 /nfs/dbraw/zinc/21/36/81/334213681.db2.gz WLMSLTOCKIMXMC-VEAWUBTESA-N 1 0 274.364 3.826 20 5 CHBDRO C[C@H](F)CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000551258122 334243266 /nfs/dbraw/zinc/24/32/66/334243266.db2.gz DJAHWFPINQOEBL-HZMBPMFUSA-N 1 0 280.343 3.655 20 5 CHBDRO CC(C)[C@@H]1CC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000552283015 334312693 /nfs/dbraw/zinc/31/26/93/334312693.db2.gz VCIIHFOSOPGKMD-JSGCOSHPSA-N 1 0 282.771 3.772 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C=CCCC2)cc1[N+](=O)[O-] ZINC000090392828 334360097 /nfs/dbraw/zinc/36/00/97/334360097.db2.gz HXODSMINGVEXJO-GXTWGEPZSA-N 1 0 260.337 3.663 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000251677268 334366716 /nfs/dbraw/zinc/36/67/16/334366716.db2.gz AILBVVIWPIADDP-IMRBUKKESA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000252182360 334375966 /nfs/dbraw/zinc/37/59/66/334375966.db2.gz QGCNTFVRDXBIQD-TYNCELHUSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]([N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])C1(C)CC1 ZINC000091900338 334385817 /nfs/dbraw/zinc/38/58/17/334385817.db2.gz DSNUFLJBKYPHLY-STMXVASLSA-N 1 0 274.364 3.728 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccoc1 ZINC000094868963 334506882 /nfs/dbraw/zinc/50/68/82/334506882.db2.gz WVPDOCHAZJLBNH-GHMZBOCLSA-N 1 0 260.293 3.600 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)cc1 ZINC000576851282 335255896 /nfs/dbraw/zinc/25/58/96/335255896.db2.gz MLSRVJWNNAZDRR-QGZVFWFLSA-N 1 0 296.370 3.974 20 5 CHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@H]3CCCC34CC4)c2c1 ZINC000579252843 335728472 /nfs/dbraw/zinc/72/84/72/335728472.db2.gz GCXFOMHKINWDSY-INIZCTEOSA-N 1 0 299.374 3.541 20 5 CHBDRO CCC(C)(C)[C@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000579676158 335853197 /nfs/dbraw/zinc/85/31/97/335853197.db2.gz MZLOZHGALMBTCA-LBPRGKRZSA-N 1 0 264.369 3.552 20 5 CHBDRO Cc1csc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000380849637 336037085 /nfs/dbraw/zinc/03/70/85/336037085.db2.gz BKJPMZIVVQXNPK-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC1CCCCC1 ZINC000195669620 336058170 /nfs/dbraw/zinc/05/81/70/336058170.db2.gz HEKCLZJFHNAQFK-UHFFFAOYSA-N 1 0 276.380 3.649 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000385653640 336153708 /nfs/dbraw/zinc/15/37/08/336153708.db2.gz CYYAUZAJCVKPEG-MRXNPFEDSA-N 1 0 288.322 3.975 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353878477 533825509 /nfs/dbraw/zinc/82/55/09/533825509.db2.gz DEXKCVKVDVTXOY-MNOVXSKESA-N 1 0 268.382 3.667 20 5 CHBDRO CC(C)(C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113319025 518767337 /nfs/dbraw/zinc/76/73/37/518767337.db2.gz VINKHJHTUXCOJR-UHFFFAOYSA-N 1 0 291.376 3.606 20 5 CHBDRO CO[C@]1(C)CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000280647275 521751867 /nfs/dbraw/zinc/75/18/67/521751867.db2.gz YUNRUGJUBYLTHQ-CZUORRHYSA-N 1 0 292.379 3.547 20 5 CHBDRO CC[C@H]([NH2+]CCCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000126801677 522581638 /nfs/dbraw/zinc/58/16/38/522581638.db2.gz JOZPJBGTBBTBAQ-LBPRGKRZSA-N 1 0 290.285 3.978 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000122013210 522859506 /nfs/dbraw/zinc/85/95/06/522859506.db2.gz WNTSDPHWCZVIAY-HUUCEWRRSA-N 1 0 294.420 3.921 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccoc1C)c1cccc([N+](=O)[O-])c1 ZINC000358022424 522887475 /nfs/dbraw/zinc/88/74/75/522887475.db2.gz VZRVMCULSFQCLB-OAHLLOKOSA-N 1 0 274.320 3.737 20 5 CHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000339919919 524142310 /nfs/dbraw/zinc/14/23/10/524142310.db2.gz DSCAZKPFLONZNO-CMPLNLGQSA-N 1 0 268.382 3.667 20 5 CHBDRO C[C@H]([NH2+]CCc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000049153242 525370553 /nfs/dbraw/zinc/37/05/53/525370553.db2.gz DBXBNFOJXHKOAG-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000052332993 525459247 /nfs/dbraw/zinc/45/92/47/525459247.db2.gz WQKQTMGZIZQDIP-LBPRGKRZSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000052332995 525536543 /nfs/dbraw/zinc/53/65/43/525536543.db2.gz WQKQTMGZIZQDIP-GFCCVEGCSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1CCCCC1 ZINC000052334122 525556102 /nfs/dbraw/zinc/55/61/02/525556102.db2.gz QTACDCUOTGTXFV-SNVBAGLBSA-N 1 0 268.382 3.715 20 5 CHBDRO Cc1sccc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000293109126 526912748 /nfs/dbraw/zinc/91/27/48/526912748.db2.gz YIMXLHHVHZDRPI-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO CC1(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000344691673 527981044 /nfs/dbraw/zinc/98/10/44/527981044.db2.gz IDTFBMWBBJZEBY-UHFFFAOYSA-N 1 0 286.331 3.745 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1[C@@H](C)CC[C@@H]1C ZINC000342077867 535021112 /nfs/dbraw/zinc/02/11/12/535021112.db2.gz SWJHHLMFDNFNJH-STQMWFEESA-N 1 0 292.379 3.755 20 5 CHBDRO C[N+](C)(C)CCCOC(c1ccccc1)c1ccccc1 ZINC000003176014 567852134 /nfs/dbraw/zinc/85/21/34/567852134.db2.gz GTZUIMSKNPMULT-UHFFFAOYSA-N 1 0 284.423 3.889 20 5 CHBDRO C[C@@H](CCc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000013726122 567894067 /nfs/dbraw/zinc/89/40/67/567894067.db2.gz OGOPVSDEBSMRQR-AWEZNQCLSA-N 1 0 284.359 3.706 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)C1(C)CC1 ZINC000776882205 1123557799 /nfs/dbraw/zinc/55/77/99/1123557799.db2.gz OJBTZUMHNZAKFT-VXGBXAGGSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@@H](OCCC[N+](C)(C)C)c1cccc(F)c1C ZINC001224623324 1135462188 /nfs/dbraw/zinc/46/21/88/1135462188.db2.gz MGWLJQCORGIKIQ-MRXNPFEDSA-N 1 0 268.396 3.698 20 5 CHBDRO C/C=C/[C@@H](OCCC[N+](C)(C)C)C1CCCCC1 ZINC001224623999 1135462523 /nfs/dbraw/zinc/46/25/23/1135462523.db2.gz SCSBIUNJYRGOHL-ZWIJEDICSA-N 1 0 254.438 3.624 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](F)C2)cc1[N+](=O)[O-] ZINC000348338229 1125594452 /nfs/dbraw/zinc/59/44/52/1125594452.db2.gz VBNILXJEGBPOLA-DRZSPHRISA-N 1 0 296.342 3.535 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[NH2+][C@@H]1CCCC12CCCCC2 ZINC000886274567 1125665891 /nfs/dbraw/zinc/66/58/91/1125665891.db2.gz WFWXXXOXAUHAAA-CQSZACIVSA-N 1 0 289.379 3.582 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCC2CCCCC2)c1 ZINC000037501055 1125680000 /nfs/dbraw/zinc/68/00/00/1125680000.db2.gz KDNSNLWZMWSWFM-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO CO[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000886512983 1125683028 /nfs/dbraw/zinc/68/30/28/1125683028.db2.gz QXLNFGXRBWKJSQ-XNRPHZJLSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000886540829 1125687017 /nfs/dbraw/zinc/68/70/17/1125687017.db2.gz LNABQOLEXMUDMI-CJNGLKHVSA-N 1 0 297.358 3.573 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000159927275 1126758132 /nfs/dbraw/zinc/75/81/32/1126758132.db2.gz ZXBUVPUVBVOARA-JSGCOSHPSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000482489460 1126760700 /nfs/dbraw/zinc/76/07/00/1126760700.db2.gz KJWJYVJZIUHWQI-NHYWBVRUSA-N 1 0 262.353 3.524 20 5 CHBDRO COc1cc(C[N@H+](C)[C@@H]2CCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000483095374 1126767549 /nfs/dbraw/zinc/76/75/49/1126767549.db2.gz AKFLKSJGNANRIT-CYBMUJFWSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc(Cl)c(O[C@@H](C)C[N+](C)(C)C)c1Cl ZINC001234302732 1130633558 /nfs/dbraw/zinc/63/35/58/1130633558.db2.gz LUAZWVGZPWZYLO-JTQLQIEISA-N 1 0 277.215 3.775 20 5 CHBDRO CC[N@H+](Cc1ccccn1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182843579 1126878538 /nfs/dbraw/zinc/87/85/38/1126878538.db2.gz XDMREOYXKSRBPD-AWEZNQCLSA-N 1 0 299.374 3.881 20 5 CHBDRO COc1cc(C[N@H+](C)[C@H]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000485733615 1126948477 /nfs/dbraw/zinc/94/84/77/1126948477.db2.gz BMBCJBQFKPEEOI-JSGCOSHPSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H](OCC[N+](C)(C)C)c1ccc2ccccc2c1 ZINC001224772192 1126985980 /nfs/dbraw/zinc/98/59/80/1126985980.db2.gz WQUOPAONWRFVRX-CQSZACIVSA-N 1 0 258.385 3.624 20 5 CHBDRO CC1(CC[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000698042952 1126990787 /nfs/dbraw/zinc/99/07/87/1126990787.db2.gz YXYJYTBIOKDMAM-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2CCSCC2)cccc1[N+](=O)[O-] ZINC000268925614 1127028977 /nfs/dbraw/zinc/02/89/77/1127028977.db2.gz XXGOBHIOECGDMU-LBPRGKRZSA-N 1 0 294.420 3.697 20 5 CHBDRO CC(C)CC[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000042457021 1127049828 /nfs/dbraw/zinc/04/98/28/1127049828.db2.gz XSWQJSRQYXXOCL-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cncs2)cc1[N+](=O)[O-] ZINC000271474705 1127085070 /nfs/dbraw/zinc/08/50/70/1127085070.db2.gz JLIMABLZHMFNPD-MNOVXSKESA-N 1 0 291.376 3.772 20 5 CHBDRO CCCCN(C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000913064091 1127121198 /nfs/dbraw/zinc/12/11/98/1127121198.db2.gz CEHOOLZHHWNCIR-UHFFFAOYSA-N 1 0 295.364 3.561 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc3occc3c2)c1 ZINC000586776480 1127138215 /nfs/dbraw/zinc/13/82/15/1127138215.db2.gz HVBMDBUAKRAWET-UHFFFAOYSA-N 1 0 282.299 3.631 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CCC2)CC1 ZINC000586783007 1127141281 /nfs/dbraw/zinc/14/12/81/1127141281.db2.gz IWCBEDXQMFZFTM-CYBMUJFWSA-N 1 0 274.364 3.922 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284153636 1127176376 /nfs/dbraw/zinc/17/63/76/1127176376.db2.gz PMEIUYNGMLDSHX-MEDUHNTESA-N 1 0 297.358 3.515 20 5 CHBDRO CC1(C)CC[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000164873339 1127192233 /nfs/dbraw/zinc/19/22/33/1127192233.db2.gz IKFICDGDRIYVTP-GFCCVEGCSA-N 1 0 282.771 3.917 20 5 CHBDRO CC[N@H+](CCc1cccs1)Cc1csc([N+](=O)[O-])c1 ZINC000351658990 1127202226 /nfs/dbraw/zinc/20/22/26/1127202226.db2.gz NGQVJHIXHNBXIO-UHFFFAOYSA-N 1 0 296.417 3.782 20 5 CHBDRO Cc1ccc(C(C)(C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000353206339 1127263913 /nfs/dbraw/zinc/26/39/13/1127263913.db2.gz YSTCFPMHMFWYQH-UHFFFAOYSA-N 1 0 299.374 3.632 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)C2CCSCC2)cccc1[N+](=O)[O-] ZINC000355182523 1127323296 /nfs/dbraw/zinc/32/32/96/1127323296.db2.gz VFYVNBMXVSJFMV-GFCCVEGCSA-N 1 0 294.420 3.525 20 5 CHBDRO CC(C)C[NH+](Cc1cccc([N+](=O)[O-])c1)CC(C)C ZINC000058337055 1127335858 /nfs/dbraw/zinc/33/58/58/1127335858.db2.gz SMCIAUKBHKRXBX-UHFFFAOYSA-N 1 0 264.369 3.709 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@@H](F)C2)cccc1[N+](=O)[O-] ZINC000592390730 1127346992 /nfs/dbraw/zinc/34/69/92/1127346992.db2.gz PERSCYBKBXCBTL-YNEHKIRRSA-N 1 0 280.343 3.835 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]12 ZINC000058577287 1127362248 /nfs/dbraw/zinc/36/22/48/1127362248.db2.gz BDADJFSWWDQPBG-XOKHGSTOSA-N 1 0 288.391 3.995 20 5 CHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000358194116 1127407810 /nfs/dbraw/zinc/40/78/10/1127407810.db2.gz BDXHNNZFVBTSFR-CQSZACIVSA-N 1 0 299.374 3.663 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C)SC2)cc1[N+](=O)[O-] ZINC000594497774 1127418302 /nfs/dbraw/zinc/41/83/02/1127418302.db2.gz GEEXERIIBDTGIS-MBNYWOFBSA-N 1 0 294.420 3.838 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccsc1 ZINC000594504373 1127418998 /nfs/dbraw/zinc/41/89/98/1127418998.db2.gz OAPQENSOCVNNGI-QMTHXVAHSA-N 1 0 288.372 3.994 20 5 CHBDRO COC[C@H](CC(C)(C)C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000594519154 1127420927 /nfs/dbraw/zinc/42/09/27/1127420927.db2.gz DWIONFKWJZWFLM-OCCSQVGLSA-N 1 0 294.395 3.697 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCO1 ZINC000594518677 1127420935 /nfs/dbraw/zinc/42/09/35/1127420935.db2.gz IXHNHLRPVLAYJV-RCBQFDQVSA-N 1 0 292.379 3.593 20 5 CHBDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000358513762 1127425254 /nfs/dbraw/zinc/42/52/54/1127425254.db2.gz WGKBDYYGBBVMQA-CYBMUJFWSA-N 1 0 299.374 3.711 20 5 CHBDRO CSCC1(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000594962620 1127440861 /nfs/dbraw/zinc/44/08/61/1127440861.db2.gz IYHCQSSANKZIEW-UHFFFAOYSA-N 1 0 294.420 3.526 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000594985313 1127443847 /nfs/dbraw/zinc/44/38/47/1127443847.db2.gz LEKGLAXHZAOVRZ-CQSZACIVSA-N 1 0 298.333 3.853 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CCC2(C)CC2)cc1[N+](=O)[O-] ZINC000359009273 1127444422 /nfs/dbraw/zinc/44/44/22/1127444422.db2.gz YUDXCYAFJOEEEV-GFCCVEGCSA-N 1 0 292.379 3.834 20 5 CHBDRO CC(C)CC1([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000595000726 1127444893 /nfs/dbraw/zinc/44/48/93/1127444893.db2.gz NTAVTTPQVJFGGN-FNORWQNLSA-N 1 0 274.364 3.776 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CC=CCC1 ZINC000595005227 1127444924 /nfs/dbraw/zinc/44/49/24/1127444924.db2.gz FJNPBDMDEPQHDT-CHWSQXEVSA-N 1 0 290.363 3.610 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC=C(C)C ZINC000595041786 1127450674 /nfs/dbraw/zinc/45/06/74/1127450674.db2.gz RDUMZAKNUQFZFI-LBPRGKRZSA-N 1 0 278.352 3.610 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@]1(C)CC1(F)F ZINC000595082705 1127453434 /nfs/dbraw/zinc/45/34/34/1127453434.db2.gz VMABZTXRWYPNMS-BXUZGUMPSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCC[C@@H](C)O1 ZINC000595081095 1127453688 /nfs/dbraw/zinc/45/36/88/1127453688.db2.gz QBYARPARHYXNDQ-VNHYZAJKSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595079650 1127453719 /nfs/dbraw/zinc/45/37/19/1127453719.db2.gz MDEKYBNKHFODHV-QWHCGFSZSA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@@H](C)O2)cc1[N+](=O)[O-] ZINC000595078909 1127453739 /nfs/dbraw/zinc/45/37/39/1127453739.db2.gz HGPNAELRXDIQKP-VNHYZAJKSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@]1(C)CC1(F)F ZINC000595082706 1127453753 /nfs/dbraw/zinc/45/37/53/1127453753.db2.gz VMABZTXRWYPNMS-FZMZJTMJSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2CCC[C@@H](C)O2)cccc1[N+](=O)[O-] ZINC000595081999 1127453758 /nfs/dbraw/zinc/45/37/58/1127453758.db2.gz VKENFWAXILVDSA-KWCYVHTRSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCC[C@H](C)O1 ZINC000595081097 1127453759 /nfs/dbraw/zinc/45/37/59/1127453759.db2.gz QBYARPARHYXNDQ-YDHLFZDLSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCC(C)(C)F)cccc1[N+](=O)[O-] ZINC000595086514 1127453949 /nfs/dbraw/zinc/45/39/49/1127453949.db2.gz KOJKZXJUUDODAA-LLVKDONJSA-N 1 0 268.332 3.692 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC(C)(C)F ZINC000595091181 1127454641 /nfs/dbraw/zinc/45/46/41/1127454641.db2.gz WMQAVSMJRXDTFY-NSHDSACASA-N 1 0 268.332 3.692 20 5 CHBDRO CC(C)CC1([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595094780 1127455229 /nfs/dbraw/zinc/45/52/29/1127455229.db2.gz IUYWUVOSLBPXKM-LBPRGKRZSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCCc2ccco2)cccc1[N+](=O)[O-] ZINC000595093953 1127455522 /nfs/dbraw/zinc/45/55/22/1127455522.db2.gz QBRVHYGYZCVCQE-ZDUSSCGKSA-N 1 0 288.347 3.780 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CC2=CCCC2)cc1[N+](=O)[O-] ZINC000595097348 1127456049 /nfs/dbraw/zinc/45/60/49/1127456049.db2.gz TVHGBBFOXXBFDU-LBPRGKRZSA-N 1 0 290.363 3.754 20 5 CHBDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)C1 ZINC000359302888 1127457075 /nfs/dbraw/zinc/45/70/75/1127457075.db2.gz PDALCEXQNIQGRG-XJKSGUPXSA-N 1 0 274.364 3.607 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595411500 1127461475 /nfs/dbraw/zinc/46/14/75/1127461475.db2.gz RLAYXLZCVKUQAA-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593119391 1127475150 /nfs/dbraw/zinc/47/51/50/1127475150.db2.gz XESNILICCWUTCK-SMDDNHRTSA-N 1 0 296.317 3.695 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CCC1 ZINC000360028073 1127487077 /nfs/dbraw/zinc/48/70/77/1127487077.db2.gz QHPDBYMFGPOVFJ-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC(F)(F)C1 ZINC000293668631 1127512399 /nfs/dbraw/zinc/51/23/99/1127512399.db2.gz MKDJFQQPFPMAFO-NSHDSACASA-N 1 0 298.333 3.551 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H](CCF)C1 ZINC000597212106 1127533973 /nfs/dbraw/zinc/53/39/73/1127533973.db2.gz RSKQSCWYAMMDAT-ZBKLQPJUSA-N 1 0 292.354 3.680 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@H+]([C@@H]1C[C@@H]1c1ccccc1)CC2 ZINC000361314804 1127555913 /nfs/dbraw/zinc/55/59/13/1127555913.db2.gz SLCOROYBYXIPIY-QZTJIDSGSA-N 1 0 294.354 3.509 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000294363880 1127568607 /nfs/dbraw/zinc/56/86/07/1127568607.db2.gz AVFYTAVXXBXPLK-SFDCQRBFSA-N 1 0 292.379 3.510 20 5 CHBDRO CC[C@H](C)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602503470 1127588112 /nfs/dbraw/zinc/58/81/12/1127588112.db2.gz JYICCXMXQHVCKN-QMMMGPOBSA-N 1 0 276.258 3.502 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000602504115 1127588143 /nfs/dbraw/zinc/58/81/43/1127588143.db2.gz SIQOBSURPOGPMN-QMMMGPOBSA-N 1 0 288.269 3.502 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]CC2CCC(F)(F)CC2)cc1 ZINC000602654088 1127602839 /nfs/dbraw/zinc/60/28/39/1127602839.db2.gz UJTCKALDKGYLSV-UHFFFAOYSA-N 1 0 298.333 3.552 20 5 CHBDRO CC(C)(C)C[C@@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000060877142 1127614772 /nfs/dbraw/zinc/61/47/72/1127614772.db2.gz KFGIJTHZXSMHEK-HNNXBMFYSA-N 1 0 276.380 3.995 20 5 CHBDRO CS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000593654007 1127648426 /nfs/dbraw/zinc/64/84/26/1127648426.db2.gz NSOVANRFEIJLEJ-HUUCEWRRSA-N 1 0 294.420 3.667 20 5 CHBDRO COc1ccc(C[N@H+]([C@H](C)C(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000061185367 1127663825 /nfs/dbraw/zinc/66/38/25/1127663825.db2.gz MVVYBQDSYSCADD-GFCCVEGCSA-N 1 0 292.379 3.612 20 5 CHBDRO Cc1c(C[N@H+](C)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000603837845 1127673860 /nfs/dbraw/zinc/67/38/60/1127673860.db2.gz ORGMSURNIVQIDU-UHFFFAOYSA-N 1 0 276.380 3.915 20 5 CHBDRO CCCc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000603834969 1127674612 /nfs/dbraw/zinc/67/46/12/1127674612.db2.gz YRHUOHBYQTYIGQ-UHFFFAOYSA-N 1 0 284.359 3.837 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000603847295 1127676196 /nfs/dbraw/zinc/67/61/96/1127676196.db2.gz PDUKWLZXSQMMHV-UKPHBRMFSA-N 1 0 288.391 3.995 20 5 CHBDRO CC(F)(F)CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000297177087 1127690013 /nfs/dbraw/zinc/69/00/13/1127690013.db2.gz DRECIPDFWVNSMW-ZDUSSCGKSA-N 1 0 284.306 3.607 20 5 CHBDRO Cc1cncc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000297384820 1127694700 /nfs/dbraw/zinc/69/47/00/1127694700.db2.gz RHGMTFDYKGCOHI-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO C[N@H+](CCCNc1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000604408733 1127703126 /nfs/dbraw/zinc/70/31/26/1127703126.db2.gz CNEHAJKKNUQQMO-UHFFFAOYSA-N 1 0 297.424 3.723 20 5 CHBDRO CC1CC[NH+](CCCCNc2ccc([N+](=O)[O-])s2)CC1 ZINC000604409315 1127703299 /nfs/dbraw/zinc/70/32/99/1127703299.db2.gz WYLXJJXOKQHRSN-UHFFFAOYSA-N 1 0 297.424 3.580 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001168423486 1127829487 /nfs/dbraw/zinc/82/94/87/1127829487.db2.gz KWXJCPVZMSTGHR-NSHDSACASA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000374007184 1127870356 /nfs/dbraw/zinc/87/03/56/1127870356.db2.gz CJWZFJSKXIVTJV-GXTWGEPZSA-N 1 0 286.331 3.738 20 5 CHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1C[C@@H]1c1ccccc1 ZINC000411724238 1127871342 /nfs/dbraw/zinc/87/13/42/1127871342.db2.gz UJBSKOUMEIOKBA-SJLPKXTDSA-N 1 0 296.370 3.625 20 5 CHBDRO CC1(C)C[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000608836430 1127889489 /nfs/dbraw/zinc/88/94/89/1127889489.db2.gz GQOUXUSJLQMDJB-HNNXBMFYSA-N 1 0 286.331 3.743 20 5 CHBDRO C[C@H](C[N@H+](C)Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000608976712 1127896329 /nfs/dbraw/zinc/89/63/29/1127896329.db2.gz JGMIVFLSDZQIPS-CQSZACIVSA-N 1 0 284.359 3.830 20 5 CHBDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000076067343 1127931836 /nfs/dbraw/zinc/93/18/36/1127931836.db2.gz BUOSZHWXDDITOR-LSDHHAIUSA-N 1 0 294.420 3.701 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2C2CCCC2)cc1F ZINC000094774715 1127950887 /nfs/dbraw/zinc/95/08/87/1127950887.db2.gz PESPLRKUUBAJEX-HNNXBMFYSA-N 1 0 292.354 3.889 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000462733803 1127952249 /nfs/dbraw/zinc/95/22/49/1127952249.db2.gz KNHQZUXBHDVKDC-ARFHVFGLSA-N 1 0 288.391 3.962 20 5 CHBDRO CC[C@H](C)C[N@H+](CC)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774967 1127981158 /nfs/dbraw/zinc/98/11/58/1127981158.db2.gz RRFVIPCQEVRYQC-NSHDSACASA-N 1 0 268.332 3.602 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@H]2CCCC[C@@H]12 ZINC000541108998 1128008741 /nfs/dbraw/zinc/00/87/41/1128008741.db2.gz FUAOUBMWBDYHRF-WPGHFRTFSA-N 1 0 292.354 3.744 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H](C)C1CC1 ZINC000470176948 1128064941 /nfs/dbraw/zinc/06/49/41/1128064941.db2.gz ZFZILGASWFLYQI-SUIFULHWSA-N 1 0 274.364 3.728 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000470207395 1128066449 /nfs/dbraw/zinc/06/64/49/1128066449.db2.gz VPJYJULEFUBZRM-FCDYRPLESA-N 1 0 286.375 3.873 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000557258881 1128097035 /nfs/dbraw/zinc/09/70/35/1128097035.db2.gz GXDWPEVLTWQOJX-ATCWAGBWSA-N 1 0 292.379 3.518 20 5 CHBDRO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC1CC1 ZINC000761510550 1128132229 /nfs/dbraw/zinc/13/22/29/1128132229.db2.gz JJRJEEVFSUPFIE-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761506004 1128132393 /nfs/dbraw/zinc/13/23/93/1128132393.db2.gz LNUQOKILWMNWKK-JTQLQIEISA-N 1 0 270.760 3.869 20 5 CHBDRO CC(C)[C@H]1CC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493382861 1128140561 /nfs/dbraw/zinc/14/05/61/1128140561.db2.gz IWCDEHJFFGKEHV-NSHDSACASA-N 1 0 282.771 3.726 20 5 CHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000324229373 1128159565 /nfs/dbraw/zinc/15/95/65/1128159565.db2.gz XKRKWTNZOFUZMN-ZDUSSCGKSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[C@@H](C[C@@](C)(O)CC)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000926493335 1128175309 /nfs/dbraw/zinc/17/53/09/1128175309.db2.gz QTZPEUOMVSHDPM-NOLJZWGESA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CCCCS2)cccc1[N+](=O)[O-] ZINC000542500340 1128194673 /nfs/dbraw/zinc/19/46/73/1128194673.db2.gz UGFYRHJXYUPVGB-STQMWFEESA-N 1 0 294.420 3.840 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193069561 1128206429 /nfs/dbraw/zinc/20/64/29/1128206429.db2.gz LLCMJRGKOAWHDG-IUODEOHRSA-N 1 0 294.420 3.703 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000089512604 1128295952 /nfs/dbraw/zinc/29/59/52/1128295952.db2.gz FJLKYTZXILJOJY-KGLIPLIRSA-N 1 0 284.359 3.877 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1cccc([N+](=O)[O-])c1 ZINC000930208073 1128307867 /nfs/dbraw/zinc/30/78/67/1128307867.db2.gz JAHDRKINBMQMQK-XYHOJCAOSA-N 1 0 296.317 3.537 20 5 CHBDRO C[N@H+](CCCC(C)(F)F)CCc1cccc([N+](=O)[O-])c1 ZINC000930353057 1128315629 /nfs/dbraw/zinc/31/56/29/1128315629.db2.gz FMYDNINFHUCDGH-UHFFFAOYSA-N 1 0 286.322 3.505 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000272594531 1128363143 /nfs/dbraw/zinc/36/31/43/1128363143.db2.gz IESPUPWTCAPUBA-JTQLQIEISA-N 1 0 294.738 3.735 20 5 CHBDRO Cc1ccc(C[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000036432174 1128420724 /nfs/dbraw/zinc/42/07/24/1128420724.db2.gz VYSCDWCYCJTRNV-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO CCCCC1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000934206522 1128454459 /nfs/dbraw/zinc/45/44/59/1128454459.db2.gz ANENYTNMGTVDDA-UHFFFAOYSA-N 1 0 289.335 3.548 20 5 CHBDRO CC(C)C1([NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])CC1 ZINC000556229020 1128565514 /nfs/dbraw/zinc/56/55/14/1128565514.db2.gz DXUZNEKGCWZFJO-ZDUSSCGKSA-N 1 0 276.380 3.694 20 5 CHBDRO CO[C@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C(C)(C)C ZINC000154944533 1128599623 /nfs/dbraw/zinc/59/96/23/1128599623.db2.gz REMLDHDTTHWHPM-SWLSCSKDSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC(C)(F)F ZINC000569191121 1128601183 /nfs/dbraw/zinc/60/11/83/1128601183.db2.gz ITOWHSWZIRLHBY-JTQLQIEISA-N 1 0 272.295 3.599 20 5 CHBDRO COC1([C@H](C)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCC1 ZINC000570300938 1128620823 /nfs/dbraw/zinc/62/08/23/1128620823.db2.gz MPOHEDZROSHLJG-STQMWFEESA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000570611841 1128628013 /nfs/dbraw/zinc/62/80/13/1128628013.db2.gz ADEHSSFXVSABCO-MRXNPFEDSA-N 1 0 286.375 3.668 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2cccc(C[NH2+]C3CC3)c2)cc1 ZINC000600783589 1128681298 /nfs/dbraw/zinc/68/12/98/1128681298.db2.gz FHJRIFNYADDPKK-UHFFFAOYSA-N 1 0 268.316 3.514 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2cccc([C@@H]3CCC[NH2+]3)c2)cc1 ZINC000600786484 1128681429 /nfs/dbraw/zinc/68/14/29/1128681429.db2.gz QIDQPDXUCMKJRI-INIZCTEOSA-N 1 0 268.316 3.686 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1-c1ccc([C@@H]2CCC[NH2+]2)cc1 ZINC000600789177 1128681706 /nfs/dbraw/zinc/68/17/06/1128681706.db2.gz IOFFDWCYLNYNMF-HNNXBMFYSA-N 1 0 286.306 3.825 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCCC12CC2 ZINC000601289368 1128708928 /nfs/dbraw/zinc/70/89/28/1128708928.db2.gz MFZFCWPQSATVRH-UKRRQHHQSA-N 1 0 272.348 3.504 20 5 CHBDRO CC[C@@H]1CC[N@@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000430193493 1117835057 /nfs/dbraw/zinc/83/50/57/1117835057.db2.gz FJBQNRBUSIOIIH-CYBMUJFWSA-N 1 0 262.353 3.703 20 5 CHBDRO CC[C@@H]1CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000430194364 1117838646 /nfs/dbraw/zinc/83/86/46/1117838646.db2.gz UQZLZBXIENKUSZ-CYBMUJFWSA-N 1 0 286.331 3.839 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000610080160 1128738161 /nfs/dbraw/zinc/73/81/61/1128738161.db2.gz JVJFFUDYFAMSTN-LBPRGKRZSA-N 1 0 280.343 3.889 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1C(C)(C)C ZINC000430222297 1117891985 /nfs/dbraw/zinc/89/19/85/1117891985.db2.gz VFUQXLLYKSOOQG-OAHLLOKOSA-N 1 0 292.379 3.614 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCCC[C@@H]1C ZINC000430240067 1117908773 /nfs/dbraw/zinc/90/87/73/1117908773.db2.gz CBMBWCJDINZAEM-SWLSCSKDSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001307686302 1117928841 /nfs/dbraw/zinc/92/88/41/1117928841.db2.gz SPJRODKFXSNRBZ-BONVTDFDSA-N 1 0 298.333 3.884 20 5 CHBDRO COc1ccc(C[NH2+]C2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000237324133 1118142128 /nfs/dbraw/zinc/14/21/28/1118142128.db2.gz GXDWPEVLTWQOJX-RYUDHWBXSA-N 1 0 292.379 3.518 20 5 CHBDRO C[N@@H+]1CC[C@H](Nc2nc3ccccc3c3ccccc32)C1 ZINC001167281351 1118150156 /nfs/dbraw/zinc/15/01/56/1118150156.db2.gz WHSKBZCNRKDHBB-ZDUSSCGKSA-N 1 0 277.371 3.504 20 5 CHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000610275456 1118172928 /nfs/dbraw/zinc/17/29/28/1118172928.db2.gz QPFDVKBPHNJJHO-LBPRGKRZSA-N 1 0 297.424 3.579 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C1CC1 ZINC000615720416 1128761026 /nfs/dbraw/zinc/76/10/26/1128761026.db2.gz AGVAKCUPAONIAO-FSBNRTBOSA-N 1 0 274.364 3.634 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CC1CCCC1 ZINC000084439806 1118355780 /nfs/dbraw/zinc/35/57/80/1118355780.db2.gz FNINHTLNCBGKAW-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C)(C)CC1 ZINC000610368495 1118362538 /nfs/dbraw/zinc/36/25/38/1118362538.db2.gz CNIQKKHBOFIQLM-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1ccc(C[N@H+]2CCCC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC001167405236 1118460473 /nfs/dbraw/zinc/46/04/73/1118460473.db2.gz BDXRIJHAYXWVFN-HNNXBMFYSA-N 1 0 276.380 3.914 20 5 CHBDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000083640387 1118462196 /nfs/dbraw/zinc/46/21/96/1118462196.db2.gz PZLYJUXHSNOMTN-OCCSQVGLSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1c(C[NH2+]CC2(C)CCCC2)cccc1[N+](=O)[O-] ZINC000111620911 1118520605 /nfs/dbraw/zinc/52/06/05/1118520605.db2.gz PHPAZTDGDIUJLU-UHFFFAOYSA-N 1 0 262.353 3.573 20 5 CHBDRO C[C@H]([NH2+]CCCc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000537950661 1118607211 /nfs/dbraw/zinc/60/72/11/1118607211.db2.gz HSQXCOVCTPSQNS-LBPRGKRZSA-N 1 0 290.388 3.940 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC=C(c3ccco3)C2)cc1[N+](=O)[O-] ZINC000348675702 1118641740 /nfs/dbraw/zinc/64/17/40/1118641740.db2.gz RDKJWGCXEZGDBE-UHFFFAOYSA-N 1 0 298.342 3.786 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000093632511 1118661753 /nfs/dbraw/zinc/66/17/53/1118661753.db2.gz NRFPWJMEIYVXGP-GWCFXTLKSA-N 1 0 282.771 3.917 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000286950732 1118678941 /nfs/dbraw/zinc/67/89/41/1118678941.db2.gz HJOMUKOSYOLTTE-IUODEOHRSA-N 1 0 294.420 3.779 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000510540247 1118766944 /nfs/dbraw/zinc/76/69/44/1118766944.db2.gz UVHPSKMGUMFDTJ-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(NC2CC[NH+](C(C)(C)C)CC2)c1 ZINC000610677334 1118818753 /nfs/dbraw/zinc/81/87/53/1118818753.db2.gz SGXODKFCLOPIPA-UHFFFAOYSA-N 1 0 291.395 3.578 20 5 CHBDRO OC[C@H]1CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000092763979 1118851006 /nfs/dbraw/zinc/85/10/06/1118851006.db2.gz NDRRVGQNPJMSPF-HNNXBMFYSA-N 1 0 291.394 3.807 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)CC1 ZINC000468148314 1118874344 /nfs/dbraw/zinc/87/43/44/1118874344.db2.gz VJCCREBXFCUBJF-CHWSQXEVSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](C)C2CC2)cccc1[N+](=O)[O-] ZINC000610805340 1118893019 /nfs/dbraw/zinc/89/30/19/1118893019.db2.gz SCFHXBLEWIONPQ-ZYHUDNBSSA-N 1 0 262.353 3.600 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000342295660 1118969055 /nfs/dbraw/zinc/96/90/55/1118969055.db2.gz IPZGSEXOIPGVOR-CHWSQXEVSA-N 1 0 280.343 3.698 20 5 CHBDRO Cc1c(C[N@@H+](C)C2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000071950417 1118980296 /nfs/dbraw/zinc/98/02/96/1118980296.db2.gz HJWHPZZSYFEQEN-UHFFFAOYSA-N 1 0 276.380 3.914 20 5 CHBDRO C[C@H](c1ccccc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511062926 1118996391 /nfs/dbraw/zinc/99/63/91/1118996391.db2.gz FSMDNCDQMHKILI-CQSZACIVSA-N 1 0 284.359 3.830 20 5 CHBDRO CC(C)=CCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000479301018 1119111947 /nfs/dbraw/zinc/11/19/47/1119111947.db2.gz OWUDJOCPHSPPCU-CYBMUJFWSA-N 1 0 262.353 3.910 20 5 CHBDRO CCC[C@H](CC)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000050404152 1119117948 /nfs/dbraw/zinc/11/79/48/1119117948.db2.gz GHWPFPNOYVPCHQ-ZDUSSCGKSA-N 1 0 250.342 3.572 20 5 CHBDRO CCC[C@@H](CC)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000050401459 1119118338 /nfs/dbraw/zinc/11/83/38/1119118338.db2.gz HACGQBQBGAYTHQ-LLVKDONJSA-N 1 0 270.760 3.917 20 5 CHBDRO CC[C@H](C)[C@H](C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)OC ZINC000362978399 1119251701 /nfs/dbraw/zinc/25/17/01/1119251701.db2.gz ZUXRHXRRZIORPO-RCBQFDQVSA-N 1 0 294.395 3.697 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)C1CCCCCC1 ZINC000248122428 1119318141 /nfs/dbraw/zinc/31/81/41/1119318141.db2.gz FUCMYWDGAOMSJY-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000219697806 1119511055 /nfs/dbraw/zinc/51/10/55/1119511055.db2.gz GMUQKTQWFUGXJU-WFASDCNBSA-N 1 0 262.353 3.605 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)cc1F ZINC000250894025 1119534610 /nfs/dbraw/zinc/53/46/10/1119534610.db2.gz OEABWWHGLOXPMM-KGLIPLIRSA-N 1 0 292.354 3.746 20 5 CHBDRO Cc1c(C[NH2+]CC2(C)CCCCC2)cccc1[N+](=O)[O-] ZINC000235813870 1119821753 /nfs/dbraw/zinc/82/17/53/1119821753.db2.gz JVOHVWLPOQGUCK-UHFFFAOYSA-N 1 0 276.380 3.963 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000582187696 1119913579 /nfs/dbraw/zinc/91/35/79/1119913579.db2.gz KZHQOHVOFUCMKU-KGLIPLIRSA-N 1 0 294.782 3.569 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@H]1c1ccco1)CCC2 ZINC000414353276 1119995648 /nfs/dbraw/zinc/99/56/48/1119995648.db2.gz VMYYLGGRSRMSPU-BZUAXINKSA-N 1 0 298.342 3.711 20 5 CHBDRO CCCC[NH+]1CCC(Nc2cc(C)ccc2[N+](=O)[O-])CC1 ZINC000301585671 1120103313 /nfs/dbraw/zinc/10/33/13/1120103313.db2.gz VYYSHWFQUVCDPR-UHFFFAOYSA-N 1 0 291.395 3.580 20 5 CHBDRO CC[C@H]1CC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000554371345 1120160312 /nfs/dbraw/zinc/16/03/12/1120160312.db2.gz LIRAZYPRRAJALQ-ZANVPECISA-N 1 0 268.744 3.526 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(C2CC2)CC1 ZINC000468615179 1120203787 /nfs/dbraw/zinc/20/37/87/1120203787.db2.gz KUROXPFLKSWLPG-LCYFTJDESA-N 1 0 286.375 3.778 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1ccc(C)cn1 ZINC000468631809 1120228700 /nfs/dbraw/zinc/22/87/00/1120228700.db2.gz MVVLNVBWIGEZJY-JYRVWZFOSA-N 1 0 283.331 3.814 20 5 CHBDRO CCS[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000300670380 1120238912 /nfs/dbraw/zinc/23/89/12/1120238912.db2.gz RIPCGACNBLNUTE-ZFWWWQNUSA-N 1 0 294.420 3.667 20 5 CHBDRO Cc1c(C[NH2+]CC(C(C)C)C(C)C)cccc1[N+](=O)[O-] ZINC000229549560 1120263059 /nfs/dbraw/zinc/26/30/59/1120263059.db2.gz RIEOWBFUAKSSQR-UHFFFAOYSA-N 1 0 278.396 3.921 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000312122486 1120309427 /nfs/dbraw/zinc/30/94/27/1120309427.db2.gz WKNHKYVZEVXEKZ-NSHDSACASA-N 1 0 268.332 3.744 20 5 CHBDRO Cc1ncsc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000132423515 1120438725 /nfs/dbraw/zinc/43/87/25/1120438725.db2.gz PWJPBZVFISHLHH-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CC=CCC1 ZINC000543179073 1120453163 /nfs/dbraw/zinc/45/31/63/1120453163.db2.gz WICLCHQMHWGXCR-GFCCVEGCSA-N 1 0 278.327 3.522 20 5 CHBDRO CC[C@@H]1CCC[C@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000068592692 1120478832 /nfs/dbraw/zinc/47/88/32/1120478832.db2.gz KPSYZCCMFUONGN-KGLIPLIRSA-N 1 0 292.379 3.532 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000532072997 1120495914 /nfs/dbraw/zinc/49/59/14/1120495914.db2.gz WOHXTWVWGDAMRA-CYBMUJFWSA-N 1 0 292.379 3.616 20 5 CHBDRO C[C@@H](c1ccco1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000131043738 1120511210 /nfs/dbraw/zinc/51/12/10/1120511210.db2.gz WTQFZRGHUAGMGT-LJLILKBBSA-N 1 0 286.331 3.894 20 5 CHBDRO CCC1(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000468749003 1120524807 /nfs/dbraw/zinc/52/48/07/1120524807.db2.gz YXCNRUHQVJIMJQ-LCYFTJDESA-N 1 0 274.364 3.778 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCCC[C@@H]1OC)c1cccc([N+](=O)[O-])c1 ZINC000123174286 1120531509 /nfs/dbraw/zinc/53/15/09/1120531509.db2.gz QTCZFIJGEMDGEB-PMPSAXMXSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc(C[N@@H+](C(C)C)C2CCC2)cc1[N+](=O)[O-] ZINC000093608301 1120563826 /nfs/dbraw/zinc/56/38/26/1120563826.db2.gz ZWKPYKUMKRJCSB-UHFFFAOYSA-N 1 0 262.353 3.666 20 5 CHBDRO CC(C)(/C=C/Cl)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000922649051 1120571645 /nfs/dbraw/zinc/57/16/45/1120571645.db2.gz RLIACMQOWDBDNT-GLVZAGOZSA-N 1 0 280.755 3.729 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCSC3(CCC3)C2)cs1 ZINC000922842991 1120609567 /nfs/dbraw/zinc/60/95/67/1120609567.db2.gz RQRZWIUTXCKYEK-NSHDSACASA-N 1 0 298.433 3.564 20 5 CHBDRO Cc1c(C[NH2+]C[C@H](C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000125441476 1120614109 /nfs/dbraw/zinc/61/41/09/1120614109.db2.gz JSQVCEVKAZMLPK-NSHDSACASA-N 1 0 264.369 3.675 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000511855396 1120665988 /nfs/dbraw/zinc/66/59/88/1120665988.db2.gz OAPZQBQDEIWROY-YORMDBTCSA-N 1 0 286.375 3.873 20 5 CHBDRO Cc1c(C[N@H+](C)Cc2ccsc2)cccc1[N+](=O)[O-] ZINC000051455381 1120924213 /nfs/dbraw/zinc/92/42/13/1120924213.db2.gz DTXRZZYCVBVUQI-UHFFFAOYSA-N 1 0 276.361 3.597 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000343979485 1121028799 /nfs/dbraw/zinc/02/87/99/1121028799.db2.gz NHZJAMIEMQLFRY-SWLSCSKDSA-N 1 0 285.347 3.792 20 5 CHBDRO CC1(C)C[C@H]([NH2+]C2CC=CC2)c2cc([N+](=O)[O-])ccc21 ZINC000618984968 1128959367 /nfs/dbraw/zinc/95/93/67/1128959367.db2.gz QQYGOMLUKWTZJK-HNNXBMFYSA-N 1 0 272.348 3.625 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000500495114 1121286788 /nfs/dbraw/zinc/28/67/88/1121286788.db2.gz ATXMEDJRPDBCNW-OAHLLOKOSA-N 1 0 276.380 3.914 20 5 CHBDRO CC(C)(C)C(=[NH2+])Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC001162661656 1121328659 /nfs/dbraw/zinc/32/86/59/1121328659.db2.gz YSTPFMJSYJWBBH-UHFFFAOYSA-N 1 0 272.308 3.578 20 5 CHBDRO CC[C@H]([NH2+]CC[C@@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000704774869 1121367901 /nfs/dbraw/zinc/36/79/01/1121367901.db2.gz ZYUBZMPCAHWNTD-DOMZBBRYSA-N 1 0 294.420 3.779 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(F)(F)CC1 ZINC000619434103 1128991777 /nfs/dbraw/zinc/99/17/77/1128991777.db2.gz NLSUUTWXYNXSNS-XFXZXTDPSA-N 1 0 296.317 3.729 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CC23CCCC3)cccc1[N+](=O)[O-] ZINC000429433672 1121578077 /nfs/dbraw/zinc/57/80/77/1121578077.db2.gz WEJWWUDXRYSRGR-IUODEOHRSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)CC2 ZINC000611439171 1121647831 /nfs/dbraw/zinc/64/78/31/1121647831.db2.gz IMVYFGBQLUSNOC-AWEZNQCLSA-N 1 0 288.372 3.742 20 5 CHBDRO CC(C)(C)C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000611442114 1121648558 /nfs/dbraw/zinc/64/85/58/1121648558.db2.gz SZQBDCLQWHGPIU-UHFFFAOYSA-N 1 0 264.369 3.553 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC(F)(F)C1 ZINC000611475905 1121651087 /nfs/dbraw/zinc/65/10/87/1121651087.db2.gz PHPUFOITOBHNMH-YPMHNXCESA-N 1 0 298.333 3.693 20 5 CHBDRO Cc1ccc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000544186767 1121684036 /nfs/dbraw/zinc/68/40/36/1121684036.db2.gz IYGSHXZHDCPYJP-KRWDZBQOSA-N 1 0 296.370 3.893 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000052337476 1121702529 /nfs/dbraw/zinc/70/25/29/1121702529.db2.gz NEJRRNMVQZOSBD-LLVKDONJSA-N 1 0 280.343 3.792 20 5 CHBDRO CC1=CCC[C@@H](C)[C@@H]1C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC001178393738 1121781752 /nfs/dbraw/zinc/78/17/52/1121781752.db2.gz WFKKXZZELJNDSF-RHSMWYFYSA-N 1 0 288.391 3.719 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000037770941 1129008770 /nfs/dbraw/zinc/00/87/70/1129008770.db2.gz VKGBWVAOMXYYFB-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC001179685828 1121898464 /nfs/dbraw/zinc/89/84/64/1121898464.db2.gz QNMCGUVQZWRMBG-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO CSC(C)(C)CC[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC001180664255 1122006737 /nfs/dbraw/zinc/00/67/37/1122006737.db2.gz FSGHVWCGEVQKNB-UHFFFAOYSA-N 1 0 296.436 3.951 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000501787998 1122008638 /nfs/dbraw/zinc/00/86/38/1122008638.db2.gz BWMXTCVJPCFJPS-FRRDWIJNSA-N 1 0 262.353 3.634 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000501792207 1122009860 /nfs/dbraw/zinc/00/98/60/1122009860.db2.gz CWLNPQCGLYWFAN-AGIUHOORSA-N 1 0 262.353 3.634 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CCC23CCC3)cc1 ZINC000502450008 1122085895 /nfs/dbraw/zinc/08/58/95/1122085895.db2.gz FOTYXVGZQXLBPZ-INIZCTEOSA-N 1 0 288.391 3.840 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccccc1 ZINC000183207137 1129034065 /nfs/dbraw/zinc/03/40/65/1129034065.db2.gz DLQTYZWPORDYAE-UHFFFAOYSA-N 1 0 270.332 3.535 20 5 CHBDRO C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000035010712 1122148197 /nfs/dbraw/zinc/14/81/97/1122148197.db2.gz CSURDDIGLGYZOY-JTQLQIEISA-N 1 0 292.285 3.724 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]C[C@H]1C[C@H]1c1ccccc1 ZINC000503036163 1122163844 /nfs/dbraw/zinc/16/38/44/1122163844.db2.gz QGZDHAMZWDPDOD-SJORKVTESA-N 1 0 296.370 3.531 20 5 CHBDRO CC1=CC[C@@H]([NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC001184046139 1122253692 /nfs/dbraw/zinc/25/36/92/1122253692.db2.gz UTRMQJPZMHXVTB-UONOGXRCSA-N 1 0 274.364 3.787 20 5 CHBDRO CC(C)C[NH+](Cc1c(F)cccc1[N+](=O)[O-])CC(C)C ZINC000505552575 1122417406 /nfs/dbraw/zinc/41/74/06/1122417406.db2.gz BCYBSFFZUHVJPT-UHFFFAOYSA-N 1 0 282.359 3.848 20 5 CHBDRO CC(C)C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000505615450 1122438268 /nfs/dbraw/zinc/43/82/68/1122438268.db2.gz ZQYLMGVJQBKPRI-UHFFFAOYSA-N 1 0 268.332 3.600 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000505640166 1122447710 /nfs/dbraw/zinc/44/77/10/1122447710.db2.gz YEFHRARDNQWLFF-CZUORRHYSA-N 1 0 296.370 3.975 20 5 CHBDRO CCC(C)(CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000183477775 1129057611 /nfs/dbraw/zinc/05/76/11/1129057611.db2.gz WTEYEKJSYXMREO-UHFFFAOYSA-N 1 0 250.342 3.572 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000515509594 1122504268 /nfs/dbraw/zinc/50/42/68/1122504268.db2.gz SMPUUCYFHLZQGS-RBOXIYTFSA-N 1 0 274.364 3.600 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000578053298 1122552344 /nfs/dbraw/zinc/55/23/44/1122552344.db2.gz KSGMJCMQRHSIOP-GFCCVEGCSA-N 1 0 250.342 3.605 20 5 CHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000506220217 1122697934 /nfs/dbraw/zinc/69/79/34/1122697934.db2.gz VAEDHLRDBZZDCI-JSGCOSHPSA-N 1 0 262.353 3.605 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426524700 1122812867 /nfs/dbraw/zinc/81/28/67/1122812867.db2.gz PNQPWWYAGKGMAB-MFKMUULPSA-N 1 0 280.755 3.623 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H]1CC1(C)C ZINC000426569507 1122824160 /nfs/dbraw/zinc/82/41/60/1122824160.db2.gz AVTREXFKFFIJSA-LDCOFTPGSA-N 1 0 274.364 3.728 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@@H](C)[C@H]1C ZINC001195277902 1122860254 /nfs/dbraw/zinc/86/02/54/1122860254.db2.gz HDJRJOXALBBZSU-FDYHWXHSSA-N 1 0 262.353 3.632 20 5 CHBDRO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCC[C@H]1C(C)(C)C ZINC001195279152 1122860687 /nfs/dbraw/zinc/86/06/87/1122860687.db2.gz NAKHHFBUDJJEIB-ZIAGYGMSSA-N 1 0 291.395 3.636 20 5 CHBDRO Cc1ccc(C[NH+]2CCC(C3CCC3)CC2)cc1[N+](=O)[O-] ZINC001195947552 1122900196 /nfs/dbraw/zinc/90/01/96/1122900196.db2.gz UKNOQCGVBIBJCH-UHFFFAOYSA-N 1 0 288.391 3.915 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426822128 1122918458 /nfs/dbraw/zinc/91/84/58/1122918458.db2.gz ZZFLYCVNWQJXRZ-TXEJJXNPSA-N 1 0 294.782 3.870 20 5 CHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC(C)C ZINC000507116751 1122925263 /nfs/dbraw/zinc/92/52/63/1122925263.db2.gz RIUPPIWQHCWICQ-CLFYSBASSA-N 1 0 262.353 3.586 20 5 CHBDRO CCC1(CC)CCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001197515149 1122958143 /nfs/dbraw/zinc/95/81/43/1122958143.db2.gz YYIXSOSZSMEKLT-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000507672219 1122983119 /nfs/dbraw/zinc/98/31/19/1122983119.db2.gz JJJDTYTVLITASG-INIZCTEOSA-N 1 0 296.370 3.659 20 5 CHBDRO CCCCC1([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC001198554735 1123000071 /nfs/dbraw/zinc/00/00/71/1123000071.db2.gz UDJAZGMBRWZMML-UHFFFAOYSA-N 1 0 262.353 3.716 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000049119596 1123110849 /nfs/dbraw/zinc/11/08/49/1123110849.db2.gz COWRLAULRHFUEZ-RISCZKNCSA-N 1 0 280.343 3.792 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)cccc1[N+](=O)[O-] ZINC000441432672 1123116850 /nfs/dbraw/zinc/11/68/50/1123116850.db2.gz FBGVBRHDFBIHML-XJKSGUPXSA-N 1 0 274.364 3.668 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCCc1ccco1 ZINC000850407634 1123263702 /nfs/dbraw/zinc/26/37/02/1123263702.db2.gz LYYDKQXSXUTWND-UHFFFAOYSA-N 1 0 294.738 3.564 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C=CCC1 ZINC000850506423 1123276353 /nfs/dbraw/zinc/27/63/53/1123276353.db2.gz APYGBMQFXDEAJL-QWHCGFSZSA-N 1 0 292.404 3.774 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC2(CCCC2)C1 ZINC000851791089 1123380983 /nfs/dbraw/zinc/38/09/83/1123380983.db2.gz SSJWPBHBMGDFIE-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO C[C@@H](CC1CCC1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000129622781 1123405068 /nfs/dbraw/zinc/40/50/68/1123405068.db2.gz ZIGQCKDPBIQSDG-RYUDHWBXSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1(C2CCC2)CCC1 ZINC000414180963 1123507305 /nfs/dbraw/zinc/50/73/05/1123507305.db2.gz MFZJJUXWBXINMO-CYBMUJFWSA-N 1 0 288.391 3.838 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)C2(C)CC2)cccc1[N+](=O)[O-] ZINC000776884042 1123559587 /nfs/dbraw/zinc/55/95/87/1123559587.db2.gz WMQMJWSFUVTDAH-NWDGAFQWSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C2Cc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000184005598 1129144141 /nfs/dbraw/zinc/14/41/41/1129144141.db2.gz OPSVCDRGXMAEED-CYBMUJFWSA-N 1 0 296.370 3.721 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C1CC1)C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000324713838 1123798599 /nfs/dbraw/zinc/79/85/99/1123798599.db2.gz XCYJCHRCKVQAET-BDJLRTHQSA-N 1 0 274.364 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCc1ccccc1 ZINC000084439710 1129152596 /nfs/dbraw/zinc/15/25/96/1129152596.db2.gz HVEBYGXMSYQLBQ-UHFFFAOYSA-N 1 0 290.750 3.581 20 5 CHBDRO Cc1ccc(COc2ccc([C@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000864554867 1123936165 /nfs/dbraw/zinc/93/61/65/1123936165.db2.gz OBCQWHKVGIWSCP-LBPRGKRZSA-N 1 0 286.331 3.502 20 5 CHBDRO OC[C@H]1C[C@@H]([NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000865664909 1124003800 /nfs/dbraw/zinc/00/38/00/1124003800.db2.gz NDFJPAUBHBHXQZ-KDYLLFBJSA-N 1 0 291.394 3.854 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000866448512 1124066052 /nfs/dbraw/zinc/06/60/52/1124066052.db2.gz HMMKWKXVSZPUHC-LEWSCRJBSA-N 1 0 266.316 3.526 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000121647113 1124112214 /nfs/dbraw/zinc/11/22/14/1124112214.db2.gz YTBRNAVJNBOPAA-UKRRQHHQSA-N 1 0 296.370 3.894 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCCC12CCC2 ZINC000446837114 1124124873 /nfs/dbraw/zinc/12/48/73/1124124873.db2.gz XWSIYIVAAPHCKV-XVNBXDOJSA-N 1 0 272.348 3.627 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC(F)F ZINC001119540099 1131258034 /nfs/dbraw/zinc/25/80/34/1131258034.db2.gz FIMACSLDRKPEHG-SNVBAGLBSA-N 1 0 272.295 3.599 20 5 CHBDRO C[C@H](CC1CC1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447535880 1124484803 /nfs/dbraw/zinc/48/48/03/1124484803.db2.gz JCIYJBNOEYPXBA-BZNIZROVSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@@H]1C[C@H](C)[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000526989370 1124538344 /nfs/dbraw/zinc/53/83/44/1124538344.db2.gz RJJNPOQMJYPHJJ-TXEJJXNPSA-N 1 0 286.331 3.838 20 5 CHBDRO Cc1ccc(CC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000449141237 1124655426 /nfs/dbraw/zinc/65/54/26/1124655426.db2.gz KWLJUZVECQKEKV-OAHLLOKOSA-N 1 0 298.386 3.667 20 5 CHBDRO C[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872020399 1124658038 /nfs/dbraw/zinc/65/80/38/1124658038.db2.gz HANNUTNKGBXZPU-QWRGUYRKSA-N 1 0 292.310 3.609 20 5 CHBDRO CC(C)C1(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449170920 1124658882 /nfs/dbraw/zinc/65/88/82/1124658882.db2.gz JLMWKYLBODLSLB-ZDUSSCGKSA-N 1 0 276.380 3.552 20 5 CHBDRO CC[C@@H](CCC(F)(F)F)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000872048393 1124666241 /nfs/dbraw/zinc/66/62/41/1124666241.db2.gz ZNILRQSIJCMCGO-NSHDSACASA-N 1 0 290.285 3.806 20 5 CHBDRO CC(C)OCCCC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872061435 1124670058 /nfs/dbraw/zinc/67/00/58/1124670058.db2.gz YOFNHTJWQXECHF-LBPRGKRZSA-N 1 0 298.358 3.590 20 5 CHBDRO Cc1csc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000873130660 1124739219 /nfs/dbraw/zinc/73/92/19/1124739219.db2.gz FWRHDOCEMYYLIV-UHFFFAOYSA-N 1 0 290.388 3.871 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2c3ccccc3O[C@H]2C)cccc1[N+](=O)[O-] ZINC000873127973 1124739852 /nfs/dbraw/zinc/73/98/52/1124739852.db2.gz YOZQXCRWDSGNDU-SJCJKPOMSA-N 1 0 298.342 3.515 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H](C)CC(F)F ZINC000873134627 1124741504 /nfs/dbraw/zinc/74/15/04/1124741504.db2.gz SAPLBXSYWXCWSX-SECBINFHSA-N 1 0 286.322 3.593 20 5 CHBDRO CC/C=C\C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000449464646 1124757696 /nfs/dbraw/zinc/75/76/96/1124757696.db2.gz YNKWEPVTBRMWTK-IBKJGWGWSA-N 1 0 260.337 3.554 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(C)CC(F)(F)C1 ZINC000883255323 1125385922 /nfs/dbraw/zinc/38/59/22/1125385922.db2.gz RXRHKZKVOXERAW-NSHDSACASA-N 1 0 298.333 3.989 20 5 CHBDRO CC1(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC(F)(F)C1 ZINC000883257056 1125386664 /nfs/dbraw/zinc/38/66/64/1125386664.db2.gz PSOREEQAFJPBCL-LBPRGKRZSA-N 1 0 296.317 3.607 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C2CC(c3ccccc3)C2)cs1 ZINC000105492481 1125436569 /nfs/dbraw/zinc/43/65/69/1125436569.db2.gz JJIKDDNWPGZYPU-UHFFFAOYSA-N 1 0 288.372 3.692 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC[C@@H]2CCc3ccccc32)c1 ZINC001202602980 1125440810 /nfs/dbraw/zinc/44/08/10/1125440810.db2.gz PDJXANZHZVORKY-INIZCTEOSA-N 1 0 296.370 3.805 20 5 CHBDRO Cc1ccccc1C[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000037777319 1129268927 /nfs/dbraw/zinc/26/89/27/1129268927.db2.gz ZLOVVIQECXXQMJ-CQSZACIVSA-N 1 0 284.359 3.624 20 5 CHBDRO CC[C@@H](C)C[N@H+](CC)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774966 1129451657 /nfs/dbraw/zinc/45/16/57/1129451657.db2.gz RRFVIPCQEVRYQC-LLVKDONJSA-N 1 0 268.332 3.602 20 5 CHBDRO O=[N+]([O-])CC[NH2+][C@@H](CC1CCCCC1)c1ccccc1 ZINC001168826412 1129674567 /nfs/dbraw/zinc/67/45/67/1129674567.db2.gz SWMWQUUDPFNPNJ-INIZCTEOSA-N 1 0 276.380 3.564 20 5 CHBDRO CC[C@H]([NH2+]CCNc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000766515358 1129678984 /nfs/dbraw/zinc/67/89/84/1129678984.db2.gz MPPFFDJKGVPOGB-KRWDZBQOSA-N 1 0 299.374 3.748 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168976684 1129686072 /nfs/dbraw/zinc/68/60/72/1129686072.db2.gz FBEDHCMVGMYSBR-BMFZPTHFSA-N 1 0 276.380 3.563 20 5 CHBDRO CC(C)[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168981783 1129686974 /nfs/dbraw/zinc/68/69/74/1129686974.db2.gz HGUAUMWNWMHEMD-RCBQFDQVSA-N 1 0 294.370 3.558 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168979226 1129687233 /nfs/dbraw/zinc/68/72/33/1129687233.db2.gz XGAKLCVGFJQSCQ-GOEBONIOSA-N 1 0 298.386 3.683 20 5 CHBDRO CC(C)(C)c1ccc(C[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001168966499 1129687532 /nfs/dbraw/zinc/68/75/32/1129687532.db2.gz IQSOYAMVCPYXCS-ZBFHGGJFSA-N 1 0 290.407 3.519 20 5 CHBDRO CC(C)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168968751 1129688480 /nfs/dbraw/zinc/68/84/80/1129688480.db2.gz AEYOMJJQYPXLLO-BXUZGUMPSA-N 1 0 296.798 3.610 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]CCCCC2CCCCC2)C1 ZINC001169004579 1129689429 /nfs/dbraw/zinc/68/94/29/1129689429.db2.gz RFPKPABPXIAIFQ-HZPDHXFCSA-N 1 0 282.428 3.772 20 5 CHBDRO CC[N@H+](Cc1cccc(Cl)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169042787 1129690725 /nfs/dbraw/zinc/69/07/25/1129690725.db2.gz FSCBNWDRFPANNW-UKRRQHHQSA-N 1 0 296.798 3.607 20 5 CHBDRO C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C1CCC(C(C)(C)C)CC1 ZINC001169036348 1129690737 /nfs/dbraw/zinc/69/07/37/1129690737.db2.gz FRBHNRGECUFPBK-LBDPXKHJSA-N 1 0 296.455 3.969 20 5 CHBDRO CC[C@H](c1ccccc1)[N@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169040122 1129690900 /nfs/dbraw/zinc/69/09/00/1129690900.db2.gz YAXHZEHYVCNEAN-CWRNSKLLSA-N 1 0 276.380 3.515 20 5 CHBDRO C[N@H+](Cc1ccc2ccccc2c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046786 1129691307 /nfs/dbraw/zinc/69/13/07/1129691307.db2.gz NANWOJCGYNPXLE-MAUKXSAKSA-N 1 0 298.386 3.717 20 5 CHBDRO CC(C)[N@H+]([C@@H](C)c1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169048720 1129692079 /nfs/dbraw/zinc/69/20/79/1129692079.db2.gz AXLMVPHBFVVJNI-UXLLHSPISA-N 1 0 290.407 3.903 20 5 CHBDRO Cc1ccccc1[C@H]1CCC[N@@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169055870 1129693263 /nfs/dbraw/zinc/69/32/63/1129693263.db2.gz QXBXTIXSMMUYRF-YQQAZPJKSA-N 1 0 288.391 3.577 20 5 CHBDRO C[C@H]([NH2+]CC1(C)CC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000720912219 1129720342 /nfs/dbraw/zinc/72/03/42/1129720342.db2.gz MABFEHQCIRBVJT-JTQLQIEISA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@@H](C1CCCCC1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001169734140 1129753418 /nfs/dbraw/zinc/75/34/18/1129753418.db2.gz RSAOERPZBAQUJR-ZDUSSCGKSA-N 1 0 276.380 3.995 20 5 CHBDRO C[C@@]1(O)CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769543390 1129916868 /nfs/dbraw/zinc/91/68/68/1129916868.db2.gz OTZOJZVFPGBVJD-HXUWFJFHSA-N 1 0 291.394 3.950 20 5 CHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801517199 1129923792 /nfs/dbraw/zinc/92/37/92/1129923792.db2.gz BHFVYVKSCQFPDI-RYUDHWBXSA-N 1 0 280.343 3.744 20 5 CHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCCC1 ZINC000801522596 1129924574 /nfs/dbraw/zinc/92/45/74/1129924574.db2.gz WCSICERPGFQSLY-UHFFFAOYSA-N 1 0 280.343 3.887 20 5 CHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C[C@@H]1CC=CCC1 ZINC000801539781 1129925804 /nfs/dbraw/zinc/92/58/04/1129925804.db2.gz PSUGUWRCFNXZNK-GFCCVEGCSA-N 1 0 278.327 3.522 20 5 CHBDRO CC(C)[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC1CCC1 ZINC000769929508 1129932809 /nfs/dbraw/zinc/93/28/09/1129932809.db2.gz ZOZNQGLBCRZRTN-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO CN(c1nc2ccccc2c2ccccc21)C(C)(C)C[NH3+] ZINC001170060924 1130109903 /nfs/dbraw/zinc/10/99/03/1130109903.db2.gz XINOOXXZIFFUTD-UHFFFAOYSA-N 1 0 279.387 3.562 20 5 CHBDRO C[C@H]1CC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000786930457 1130123450 /nfs/dbraw/zinc/12/34/50/1130123450.db2.gz IZVYEOKXKXIDIR-QPUJVOFHSA-N 1 0 288.269 3.502 20 5 CHBDRO Cc1cccc(C)c1C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788671842 1130202310 /nfs/dbraw/zinc/20/23/10/1130202310.db2.gz ZJEWQFQBWPYLNR-ZDUSSCGKSA-N 1 0 299.374 3.645 20 5 CHBDRO C[C@@H]([NH2+]CCCC(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788669418 1130202357 /nfs/dbraw/zinc/20/23/57/1130202357.db2.gz ZTLKCVJJSXANPA-LLVKDONJSA-N 1 0 279.384 3.654 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000748819381 1130248252 /nfs/dbraw/zinc/24/82/52/1130248252.db2.gz GWGWKKYYXNZXQZ-GFCCVEGCSA-N 1 0 276.380 3.996 20 5 CHBDRO CCC(CC)C[NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170298294 1130476437 /nfs/dbraw/zinc/47/64/37/1130476437.db2.gz IOAJATNINVFAGL-LBPRGKRZSA-N 1 0 294.395 3.560 20 5 CHBDRO CCCC[C@@H](C)[NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170328870 1130483491 /nfs/dbraw/zinc/48/34/91/1130483491.db2.gz WWVPBIJJEJDNFY-OLZOCXBDSA-N 1 0 294.395 3.703 20 5 CHBDRO COc1ccc(C[C@H](C)[N@H+](C)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC001170348565 1130486991 /nfs/dbraw/zinc/48/69/91/1130486991.db2.gz YMSUAOPMDHNZQO-LBPRGKRZSA-N 1 0 294.395 3.512 20 5 CHBDRO C[C@@H]1CC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000793347755 1130548532 /nfs/dbraw/zinc/54/85/32/1130548532.db2.gz ZJWHYMAORJICPD-GHMZBOCLSA-N 1 0 282.771 3.774 20 5 CHBDRO CC[NH+](CC)C[C@@H](C)Oc1cc(C)c([N+](=O)[O-])c(C)c1C ZINC001234871756 1130687045 /nfs/dbraw/zinc/68/70/45/1130687045.db2.gz MPQOJDBJJSUVGL-GFCCVEGCSA-N 1 0 294.395 3.629 20 5 CHBDRO CCC(C)(C)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000695154932 1130793137 /nfs/dbraw/zinc/79/31/37/1130793137.db2.gz YASWOCZGMPOHNF-JTQLQIEISA-N 1 0 268.332 3.648 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783710658 1130850764 /nfs/dbraw/zinc/85/07/64/1130850764.db2.gz SFLOSLNAQRBXTR-KOLCDFICSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815579460 1131002503 /nfs/dbraw/zinc/00/25/03/1131002503.db2.gz NHMVGTKILXGILC-UJZCVKTISA-N 1 0 297.358 3.541 20 5 CHBDRO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000815590139 1131004518 /nfs/dbraw/zinc/00/45/18/1131004518.db2.gz NAQUQHSYWKSIDC-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[N@@H+]1CCCC[C@H]1CCOc1ccc([N+](=O)[O-])cc1Cl ZINC000798213013 1131030156 /nfs/dbraw/zinc/03/01/56/1131030156.db2.gz HVHGHKKSSFNUQV-NSHDSACASA-N 1 0 298.770 3.501 20 5 CHBDRO C[C@H]([NH2+]CC1(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000218028827 1131105974 /nfs/dbraw/zinc/10/59/74/1131105974.db2.gz ZIIFBFPMTURRDS-AWEZNQCLSA-N 1 0 296.370 3.977 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001115984278 1131124321 /nfs/dbraw/zinc/12/43/21/1131124321.db2.gz NGIGNZUCSHERGD-OLZOCXBDSA-N 1 0 292.354 3.746 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C/C=C\C2CC2)cc1[N+](=O)[O-] ZINC001117712230 1131193519 /nfs/dbraw/zinc/19/35/19/1131193519.db2.gz CTMSSWUGJDYIFK-RXNFCKPNSA-N 1 0 290.363 3.610 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H]2CCC[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC001202813095 1131436553 /nfs/dbraw/zinc/43/65/53/1131436553.db2.gz QSILICVUPSCNBS-HZPDHXFCSA-N 1 0 288.391 3.819 20 5 CHBDRO CCc1cccc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000846209728 1131695674 /nfs/dbraw/zinc/69/56/74/1131695674.db2.gz SWFLRXQBWXPZRK-GFCCVEGCSA-N 1 0 299.374 3.590 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc2c(c1)[nH]c1ccccc12 ZINC001228487191 1131894028 /nfs/dbraw/zinc/89/40/28/1131894028.db2.gz SDVPRWSPCLSCBM-CYBMUJFWSA-N 1 0 283.395 3.795 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000773122459 1131952096 /nfs/dbraw/zinc/95/20/96/1131952096.db2.gz UABKRYRGDRXJPS-NEPJUHHUSA-N 1 0 273.336 3.643 20 5 CHBDRO C[C@@H]([NH2+]CC[C@@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000715755835 1131992040 /nfs/dbraw/zinc/99/20/40/1131992040.db2.gz RKUSHXHOBJKRHO-RISCZKNCSA-N 1 0 280.393 3.531 20 5 CHBDRO CC[C@H](C)[N@H+](CC)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001171916484 1132109355 /nfs/dbraw/zinc/10/93/55/1132109355.db2.gz MIHFCDRDZBJQEH-LBPRGKRZSA-N 1 0 250.342 3.524 20 5 CHBDRO C[C@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)C[C@H]1O ZINC001141722573 1132240074 /nfs/dbraw/zinc/24/00/74/1132240074.db2.gz DJYUKWPQOBGLPU-VBKZILBWSA-N 1 0 291.394 3.806 20 5 CHBDRO CCCc1ccc2cccnc2c1O[C@H](C)C[N+](C)(C)C ZINC001231328208 1132282540 /nfs/dbraw/zinc/28/25/40/1132282540.db2.gz YXXZQZJRJYEYRJ-CQSZACIVSA-N 1 0 287.427 3.661 20 5 CHBDRO CC(C)(C)CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898805 1132347760 /nfs/dbraw/zinc/34/77/60/1132347760.db2.gz PINDFMQEVGPCDH-HNNXBMFYSA-N 1 0 290.407 3.868 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C1CCC1 ZINC001172906318 1132348699 /nfs/dbraw/zinc/34/86/99/1132348699.db2.gz NYURLPIYELSJKI-MLGOLLRUSA-N 1 0 288.391 3.620 20 5 CHBDRO CC1(C)CC([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172912757 1132372157 /nfs/dbraw/zinc/37/21/57/1132372157.db2.gz PHSARHAMHSUMBL-AWEZNQCLSA-N 1 0 288.391 3.620 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH+]1CCCCCC1)CC2 ZINC001172910392 1132372556 /nfs/dbraw/zinc/37/25/56/1132372556.db2.gz YTMKTKIWXBQBLJ-INIZCTEOSA-N 1 0 288.391 3.718 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)C[C@@H]1C ZINC001173227604 1132412273 /nfs/dbraw/zinc/41/22/73/1132412273.db2.gz RFTMWBBNKNTULO-RDBSUJKOSA-N 1 0 276.380 3.646 20 5 CHBDRO CC(C)[NH+](C(C)C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225285 1132412583 /nfs/dbraw/zinc/41/25/83/1132412583.db2.gz JCXMELZBQUJRHX-ZDUSSCGKSA-N 1 0 264.369 3.645 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)C[C@H]1C ZINC001173227603 1132412670 /nfs/dbraw/zinc/41/26/70/1132412670.db2.gz RFTMWBBNKNTULO-MGPQQGTHSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC(F)(F)CC1 ZINC001173228929 1132412728 /nfs/dbraw/zinc/41/27/28/1132412728.db2.gz NSHYUCTUIZHGPS-LBPRGKRZSA-N 1 0 298.333 3.647 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C(F)F)CC1 ZINC001173232317 1132413715 /nfs/dbraw/zinc/41/37/15/1132413715.db2.gz DUSZYIZJRSDKSF-NSHDSACASA-N 1 0 298.333 3.503 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC001173233592 1132413739 /nfs/dbraw/zinc/41/37/39/1132413739.db2.gz JQVGBYHUUDBPHH-GUYCJALGSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C(F)F)CC1 ZINC001173232315 1132413970 /nfs/dbraw/zinc/41/39/70/1132413970.db2.gz DUSZYIZJRSDKSF-LLVKDONJSA-N 1 0 298.333 3.503 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC2CCC(CC2)C1 ZINC001173231028 1132414284 /nfs/dbraw/zinc/41/42/84/1132414284.db2.gz IUIWMHLVBISLLP-IUDNXUCKSA-N 1 0 288.391 3.648 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C[N@@H+]3CCC[C@H]4C[C@H]43)nc12 ZINC001232222334 1132438327 /nfs/dbraw/zinc/43/83/27/1132438327.db2.gz AYBYNTOJBQWMLG-DOTOQJQBSA-N 1 0 289.382 3.767 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C[NH+]3CCCCC3)nc12 ZINC001232217832 1132438475 /nfs/dbraw/zinc/43/84/75/1132438475.db2.gz BRDMBSWDWRHWJK-UHFFFAOYSA-N 1 0 277.371 3.769 20 5 CHBDRO CC[NH2+]Cc1cccc(Nc2ccc(F)cc2[N+](=O)[O-])c1 ZINC001159956602 1132928291 /nfs/dbraw/zinc/92/82/91/1132928291.db2.gz MDNMAFIXFVJLOY-UHFFFAOYSA-N 1 0 289.310 3.587 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCc1cnc(C)s1 ZINC001162159699 1133055855 /nfs/dbraw/zinc/05/58/55/1133055855.db2.gz KRFGYQXFWYXMQP-UHFFFAOYSA-N 1 0 290.456 3.660 20 5 CHBDRO C[NH2+][C@H]1C[C@@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001217956376 1135031352 /nfs/dbraw/zinc/03/13/52/1135031352.db2.gz XTPLGGIENSCTEO-GASCZTMLSA-N 1 0 278.355 3.517 20 5 CHBDRO c1ccc2nc3c(cccc3OC3CC4(CC[NH2+]4)C3)cc2c1 ZINC001218248294 1135075040 /nfs/dbraw/zinc/07/50/40/1135075040.db2.gz IIOLZGOTUNRJQV-UHFFFAOYSA-N 1 0 290.366 3.661 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@H]3[C@@H]4CC[C@H]3[NH2+]C4)c12 ZINC001218445207 1135107317 /nfs/dbraw/zinc/10/73/17/1135107317.db2.gz UVJRKOMWWHSECC-CLCXKQKWSA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCc1cccc(-c2ccccc2)c1 ZINC001222118571 1135195334 /nfs/dbraw/zinc/19/53/34/1135195334.db2.gz XNDKCKQZCVFLRJ-INIZCTEOSA-N 1 0 284.423 3.965 20 5 CHBDRO CC(C)[NH+]1CCC(O[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC001223426913 1135345216 /nfs/dbraw/zinc/34/52/16/1135345216.db2.gz BHLDGMWVQGNJKK-ZDUSSCGKSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H](O[C@H]1CC[C@H]([NH+](C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC001224021598 1135410767 /nfs/dbraw/zinc/41/07/67/1135410767.db2.gz ASXWKHOCVWMHCN-NOLJZWGESA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCCC12CC3CC(CC(C3)C1)C2 ZINC001224463875 1135452151 /nfs/dbraw/zinc/45/21/51/1135452151.db2.gz QCQNITQVMPOOPJ-CZVCLPBNSA-N 1 0 280.476 3.704 20 5 CHBDRO C[C@@H](OCCC[N+](C)(C)C)c1cccc(C(F)(F)F)c1 ZINC001224620277 1135462198 /nfs/dbraw/zinc/46/21/98/1135462198.db2.gz WALPWWWTYYXWAR-GFCCVEGCSA-N 1 0 290.349 3.879 20 5 CHBDRO C[N+](C)(C)CCCOC1c2ccccc2-c2ccccc21 ZINC001224623055 1135462406 /nfs/dbraw/zinc/46/24/06/1135462406.db2.gz KWVCAEMIFITYLX-UHFFFAOYSA-N 1 0 282.407 3.869 20 5 CHBDRO CC(C)(C)C1CCC(OCCC[N+](C)(C)C)CC1 ZINC001224622533 1135462552 /nfs/dbraw/zinc/46/25/52/1135462552.db2.gz HVBIZGQYWCQRBZ-UHFFFAOYSA-N 1 0 256.454 3.704 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(C(F)(F)F)cc1Cl ZINC001225919275 1135638683 /nfs/dbraw/zinc/63/86/83/1135638683.db2.gz ACUDIWXCNDRTDT-SECBINFHSA-N 1 0 296.740 3.832 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1c(Cl)c(F)cc(F)c1Cl ZINC001226000379 1135650304 /nfs/dbraw/zinc/65/03/04/1135650304.db2.gz QNKHUARFPPZUMZ-ZETCQYMHSA-N 1 0 299.168 3.745 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H](C)SC)c1cccc([N+](=O)[O-])c1 ZINC000090724894 260393312 /nfs/dbraw/zinc/39/33/12/260393312.db2.gz KDRPHJTZWMNUJI-FZMZJTMJSA-N 1 0 282.409 3.777 20 5 CHBDRO Cc1ccc(C(C)(C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cn1 ZINC000353582498 533633664 /nfs/dbraw/zinc/63/36/64/533633664.db2.gz RTIGYRYHHGGSBU-UHFFFAOYSA-N 1 0 299.374 3.632 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCC2(F)CCC2)c(Cl)c1 ZINC000342192164 130325077 /nfs/dbraw/zinc/32/50/77/130325077.db2.gz AIIHZGDPHZEVRZ-UHFFFAOYSA-N 1 0 286.734 3.620 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000020139630 171027124 /nfs/dbraw/zinc/02/71/24/171027124.db2.gz FJRGAQPTWKSMBJ-SNVBAGLBSA-N 1 0 262.334 3.507 20 5 CHBDRO C[C@@H]([NH2+]C1CCC(C)CC1)c1ccccc1[N+](=O)[O-] ZINC000020526021 171239145 /nfs/dbraw/zinc/23/91/45/171239145.db2.gz NIDAICIYQKWJOP-OTTFEQOBSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000020526192 171239479 /nfs/dbraw/zinc/23/94/79/171239479.db2.gz FGYWSWCBXUQDGC-WBMJQRKESA-N 1 0 282.343 3.933 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000035648596 172324582 /nfs/dbraw/zinc/32/45/82/172324582.db2.gz WLUMVWAACRDCQH-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO CCC[C@H]([NH2+]CC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000037179404 173012716 /nfs/dbraw/zinc/01/27/16/173012716.db2.gz XCVICSCOISHKKQ-HNNXBMFYSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000042857654 174892569 /nfs/dbraw/zinc/89/25/69/174892569.db2.gz JVHYJTFUOJQSRF-JSGCOSHPSA-N 1 0 262.353 3.511 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000037176992 260072726 /nfs/dbraw/zinc/07/27/26/260072726.db2.gz PCCCNXVZABDPGI-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)cs1 ZINC000353897344 226808483 /nfs/dbraw/zinc/80/84/83/226808483.db2.gz HXLTZPFZBDMKHE-OAHLLOKOSA-N 1 0 292.404 3.979 20 5 CHBDRO CSCCCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192881106 227330765 /nfs/dbraw/zinc/33/07/65/227330765.db2.gz MIDQGOUGPOHWDS-OAHLLOKOSA-N 1 0 294.420 3.705 20 5 CHBDRO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000353657914 228140751 /nfs/dbraw/zinc/14/07/51/228140751.db2.gz VFHYDXQYHKPLFT-ZDUSSCGKSA-N 1 0 282.343 3.542 20 5 CHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CC2CC2)c2ccccc2)c1 ZINC000180063514 260092539 /nfs/dbraw/zinc/09/25/39/260092539.db2.gz MMQVCWFXXCMYHU-QGZVFWFLSA-N 1 0 282.343 3.684 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000088747222 260234391 /nfs/dbraw/zinc/23/43/91/260234391.db2.gz UIDJKGNVZNTBMM-HIFRSBDPSA-N 1 0 260.337 3.744 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449183022 260283251 /nfs/dbraw/zinc/28/32/51/260283251.db2.gz CLFOXTYEZADGTC-QWHCGFSZSA-N 1 0 264.369 3.550 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000015301423 260362547 /nfs/dbraw/zinc/36/25/47/260362547.db2.gz WMUBNOHUPRYFKD-CQSZACIVSA-N 1 0 288.372 3.993 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC2(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000090772704 260404501 /nfs/dbraw/zinc/40/45/01/260404501.db2.gz HTJQAURZRTZFGR-LBPRGKRZSA-N 1 0 274.364 3.744 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000132469054 260499927 /nfs/dbraw/zinc/49/99/27/260499927.db2.gz HNCBMWXYZWEPOZ-JSGCOSHPSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccc(C[NH2+]CCCC(C)(C)C)cc1[N+](=O)[O-] ZINC000313255747 260513040 /nfs/dbraw/zinc/51/30/40/260513040.db2.gz RTZUJZPURXYBQG-UHFFFAOYSA-N 1 0 264.369 3.819 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1ccccc1 ZINC000449061835 261142327 /nfs/dbraw/zinc/14/23/27/261142327.db2.gz HRMRWIBQLSVJEQ-ZIAGYGMSSA-N 1 0 284.359 3.877 20 5 CHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccccc1 ZINC000301228834 261331636 /nfs/dbraw/zinc/33/16/36/261331636.db2.gz DIFMNFAWCKRBGC-AWEZNQCLSA-N 1 0 299.374 3.527 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000020526058 262245963 /nfs/dbraw/zinc/24/59/63/262245963.db2.gz CPWSVEAEZBBUFG-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO COCCC(C)(C)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000183930010 262253944 /nfs/dbraw/zinc/25/39/44/262253944.db2.gz KWHWLWQJVPPVII-ZDUSSCGKSA-N 1 0 294.395 3.617 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000186279729 262313375 /nfs/dbraw/zinc/31/33/75/262313375.db2.gz XXQRPZCEKZCFFX-NWDGAFQWSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000186742108 262322733 /nfs/dbraw/zinc/32/27/33/262322733.db2.gz FIMHQRCZQRHDGP-QWRGUYRKSA-N 1 0 291.376 3.506 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CS[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000488541598 262334046 /nfs/dbraw/zinc/33/40/46/262334046.db2.gz IHQTULRRNPVSSC-UKRRQHHQSA-N 1 0 294.420 3.523 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCCC1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000390918396 262363957 /nfs/dbraw/zinc/36/39/57/262363957.db2.gz VNHHESCJCPAVEP-PWSUYJOCSA-N 1 0 284.306 3.681 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1cccc([N+](=O)[O-])c1 ZINC000187848181 263271751 /nfs/dbraw/zinc/27/17/51/263271751.db2.gz AYOBKFLYDBEJBR-GJZGRUSLSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2CC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000425952739 264070818 /nfs/dbraw/zinc/07/08/18/264070818.db2.gz ILCRMJOSRARJPF-JTQLQIEISA-N 1 0 284.306 3.599 20 5 CHBDRO CCS[C@H]1CCCC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000189484180 264302710 /nfs/dbraw/zinc/30/27/10/264302710.db2.gz GFAXIZYSWAETHL-HIFRSBDPSA-N 1 0 294.420 3.749 20 5 CHBDRO CC(C)(C)CC[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000525866784 264655815 /nfs/dbraw/zinc/65/58/15/264655815.db2.gz GQCPHVFKWQGSJF-UHFFFAOYSA-N 1 0 264.369 3.856 20 5 CHBDRO CC1(C)CCC[C@@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000094324496 265236698 /nfs/dbraw/zinc/23/66/98/265236698.db2.gz UOWIRYDXHBBJSL-ZDUSSCGKSA-N 1 0 282.771 3.917 20 5 CHBDRO CC1(C)CCC[C@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000094324497 265237025 /nfs/dbraw/zinc/23/70/25/265237025.db2.gz UOWIRYDXHBBJSL-CYBMUJFWSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1F ZINC000094837895 265264029 /nfs/dbraw/zinc/26/40/29/265264029.db2.gz AILCPMRAZIKFHO-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC(C)OC1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000531164910 327744239 /nfs/dbraw/zinc/74/42/39/327744239.db2.gz ZDWNISFTXHVSEZ-ZDUSSCGKSA-N 1 0 292.379 3.545 20 5 CHBDRO COC[C@@H](CC(C)C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000540222020 327837486 /nfs/dbraw/zinc/83/74/86/327837486.db2.gz LUGLCZNKRKJSRY-DZGCQCFKSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000040444248 327907142 /nfs/dbraw/zinc/90/71/42/327907142.db2.gz VBMCZAVARWAMNR-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@H]1CCCCO1 ZINC000540952861 328013606 /nfs/dbraw/zinc/01/36/06/328013606.db2.gz ARBYCDKGEUUAAP-UKRRQHHQSA-N 1 0 292.379 3.513 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC(C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000531732272 328030561 /nfs/dbraw/zinc/03/05/61/328030561.db2.gz XZKAKWPOZVNQQU-GFCCVEGCSA-N 1 0 288.391 3.990 20 5 CHBDRO CCC1CCC([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000048327168 328051858 /nfs/dbraw/zinc/05/18/58/328051858.db2.gz HRAHXUHSARMWRR-UHFFFAOYSA-N 1 0 276.380 3.962 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccncc1 ZINC000563419481 328063626 /nfs/dbraw/zinc/06/36/26/328063626.db2.gz WRAZVCBAYIDEKZ-JKSUJKDBSA-N 1 0 297.358 3.718 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000531932460 328320872 /nfs/dbraw/zinc/32/08/72/328320872.db2.gz KBUHNRRWEFEZCM-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@H](Cc1ccsc1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000049155836 328350614 /nfs/dbraw/zinc/35/06/14/328350614.db2.gz GBVWLPGCZCIUCJ-VXGBXAGGSA-N 1 0 290.388 3.938 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000050015599 328381795 /nfs/dbraw/zinc/38/17/95/328381795.db2.gz DGPQRZLQGKGWTJ-LBPRGKRZSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000050443199 328439834 /nfs/dbraw/zinc/43/98/34/328439834.db2.gz KFVSEKAVZDWXKS-GWCFXTLKSA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000557462428 327006754 /nfs/dbraw/zinc/00/67/54/327006754.db2.gz AFUYPZCFELLJNN-RNVIBTMRSA-N 1 0 282.343 3.959 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000558259590 327083051 /nfs/dbraw/zinc/08/30/51/327083051.db2.gz UJZAHGLDUHYAFM-CABCVRRESA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089511928 327170719 /nfs/dbraw/zinc/17/07/19/327170719.db2.gz HGSGWBCLDCPKTA-YVEFUNNKSA-N 1 0 282.343 3.618 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000569533795 327194563 /nfs/dbraw/zinc/19/45/63/327194563.db2.gz OXWLETRKDPMYEP-NSHDSACASA-N 1 0 298.358 3.753 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000583432957 327361683 /nfs/dbraw/zinc/36/16/83/327361683.db2.gz IXBYXEJCCDWZRB-UGSOOPFHSA-N 1 0 296.370 3.975 20 5 CHBDRO C[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000507245247 332800263 /nfs/dbraw/zinc/80/02/63/332800263.db2.gz XKTUVWURLWBCGF-VIFPVBQESA-N 1 0 288.269 3.588 20 5 CHBDRO CCC(CC)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000151293326 327464724 /nfs/dbraw/zinc/46/47/24/327464724.db2.gz SNJDCYSDQQZCTK-NSHDSACASA-N 1 0 250.342 3.742 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000582187695 328620794 /nfs/dbraw/zinc/62/07/94/328620794.db2.gz KZHQOHVOFUCMKU-KBPBESRZSA-N 1 0 294.782 3.569 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C(C)(C)C2CC2)cc1[N+](=O)[O-] ZINC000536552677 328664879 /nfs/dbraw/zinc/66/48/79/328664879.db2.gz LQKZFLKVPPRQPR-UHFFFAOYSA-N 1 0 276.380 3.996 20 5 CHBDRO Cc1csc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000563898036 328699425 /nfs/dbraw/zinc/69/94/25/328699425.db2.gz BQEYFJACOBVPRB-CQSZACIVSA-N 1 0 288.372 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(C)(C)C ZINC000532461881 328780237 /nfs/dbraw/zinc/78/02/37/328780237.db2.gz JWHGTHADLKTLPT-NSHDSACASA-N 1 0 250.342 3.600 20 5 CHBDRO CSC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CCC1 ZINC000193811192 329063159 /nfs/dbraw/zinc/06/31/59/329063159.db2.gz OPIVOXNDKGZPBF-GFCCVEGCSA-N 1 0 294.420 3.840 20 5 CHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccn1 ZINC000179605920 329210353 /nfs/dbraw/zinc/21/03/53/329210353.db2.gz MVIIBZUMECXLQD-CLFYSBASSA-N 1 0 297.358 3.525 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCCC[C@H]1F ZINC000419821146 329745788 /nfs/dbraw/zinc/74/57/88/329745788.db2.gz PCPUUTDTNBNWKV-ORVLFJDJSA-N 1 0 292.354 3.868 20 5 CHBDRO CC[C@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000421874293 330100961 /nfs/dbraw/zinc/10/09/61/330100961.db2.gz ICYXIGZOBZLPFH-JQWIXIFHSA-N 1 0 250.342 3.600 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1C[C@H](C)O[C@@H](C)C1 ZINC000536831537 330229228 /nfs/dbraw/zinc/22/92/28/330229228.db2.gz GBEMVDYMRZPOKD-AVGNSLFASA-N 1 0 292.379 3.510 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H](C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000396956585 330232056 /nfs/dbraw/zinc/23/20/56/330232056.db2.gz VMKHTFUMDDUAKI-SECBINFHSA-N 1 0 290.285 3.581 20 5 CHBDRO CC(C)[C@H](C)[N@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000079601930 330249108 /nfs/dbraw/zinc/24/91/08/330249108.db2.gz PIMGUSJGOZPDRN-JTQLQIEISA-N 1 0 268.382 3.665 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CC1(C)C ZINC000536865081 330253471 /nfs/dbraw/zinc/25/34/71/330253471.db2.gz UGIVAWVADJAJOT-NWDGAFQWSA-N 1 0 262.353 3.600 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4C[C@H]4C3)o2)cc1 ZINC000424201175 330326766 /nfs/dbraw/zinc/32/67/66/330326766.db2.gz HOLZEDLGFUCSEG-BTTYYORXSA-N 1 0 298.342 3.743 20 5 CHBDRO CC1(C)CCC([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000079676368 330334323 /nfs/dbraw/zinc/33/43/23/330334323.db2.gz GTGILRLLFMVGOJ-UHFFFAOYSA-N 1 0 268.382 3.715 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000424291384 330334723 /nfs/dbraw/zinc/33/47/23/330334723.db2.gz LSYWLEYKAVTEDM-WPGHFRTFSA-N 1 0 274.364 3.682 20 5 CHBDRO CC(C)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000445436427 330342694 /nfs/dbraw/zinc/34/26/94/330342694.db2.gz RBVJCHYPCCCBOQ-CHWSQXEVSA-N 1 0 262.353 3.634 20 5 CHBDRO Cc1ccc(C[NH+]2CCc3ccccc3CC2)cc1[N+](=O)[O-] ZINC000537631665 330448600 /nfs/dbraw/zinc/44/86/00/330448600.db2.gz QUBCVRPGENBWCP-UHFFFAOYSA-N 1 0 296.370 3.504 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000159945487 330854771 /nfs/dbraw/zinc/85/47/71/330854771.db2.gz QAMOILVOCULAON-ZFWWWQNUSA-N 1 0 292.379 3.593 20 5 CHBDRO CCC(C)(C)C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449285161 330911886 /nfs/dbraw/zinc/91/18/86/330911886.db2.gz QFHKRJYVOCSKGQ-LBPRGKRZSA-N 1 0 264.369 3.552 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C12CCC(CC1)CC2 ZINC000449530368 330934216 /nfs/dbraw/zinc/93/42/16/330934216.db2.gz AQQLHGHIVMHKEF-HWKANZROSA-N 1 0 286.375 3.920 20 5 CHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CCCCF)C2)cc1 ZINC000451543727 331033540 /nfs/dbraw/zinc/03/35/40/331033540.db2.gz CIUABEJMJCVGOR-CQSZACIVSA-N 1 0 280.343 3.524 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000453176757 331097379 /nfs/dbraw/zinc/09/73/79/331097379.db2.gz MYPWPUHZZSSOMX-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO CCC1([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000453288820 331111521 /nfs/dbraw/zinc/11/15/21/331111521.db2.gz LTUZEUCJBMHTSW-AWEZNQCLSA-N 1 0 260.337 3.504 20 5 CHBDRO C[C@@H]([NH2+]CCC1CC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453427476 331131155 /nfs/dbraw/zinc/13/11/55/331131155.db2.gz PJPNFYMUYYKTCW-SNVBAGLBSA-N 1 0 284.306 3.681 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CCC1CC(F)(F)C1 ZINC000453593814 331135355 /nfs/dbraw/zinc/13/53/55/331135355.db2.gz VMHKZYCJZGGURD-HYXAFXHYSA-N 1 0 296.317 3.633 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000195651202 331179481 /nfs/dbraw/zinc/17/94/81/331179481.db2.gz DFHPFJAFGUOIAS-QAPCUYQASA-N 1 0 296.370 3.975 20 5 CHBDRO C[C@@H]([NH2+]C1CC2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000459383861 331279395 /nfs/dbraw/zinc/27/93/95/331279395.db2.gz GBTUREIHLNYRAZ-LLVKDONJSA-N 1 0 260.337 3.578 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459774309 331300083 /nfs/dbraw/zinc/30/00/83/331300083.db2.gz ITHTUQQTBUHYGD-NRUUGDAUSA-N 1 0 280.755 3.526 20 5 CHBDRO Cc1cc(NC2CC=CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000167389297 331308191 /nfs/dbraw/zinc/30/81/91/331308191.db2.gz MUQRXCXJIJEAAK-UHFFFAOYSA-N 1 0 269.304 3.582 20 5 CHBDRO C=Cc1ccc(CC[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000462905439 331334543 /nfs/dbraw/zinc/33/45/43/331334543.db2.gz JMAWBPQXRFNCSA-UHFFFAOYSA-N 1 0 282.343 3.570 20 5 CHBDRO C=Cc1ccc(CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000462905995 331334690 /nfs/dbraw/zinc/33/46/90/331334690.db2.gz MJMPMNSEMWMHEL-UHFFFAOYSA-N 1 0 296.370 3.879 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000510688132 332911707 /nfs/dbraw/zinc/91/17/07/332911707.db2.gz QNLBESCUZXVSKF-IUIKQTSFSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1cc(NCCC[NH+](C(C)C)C(C)C)ccc1[N+](=O)[O-] ZINC000470866931 331493007 /nfs/dbraw/zinc/49/30/07/331493007.db2.gz ZATKBWIDFDFJTB-UHFFFAOYSA-N 1 0 293.411 3.824 20 5 CHBDRO CC1(C)CCC[C@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510764969 332916204 /nfs/dbraw/zinc/91/62/04/332916204.db2.gz NQXMWQIERJFKNS-CYBMUJFWSA-N 1 0 284.306 3.541 20 5 CHBDRO CCc1cccc(F)c1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000474868474 331601978 /nfs/dbraw/zinc/60/19/78/331601978.db2.gz LRIAZTCEOPDMQI-UHFFFAOYSA-N 1 0 288.322 3.586 20 5 CHBDRO CCC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccccn1 ZINC000477736155 331689491 /nfs/dbraw/zinc/68/94/91/331689491.db2.gz GSNVVTBNAKJSHO-HNNXBMFYSA-N 1 0 299.374 3.929 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2c3ccccc3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000478499224 331707431 /nfs/dbraw/zinc/70/74/31/331707431.db2.gz DMQHIDBADAGMJP-SGTLLEGYSA-N 1 0 296.370 3.926 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@@H]1C ZINC000481179389 331799993 /nfs/dbraw/zinc/79/99/93/331799993.db2.gz IJMLABOWZFFIPG-JTNHKYCSSA-N 1 0 280.343 3.648 20 5 CHBDRO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000482516682 331836537 /nfs/dbraw/zinc/83/65/37/331836537.db2.gz CDFSRLZLYZUENF-FZKQIMNGSA-N 1 0 296.370 3.660 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C(F)F)CC1 ZINC000483513124 331877589 /nfs/dbraw/zinc/87/75/89/331877589.db2.gz BIXZVWWSOMUJNP-SNVBAGLBSA-N 1 0 284.306 3.633 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C/C=C/c2ccncc2)cc1[N+](=O)[O-] ZINC000487279390 331962564 /nfs/dbraw/zinc/96/25/64/331962564.db2.gz VSVUIMQWWFOJTM-XGACYXMMSA-N 1 0 297.358 3.662 20 5 CHBDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CS1 ZINC000488425021 332006652 /nfs/dbraw/zinc/00/66/52/332006652.db2.gz YZOMJIVVYXIWPB-LNSITVRQSA-N 1 0 294.420 3.776 20 5 CHBDRO Cc1ccccc1C[C@H](C)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000489073900 332040446 /nfs/dbraw/zinc/04/04/46/332040446.db2.gz LRLYYCIBOBXYSC-HNNXBMFYSA-N 1 0 298.386 3.966 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(C(F)F)CC1 ZINC000489965135 332075017 /nfs/dbraw/zinc/07/50/17/332075017.db2.gz LCNJWXUWOGZMCW-LLVKDONJSA-N 1 0 298.333 3.941 20 5 CHBDRO CC[C@H]1CC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490010394 332076566 /nfs/dbraw/zinc/07/65/66/332076566.db2.gz BCSNTBOEMISIJV-OLZOCXBDSA-N 1 0 262.353 3.696 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490056126 332079070 /nfs/dbraw/zinc/07/90/70/332079070.db2.gz DVDHVURQDAGVGC-CQSZACIVSA-N 1 0 292.379 3.758 20 5 CHBDRO CC[C@H]1C[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCS1 ZINC000490088538 332080868 /nfs/dbraw/zinc/08/08/68/332080868.db2.gz OWZRDLMMELKVNA-JSGCOSHPSA-N 1 0 294.420 3.792 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000490084240 332080906 /nfs/dbraw/zinc/08/09/06/332080906.db2.gz IKPNQZUUPIJFJP-DFBGVHRSSA-N 1 0 274.364 3.552 20 5 CHBDRO CCOc1cc(C[NH2+][C@H](C)[C@H](C)CC)ccc1[N+](=O)[O-] ZINC000491599341 332242305 /nfs/dbraw/zinc/24/23/05/332242305.db2.gz QJBNMHFZGVVYFM-VXGBXAGGSA-N 1 0 280.368 3.518 20 5 CHBDRO CCOc1cc(C[NH2+][C@@H](C)[C@H](C)CC)ccc1[N+](=O)[O-] ZINC000491599338 332242312 /nfs/dbraw/zinc/24/23/12/332242312.db2.gz QJBNMHFZGVVYFM-NEPJUHHUSA-N 1 0 280.368 3.518 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000502056164 332646864 /nfs/dbraw/zinc/64/68/64/332646864.db2.gz HNADYMCMUAZMOH-GDBMZVCRSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[NH+](CC)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000505295788 332736203 /nfs/dbraw/zinc/73/62/03/332736203.db2.gz MPHCMRXYNUYONC-UHFFFAOYSA-N 1 0 274.320 3.697 20 5 CHBDRO C[C@H]1CC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000513070001 333002774 /nfs/dbraw/zinc/00/27/74/333002774.db2.gz QMIVFCBBIFDHAH-NHYWBVRUSA-N 1 0 286.331 3.743 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000513106065 333004706 /nfs/dbraw/zinc/00/47/06/333004706.db2.gz GMPFRUQFOPVTTP-ABAIWWIYSA-N 1 0 286.331 3.743 20 5 CHBDRO CC(C)[C@H]1CC[C@@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000513655107 333029658 /nfs/dbraw/zinc/02/96/58/333029658.db2.gz LBEUXFCVPXOIAB-GLQYFDAESA-N 1 0 262.353 3.680 20 5 CHBDRO CCC(CC)[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000517124054 333092978 /nfs/dbraw/zinc/09/29/78/333092978.db2.gz KUBRWUSJMUAQOO-UHFFFAOYSA-N 1 0 292.379 3.627 20 5 CHBDRO CCOC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C(C)C ZINC000189360323 333190864 /nfs/dbraw/zinc/19/08/64/333190864.db2.gz DMDGBNPBCQNELJ-DZGCQCFKSA-N 1 0 294.395 3.615 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000224486665 333221421 /nfs/dbraw/zinc/22/14/21/333221421.db2.gz VOSSMUFFFZYVSO-KYOSRNDESA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522466262 333287378 /nfs/dbraw/zinc/28/73/78/333287378.db2.gz IGCYBEARAOFYAP-YOEHRIQHSA-N 1 0 296.370 3.973 20 5 CHBDRO CCC1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CCCC1 ZINC000230200142 333315672 /nfs/dbraw/zinc/31/56/72/333315672.db2.gz NUSLMIYCGWCJCW-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000230409362 333318141 /nfs/dbraw/zinc/31/81/41/333318141.db2.gz YYWXVBBEJXWATM-JHJVBQTASA-N 1 0 262.353 3.682 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000230661986 333320167 /nfs/dbraw/zinc/32/01/67/333320167.db2.gz DPRWHOJWFAZFDI-SGMGOOAPSA-N 1 0 262.353 3.682 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000231884367 333331077 /nfs/dbraw/zinc/33/10/77/333331077.db2.gz KCTGGQJFIOUQAA-OCCSQVGLSA-N 1 0 262.353 3.572 20 5 CHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000523702136 333340214 /nfs/dbraw/zinc/34/02/14/333340214.db2.gz UZKAOHZPXLBTOK-SFHVURJKSA-N 1 0 296.370 3.757 20 5 CHBDRO C[C@@H](CCC(C)(C)C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000237496126 333379635 /nfs/dbraw/zinc/37/96/35/333379635.db2.gz JSNKZCGQIZTSCM-LBPRGKRZSA-N 1 0 264.369 3.899 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000538194744 333578544 /nfs/dbraw/zinc/57/85/44/333578544.db2.gz PJEHUAZZTIVTPZ-NEPJUHHUSA-N 1 0 282.409 3.695 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCCOC(C)C ZINC000543088366 333856403 /nfs/dbraw/zinc/85/64/03/333856403.db2.gz AWRJVKLZQOAFLJ-AWEZNQCLSA-N 1 0 294.395 3.759 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]([C@H](C)C1CC1)C1CC1 ZINC000546705345 334047244 /nfs/dbraw/zinc/04/72/44/334047244.db2.gz QRMAFDOMHDMKRC-GFCCVEGCSA-N 1 0 274.364 3.666 20 5 CHBDRO CCCC[C@H](COC)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000134055830 334078820 /nfs/dbraw/zinc/07/88/20/334078820.db2.gz SXVLACKOOMIONY-ZIAGYGMSSA-N 1 0 294.395 3.759 20 5 CHBDRO CCCC[C@@H](COC)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000134055219 334079011 /nfs/dbraw/zinc/07/90/11/334079011.db2.gz SXVLACKOOMIONY-KBPBESRZSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000078465701 334134363 /nfs/dbraw/zinc/13/43/63/334134363.db2.gz WBOCSCKHXMQRPQ-XJKCOSOUSA-N 1 0 276.380 3.552 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCF)s1 ZINC000136502301 334156372 /nfs/dbraw/zinc/15/63/72/334156372.db2.gz AGFZMBDCGRGOPI-UHFFFAOYSA-N 1 0 294.351 3.773 20 5 CHBDRO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000081598489 334198838 /nfs/dbraw/zinc/19/88/38/334198838.db2.gz SZAXPCWZHBHQGB-LBPRGKRZSA-N 1 0 290.388 3.719 20 5 CHBDRO CC[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000245568482 334204568 /nfs/dbraw/zinc/20/45/68/334204568.db2.gz YEPJEISSPPCHLD-YDHLFZDLSA-N 1 0 276.380 3.694 20 5 CHBDRO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCC[C@H]21 ZINC000550444429 334222744 /nfs/dbraw/zinc/22/27/44/334222744.db2.gz VKFSCVIINCJXFI-CABCVRRESA-N 1 0 274.364 3.605 20 5 CHBDRO C[C@H](F)CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000550883573 334231666 /nfs/dbraw/zinc/23/16/66/334231666.db2.gz XEQLIRVKSLWDTI-YDHLFZDLSA-N 1 0 294.370 3.644 20 5 CHBDRO CC[C@H]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000552292912 334314243 /nfs/dbraw/zinc/31/42/43/334314243.db2.gz JOPAXVPNTLJBDZ-MQMHXKEQSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@H]([NH2+]CC1Cc2ccccc2C1)c1ccccc1[N+](=O)[O-] ZINC000552899286 334350140 /nfs/dbraw/zinc/35/01/40/334350140.db2.gz NZPVAOBSTZCWPI-ZDUSSCGKSA-N 1 0 296.370 3.660 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000252108329 334373729 /nfs/dbraw/zinc/37/37/29/334373729.db2.gz JFMFKNQCOWCUGN-NHAGDIPZSA-N 1 0 276.380 3.552 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H]1C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000252715876 334386130 /nfs/dbraw/zinc/38/61/30/334386130.db2.gz WYLOAOIMPLLMTD-KYOSRNDESA-N 1 0 262.353 3.682 20 5 CHBDRO C[C@H]([NH2+]C1CC(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000554404268 334428942 /nfs/dbraw/zinc/42/89/42/334428942.db2.gz TUXWDWVCVOWGRZ-PUSIOWJLSA-N 1 0 288.269 3.586 20 5 CHBDRO COC1(CC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CCC1 ZINC000556225150 334501196 /nfs/dbraw/zinc/50/11/96/334501196.db2.gz ZSJVHYCRYXMVHP-CYBMUJFWSA-N 1 0 292.379 3.513 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[C@@H]1C(C)(C)C ZINC000565060752 334537086 /nfs/dbraw/zinc/53/70/86/334537086.db2.gz MAKADKVYVZSSLO-UONOGXRCSA-N 1 0 292.379 3.518 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000577191364 335320179 /nfs/dbraw/zinc/32/01/79/335320179.db2.gz ISVIIDYGCMTVQL-MLGOLLRUSA-N 1 0 282.343 3.933 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCOC2CCCC2)cccc1[N+](=O)[O-] ZINC000178071580 335411499 /nfs/dbraw/zinc/41/14/99/335411499.db2.gz ASMSBOXRIKGOKF-CYBMUJFWSA-N 1 0 292.379 3.513 20 5 CHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000195670011 336058093 /nfs/dbraw/zinc/05/80/93/336058093.db2.gz OKKHOSUIYOCYDE-XJKSGUPXSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000381386865 336061043 /nfs/dbraw/zinc/06/10/43/336061043.db2.gz LVAUVDLMQIQQPN-NHYWBVRUSA-N 1 0 280.343 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCCC2(F)F)cc1 ZINC000381765951 336072614 /nfs/dbraw/zinc/07/26/14/336072614.db2.gz XSNIQYYQODBYLC-LBPRGKRZSA-N 1 0 284.306 3.510 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000387153593 336186597 /nfs/dbraw/zinc/18/65/97/336186597.db2.gz PTZIRENFOVPIJU-LSDHHAIUSA-N 1 0 274.364 3.968 20 5 CHBDRO COc1cc(C[N@H+](C)C2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000351972028 533781347 /nfs/dbraw/zinc/78/13/47/533781347.db2.gz ZEVQXEYWNFKXCO-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]C2CC(F)(F)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279173497 520522071 /nfs/dbraw/zinc/52/20/71/520522071.db2.gz UYFVQOZBBOYQOW-CYBMUJFWSA-N 1 0 296.317 3.705 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000149611133 521158152 /nfs/dbraw/zinc/15/81/52/521158152.db2.gz XBCDNIOYTQGDGW-GJZGRUSLSA-N 1 0 294.420 3.921 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](C)CC(C)(C)O)c1cccc([N+](=O)[O-])c1 ZINC000296325552 521167672 /nfs/dbraw/zinc/16/76/72/521167672.db2.gz GZNGHEDQVRBNCA-WFASDCNBSA-N 1 0 294.395 3.575 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000037668298 522654000 /nfs/dbraw/zinc/65/40/00/522654000.db2.gz WUDNVGOJONRIHZ-INIZCTEOSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000337303983 522692477 /nfs/dbraw/zinc/69/24/77/522692477.db2.gz RBUXHTYKFMRYNF-GUYCJALGSA-N 1 0 299.374 3.662 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)[C@H]1CCCO1 ZINC000246376167 522738803 /nfs/dbraw/zinc/73/88/03/522738803.db2.gz JRXXUNLBKFLGOD-IVMMDQJWSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)[C@@H]1CCCO1 ZINC000246550129 522741835 /nfs/dbraw/zinc/74/18/35/522741835.db2.gz WMBLVIVYXIQSGB-INWMFGNUSA-N 1 0 292.379 3.511 20 5 CHBDRO COCC(C)(C)CCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000286936306 522805105 /nfs/dbraw/zinc/80/51/05/522805105.db2.gz GPYBCQOBURGXDQ-ZDUSSCGKSA-N 1 0 294.395 3.698 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000053036063 522874636 /nfs/dbraw/zinc/87/46/36/522874636.db2.gz PEZJZVXUGGAJFD-OAHLLOKOSA-N 1 0 274.320 3.737 20 5 CHBDRO CO[C@@]1(C)CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000280647268 523809918 /nfs/dbraw/zinc/80/99/18/523809918.db2.gz YUNRUGJUBYLTHQ-BBRMVZONSA-N 1 0 292.379 3.547 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000157952470 525413274 /nfs/dbraw/zinc/41/32/74/525413274.db2.gz IRVQWNZZCGLHFL-SMDDNHRTSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccncc1CCC[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000290371750 525733173 /nfs/dbraw/zinc/73/31/73/525733173.db2.gz NKZWWBOSNUYRCR-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289687898 526084214 /nfs/dbraw/zinc/08/42/14/526084214.db2.gz GUMNJFRGMQRDEA-WDEREUQCSA-N 1 0 284.306 3.633 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCc3sccc32)cc1 ZINC000061328145 527350280 /nfs/dbraw/zinc/35/02/80/527350280.db2.gz YMIQNODRUQVPLQ-CQSZACIVSA-N 1 0 288.372 3.824 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC2CCC(F)(F)CC2)c1 ZINC000337275329 527385817 /nfs/dbraw/zinc/38/58/17/527385817.db2.gz DQHSSMSVEIHREB-UHFFFAOYSA-N 1 0 284.306 3.510 20 5 CHBDRO CCC(CC)[C@@H](CC[NH2+]Cc1ccccc1[N+](=O)[O-])OC ZINC000344834817 528818156 /nfs/dbraw/zinc/81/81/56/528818156.db2.gz ZXHUMYJIHDTWLR-MRXNPFEDSA-N 1 0 294.395 3.526 20 5 CHBDRO CCS[C@H]1CCCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000353584528 529225486 /nfs/dbraw/zinc/22/54/86/529225486.db2.gz HTZWLYKVTRUXNW-AWEZNQCLSA-N 1 0 294.420 3.702 20 5 CHBDRO CC(C)[N@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000077269756 1119191470 /nfs/dbraw/zinc/19/14/70/1119191470.db2.gz OATJHORNAPKUCN-UHFFFAOYSA-N 1 0 290.285 3.758 20 5 CHBDRO C[C@H]1CCCC[C@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000093632513 1120835505 /nfs/dbraw/zinc/83/55/05/1120835505.db2.gz NRFPWJMEIYVXGP-GXFFZTMASA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@@H]([NH2+]CCCCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000127224544 1124011936 /nfs/dbraw/zinc/01/19/36/1124011936.db2.gz WQDHYCHQOAXURK-SNVBAGLBSA-N 1 0 290.285 3.978 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@@H](C)F ZINC000872074039 1124675774 /nfs/dbraw/zinc/67/57/74/1124675774.db2.gz VAJKNNFYKAUTRW-ZJUUUORDSA-N 1 0 286.372 3.715 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)C(C)C ZINC000532235483 1125243032 /nfs/dbraw/zinc/24/30/32/1125243032.db2.gz OGHOJATUOQJZNC-OLZOCXBDSA-N 1 0 264.369 3.846 20 5 CHBDRO C[C@H]([NH2+]C1CCCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000037177035 1132007271 /nfs/dbraw/zinc/00/72/71/1132007271.db2.gz NJLRERWYKFSFOM-LBPRGKRZSA-N 1 0 262.353 3.968 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1nc(Cl)c(Cl)cc1Cl ZINC001226888758 1135755941 /nfs/dbraw/zinc/75/59/41/1135755941.db2.gz JBXYDTXPMIZIBJ-SSDOTTSWSA-N 1 0 298.621 3.515 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000251862654 1125517428 /nfs/dbraw/zinc/51/74/28/1125517428.db2.gz PYUBXOYTGMPMES-NFAWXSAZSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1cccnc1[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000118839778 1125526378 /nfs/dbraw/zinc/52/63/78/1125526378.db2.gz UNFOTSLKEODLHJ-MRXNPFEDSA-N 1 0 299.374 3.785 20 5 CHBDRO CC[C@@H]([NH2+]CCC1(F)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000348336244 1125592779 /nfs/dbraw/zinc/59/27/79/1125592779.db2.gz SFSMYICEJDVAIE-CQSZACIVSA-N 1 0 280.343 3.918 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000130287143 1125619984 /nfs/dbraw/zinc/61/99/84/1125619984.db2.gz YQWKOUAKWNWZMA-MRXNPFEDSA-N 1 0 286.331 3.541 20 5 CHBDRO CC(C)[N@H+](Cc1cccnc1[N+](=O)[O-])C1CCCCC1 ZINC000886060131 1125643364 /nfs/dbraw/zinc/64/33/64/1125643364.db2.gz VKWGCAYHSHPRFV-UHFFFAOYSA-N 1 0 277.368 3.533 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000336807760 1125750927 /nfs/dbraw/zinc/75/09/27/1125750927.db2.gz ABVUWFXYVBFTEE-CQDKDKBSSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)SCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000338285491 1126731569 /nfs/dbraw/zinc/73/15/69/1126731569.db2.gz MXAKCXQYAJRTTM-UHFFFAOYSA-N 1 0 294.420 3.701 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCc2ccccn2)cc1[N+](=O)[O-] ZINC000181486525 1126856698 /nfs/dbraw/zinc/85/66/98/1126856698.db2.gz YXDSFZIZROSXOL-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO CC(C)CCC[C@@H](C)CCO[C@@H](C)C[N+](C)(C)C ZINC001224771808 1126984300 /nfs/dbraw/zinc/98/43/00/1126984300.db2.gz SABMXUYFAZFFEB-CVEARBPZSA-N 1 0 258.470 3.950 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000271438997 1127082059 /nfs/dbraw/zinc/08/20/59/1127082059.db2.gz DAYIAHHGKDPASV-CYBMUJFWSA-N 1 0 299.374 3.512 20 5 CHBDRO CC(C)=CCC[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000571796759 1127178116 /nfs/dbraw/zinc/17/81/16/1127178116.db2.gz ARSMDCKFTVKUMD-ZDUSSCGKSA-N 1 0 262.353 3.819 20 5 CHBDRO C[C@H](CF)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000588930513 1127207855 /nfs/dbraw/zinc/20/78/55/1127207855.db2.gz KABMGVKYNGPERF-SNVBAGLBSA-N 1 0 294.351 3.771 20 5 CHBDRO CC1(F)CC([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000590778814 1127271998 /nfs/dbraw/zinc/27/19/98/1127271998.db2.gz VTNKPTGKSBNKJQ-BHKPVTDMSA-N 1 0 292.354 3.797 20 5 CHBDRO CS[C@@H]1CCCC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000355216295 1127326297 /nfs/dbraw/zinc/32/62/97/1127326297.db2.gz UWYPFPZFZWALLC-CQSZACIVSA-N 1 0 294.420 3.621 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@H](F)C2)cccc1[N+](=O)[O-] ZINC000592390728 1127346885 /nfs/dbraw/zinc/34/68/85/1127346885.db2.gz PERSCYBKBXCBTL-RWMBFGLXSA-N 1 0 280.343 3.835 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H](C)CC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000592392231 1127344365 /nfs/dbraw/zinc/34/43/65/1127344365.db2.gz JCDCTBDUEVWOGP-GXFFZTMASA-N 1 0 286.322 3.927 20 5 CHBDRO CC1(C)CCC([NH2+]CCc2cccc([N+](=O)[O-])c2)CC1 ZINC001308356367 1127369274 /nfs/dbraw/zinc/36/92/74/1127369274.db2.gz BRCDOCGVXYBCDQ-UHFFFAOYSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)[C@@H](C)C1(C)CC1 ZINC001308580910 1127392608 /nfs/dbraw/zinc/39/26/08/1127392608.db2.gz YXSLKASMTBSAIK-ZDUSSCGKSA-N 1 0 276.380 3.832 20 5 CHBDRO Cc1c(C[NH2+][C@H](c2cccnc2)C(C)C)cccc1[N+](=O)[O-] ZINC000358343861 1127416033 /nfs/dbraw/zinc/41/60/33/1127416033.db2.gz YULGZFLXBYUHMI-KRWDZBQOSA-N 1 0 299.374 3.785 20 5 CHBDRO CSCC1(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000594714368 1127428992 /nfs/dbraw/zinc/42/89/92/1127428992.db2.gz YEYLYTMHYOYELZ-LBPRGKRZSA-N 1 0 294.420 3.779 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000226761106 1127424882 /nfs/dbraw/zinc/42/48/82/1127424882.db2.gz QNDNBXCGNJERNT-VHRBIJSZSA-N 1 0 280.393 3.530 20 5 CHBDRO C[C@H]([NH2+]CC[C@]1(C)CC1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000594725393 1127429948 /nfs/dbraw/zinc/42/99/48/1127429948.db2.gz KCAAHBLWZMLFOW-GXFFZTMASA-N 1 0 284.306 3.681 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@]23C[C@@H]2CCC3)o1 ZINC000594952654 1127440084 /nfs/dbraw/zinc/44/00/84/1127440084.db2.gz QNNQXZHOGWUVOZ-SJCJKPOMSA-N 1 0 298.342 3.887 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCSCC1)c1ccccc1[N+](=O)[O-] ZINC000595024828 1127443143 /nfs/dbraw/zinc/44/31/43/1127443143.db2.gz CCXAXFIHXLQUBV-VXGBXAGGSA-N 1 0 280.393 3.531 20 5 CHBDRO CC(C)[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000594994977 1127444624 /nfs/dbraw/zinc/44/46/24/1127444624.db2.gz YLYXBMPMQCZTEJ-GMNBZTITSA-N 1 0 274.364 3.632 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1CC=CCC1 ZINC000595005228 1127444941 /nfs/dbraw/zinc/44/49/41/1127444941.db2.gz FJNPBDMDEPQHDT-OLZOCXBDSA-N 1 0 290.363 3.610 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccs1 ZINC000595004268 1127445099 /nfs/dbraw/zinc/44/50/99/1127445099.db2.gz OBCSDGRMUXLLRI-JTQLQIEISA-N 1 0 292.360 3.516 20 5 CHBDRO C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000595070435 1127447965 /nfs/dbraw/zinc/44/79/65/1127447965.db2.gz WASYTKGOHSOSGO-GDZNZVCISA-N 1 0 296.370 3.974 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCSCC2)cc1[N+](=O)[O-] ZINC000595027538 1127448722 /nfs/dbraw/zinc/44/87/22/1127448722.db2.gz PNISPOWXJUGBBX-OCCSQVGLSA-N 1 0 294.420 3.840 20 5 CHBDRO CCSC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000595101506 1127452416 /nfs/dbraw/zinc/45/24/16/1127452416.db2.gz VSYUKIJKHPATCJ-NSHDSACASA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@]1(C)CC1(F)F ZINC000595081291 1127453438 /nfs/dbraw/zinc/45/34/38/1127453438.db2.gz QYOIWGQQQMFTBH-MFKMUULPSA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@]2(C)CC2(F)F)cccc1[N+](=O)[O-] ZINC000595080034 1127453515 /nfs/dbraw/zinc/45/35/15/1127453515.db2.gz NLMMJTWTNLOLFY-GXFFZTMASA-N 1 0 284.306 3.599 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@]1(C)CC1(F)F ZINC000595082707 1127453581 /nfs/dbraw/zinc/45/35/81/1127453581.db2.gz VMABZTXRWYPNMS-RISCZKNCSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC[C@]2(C)CC2(F)F)cccc1[N+](=O)[O-] ZINC000595082275 1127453671 /nfs/dbraw/zinc/45/36/71/1127453671.db2.gz XNDWHBWBQWOTQP-BXUZGUMPSA-N 1 0 298.333 3.989 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595090737 1127454193 /nfs/dbraw/zinc/45/41/93/1127454193.db2.gz FNVJUUKBNFXVNF-SKDRFNHKSA-N 1 0 284.306 3.537 20 5 CHBDRO CCC(CC)[N@@H+](Cc1onc(C)c1[N+](=O)[O-])CC(C)C ZINC000595348355 1127458621 /nfs/dbraw/zinc/45/86/21/1127458621.db2.gz RNPXZMIAVXXTME-UHFFFAOYSA-N 1 0 283.372 3.538 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC2CC=CC2)cc1[N+](=O)[O-] ZINC000595418121 1127462446 /nfs/dbraw/zinc/46/24/46/1127462446.db2.gz CHSZKPWKCDIIOF-GFCCVEGCSA-N 1 0 260.337 3.520 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119390 1127474927 /nfs/dbraw/zinc/47/49/27/1127474927.db2.gz XESNILICCWUTCK-RISCZKNCSA-N 1 0 296.317 3.695 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CCF)C1 ZINC000595754385 1127474943 /nfs/dbraw/zinc/47/49/43/1127474943.db2.gz APBKLWMIZUGQNI-OLZOCXBDSA-N 1 0 280.343 3.727 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](CCF)C1 ZINC000595754384 1127475069 /nfs/dbraw/zinc/47/50/69/1127475069.db2.gz APBKLWMIZUGQNI-CHWSQXEVSA-N 1 0 280.343 3.727 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595858278 1127478473 /nfs/dbraw/zinc/47/84/73/1127478473.db2.gz VLHPEJIMYNFGPL-PBNFFQIGSA-N 1 0 274.364 3.919 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000293579557 1127507162 /nfs/dbraw/zinc/50/71/62/1127507162.db2.gz DVCFOTSYLWRQNX-CHWSQXEVSA-N 1 0 299.374 3.897 20 5 CHBDRO Cc1ccncc1C[N@@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000361434021 1127562919 /nfs/dbraw/zinc/56/29/19/1127562919.db2.gz KKHJNCFRIKMZFT-AWEZNQCLSA-N 1 0 299.374 3.800 20 5 CHBDRO C[N@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCC1 ZINC000602471351 1127583284 /nfs/dbraw/zinc/58/32/84/1127583284.db2.gz CMAHOFJXHFJZIG-UHFFFAOYSA-N 1 0 288.269 3.598 20 5 CHBDRO CC(C)(C)C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000060877165 1127614702 /nfs/dbraw/zinc/61/47/02/1127614702.db2.gz URSSTKRMNXBNHR-HNNXBMFYSA-N 1 0 276.380 3.995 20 5 CHBDRO CC1(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C[C@H]2C[C@H]2C1 ZINC000599004789 1127649915 /nfs/dbraw/zinc/64/99/15/1127649915.db2.gz GEINPVYXCJNPDO-IJIWFQOLSA-N 1 0 286.375 3.634 20 5 CHBDRO Cc1cc(NCC2([NH+](C)C)CCCCC2)ccc1[N+](=O)[O-] ZINC000603837669 1127675379 /nfs/dbraw/zinc/67/53/79/1127675379.db2.gz ZWVKBCVUVXYLDB-UHFFFAOYSA-N 1 0 291.395 3.580 20 5 CHBDRO CC(F)(F)CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000296639296 1127680259 /nfs/dbraw/zinc/68/02/59/1127680259.db2.gz BYEFJZGWCLOZKI-AWEZNQCLSA-N 1 0 298.333 3.997 20 5 CHBDRO CSCCCCCC[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000230149866 1127743978 /nfs/dbraw/zinc/74/39/78/1127743978.db2.gz ZGPVWXSXAIZVCC-UHFFFAOYSA-N 1 0 296.436 3.916 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CC(C2CC2)C2CC2)c1 ZINC000088455644 1127938156 /nfs/dbraw/zinc/93/81/56/1127938156.db2.gz MCEXGNZRQHRBNG-UHFFFAOYSA-N 1 0 294.782 3.774 20 5 CHBDRO CC(C)C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000543858498 1127950505 /nfs/dbraw/zinc/95/05/05/1127950505.db2.gz SXYNZADAUDLYNT-UHFFFAOYSA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000462733804 1127951898 /nfs/dbraw/zinc/95/18/98/1127951898.db2.gz KNHQZUXBHDVKDC-BZUAXINKSA-N 1 0 288.391 3.962 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595091426 1127952101 /nfs/dbraw/zinc/95/21/01/1127952101.db2.gz IFPYBIWUGIWGBI-CHWSQXEVSA-N 1 0 298.333 3.927 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)CC1 ZINC000468148318 1127994910 /nfs/dbraw/zinc/99/49/10/1127994910.db2.gz VJCCREBXFCUBJF-QWHCGFSZSA-N 1 0 262.353 3.778 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C2(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000540753022 1127993340 /nfs/dbraw/zinc/99/33/40/1127993340.db2.gz KRJLFVOJGDVOEK-LLVKDONJSA-N 1 0 290.363 3.587 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)CC(F)(F)F ZINC000545236195 1128007326 /nfs/dbraw/zinc/00/73/26/1128007326.db2.gz WSQRZKLQXJGGKY-NXEZZACHSA-N 1 0 290.285 3.895 20 5 CHBDRO C[C@H]([N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1)C(C)(C)C ZINC000094774685 1128007876 /nfs/dbraw/zinc/00/78/76/1128007876.db2.gz XYZKWOVZBDANSF-JTQLQIEISA-N 1 0 268.332 3.600 20 5 CHBDRO C[C@@H](CC1CCCC1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000468443924 1128008348 /nfs/dbraw/zinc/00/83/48/1128008348.db2.gz HOJRJCATZLVKDZ-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000541701397 1128034173 /nfs/dbraw/zinc/03/41/73/1128034173.db2.gz RCMAGTIBXMYOKE-CQSZACIVSA-N 1 0 262.353 3.749 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C)[C@H]1C ZINC000541770471 1128038282 /nfs/dbraw/zinc/03/82/82/1128038282.db2.gz FDVKOJSTSDDTCB-WCQYABFASA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC000542049196 1128049497 /nfs/dbraw/zinc/04/94/97/1128049497.db2.gz VXCOUYCRGUQXOD-XNRPHZJLSA-N 1 0 274.364 3.605 20 5 CHBDRO CC[C@@H]1CC[N@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470182635 1128064962 /nfs/dbraw/zinc/06/49/62/1128064962.db2.gz MHPHNKSZKIWHQU-KADHNRKRSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C)CC1 ZINC000470176935 1128065043 /nfs/dbraw/zinc/06/50/43/1128065043.db2.gz OFSIPJJQVWVTHZ-GXDHUFHOSA-N 1 0 274.364 3.730 20 5 CHBDRO CCOc1cc(C[N@@H+]2CC[C@@](C)(CC)C2)ccc1[N+](=O)[O-] ZINC000492698886 1128109942 /nfs/dbraw/zinc/10/99/42/1128109942.db2.gz VCNMAIJAXLBILG-MRXNPFEDSA-N 1 0 292.379 3.616 20 5 CHBDRO CC(C)CCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761521253 1128132851 /nfs/dbraw/zinc/13/28/51/1128132851.db2.gz LGUPYPYLCNXGDF-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO CC1([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCCC1 ZINC000761519676 1128132880 /nfs/dbraw/zinc/13/28/80/1128132880.db2.gz DCJQNMNGIQGCBK-UHFFFAOYSA-N 1 0 268.744 3.671 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000609204551 1128173713 /nfs/dbraw/zinc/17/37/13/1128173713.db2.gz WAOSZAWMZYFBEC-CHWSQXEVSA-N 1 0 276.380 3.994 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000094868961 1128174241 /nfs/dbraw/zinc/17/42/41/1128174241.db2.gz WVPDOCHAZJLBNH-MNOVXSKESA-N 1 0 260.293 3.600 20 5 CHBDRO CC[C@@H](C[C@](C)(O)CC)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000926493332 1128175380 /nfs/dbraw/zinc/17/53/80/1128175380.db2.gz QTZPEUOMVSHDPM-DUVNUKRYSA-N 1 0 294.395 3.575 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000035277336 1128276913 /nfs/dbraw/zinc/27/69/13/1128276913.db2.gz CHFOMLYAAYKTSJ-CQSZACIVSA-N 1 0 293.411 3.826 20 5 CHBDRO CCC[C@H]([NH2+]CCCCCCO)c1cccc([N+](=O)[O-])c1 ZINC000224786570 1128286398 /nfs/dbraw/zinc/28/63/98/1128286398.db2.gz CRUBEIUDLCAXDV-INIZCTEOSA-N 1 0 294.395 3.578 20 5 CHBDRO Cc1cc(NCCC[NH2+]C2CCCCC2)ccc1[N+](=O)[O-] ZINC000301077656 1128309516 /nfs/dbraw/zinc/30/95/16/1128309516.db2.gz FXENSCNGVNDZBB-UHFFFAOYSA-N 1 0 291.395 3.628 20 5 CHBDRO Cc1c(C[NH+]2CCCCCCC2)cccc1[N+](=O)[O-] ZINC000916985306 1128466913 /nfs/dbraw/zinc/46/69/13/1128466913.db2.gz WQXOCKIPZQDEBP-UHFFFAOYSA-N 1 0 262.353 3.669 20 5 CHBDRO CC(C)C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C(C)C ZINC000917100966 1128480979 /nfs/dbraw/zinc/48/09/79/1128480979.db2.gz UGYINHOXJIYYFL-UHFFFAOYSA-N 1 0 268.332 3.600 20 5 CHBDRO CCCCC[C@@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000040675937 1128526620 /nfs/dbraw/zinc/52/66/20/1128526620.db2.gz OPRMEPIQYZSFFY-CYBMUJFWSA-N 1 0 264.369 3.696 20 5 CHBDRO O=[N+]([O-])c1ccc([O-])cc1C[N@@H+]1CCCC12CCCCC2 ZINC000568419481 1128584178 /nfs/dbraw/zinc/58/41/78/1128584178.db2.gz GFVVRGQGHZOPFO-UHFFFAOYSA-N 1 0 290.363 3.599 20 5 CHBDRO CC(C)(C)CC(C)(C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037563012 1128620226 /nfs/dbraw/zinc/62/02/26/1128620226.db2.gz UAFVOAYGUPBPQA-UHFFFAOYSA-N 1 0 270.398 3.961 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCCc3ccccc3C2)c1 ZINC000498928015 1128622477 /nfs/dbraw/zinc/62/24/77/1128622477.db2.gz HJNMVRAJWSTAQK-UHFFFAOYSA-N 1 0 282.343 3.543 20 5 CHBDRO Cc1ncsc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000132424829 1128649604 /nfs/dbraw/zinc/64/96/04/1128649604.db2.gz IDQDDTYQPFZEQR-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc([C@H]3CCC[NH2+]3)cc2)cc1 ZINC000600783020 1128681204 /nfs/dbraw/zinc/68/12/04/1128681204.db2.gz BQCJHBPGWWMSKC-MRXNPFEDSA-N 1 0 268.316 3.686 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCCCC3)cc2)cn1 ZINC000600788003 1128681460 /nfs/dbraw/zinc/68/14/60/1128681460.db2.gz CPWPJTXDEJSKOF-UHFFFAOYSA-N 1 0 297.358 3.643 20 5 CHBDRO CCCC[N@@H+]1CCCC[C@H]1CNc1ccsc1[N+](=O)[O-] ZINC000609560996 1128717981 /nfs/dbraw/zinc/71/79/81/1128717981.db2.gz QFFKXAIKXZMFFD-LBPRGKRZSA-N 1 0 297.424 3.723 20 5 CHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609767012 1128724882 /nfs/dbraw/zinc/72/48/82/1128724882.db2.gz FMHZGIUMPYPWNF-CQSZACIVSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609846133 1128728382 /nfs/dbraw/zinc/72/83/82/1128728382.db2.gz DTSJJXCUAUPRRI-INWMFGNUSA-N 1 0 274.364 3.748 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000609846171 1128728249 /nfs/dbraw/zinc/72/82/49/1128728249.db2.gz NXCFYEYUTALFMI-RAIGVLPGSA-N 1 0 280.393 3.809 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000036721078 1117746152 /nfs/dbraw/zinc/74/61/52/1117746152.db2.gz OKIZXDCZWDZXEW-BXUZGUMPSA-N 1 0 250.342 3.824 20 5 CHBDRO Cc1ccc(C[NH2+]C2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000034995804 1117757849 /nfs/dbraw/zinc/75/78/49/1117757849.db2.gz LZFUVJODGLPAKS-UHFFFAOYSA-N 1 0 262.353 3.572 20 5 CHBDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610001919 1128734511 /nfs/dbraw/zinc/73/45/11/1128734511.db2.gz LZHPQYKFSHOUEW-DZGCQCFKSA-N 1 0 276.380 3.995 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC[C@H](C)F)cc1[N+](=O)[O-] ZINC000339494197 1117808071 /nfs/dbraw/zinc/80/80/71/1117808071.db2.gz KSXZOMNHAHKZEZ-NSHDSACASA-N 1 0 268.332 3.556 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)cc1 ZINC000014672860 1117859821 /nfs/dbraw/zinc/85/98/21/1117859821.db2.gz ZGGOMNCXKHKFCT-AWEZNQCLSA-N 1 0 288.372 3.993 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000109133974 1117919787 /nfs/dbraw/zinc/91/97/87/1117919787.db2.gz APHVWMYQUIYDBB-NXEZZACHSA-N 1 0 270.760 3.772 20 5 CHBDRO CC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000340140085 1118080778 /nfs/dbraw/zinc/08/07/78/1118080778.db2.gz MFUJQZCHAKPLCG-QGZVFWFLSA-N 1 0 284.359 3.878 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000237774030 1128757544 /nfs/dbraw/zinc/75/75/44/1128757544.db2.gz CWTKLDCGUCMASO-IRXDYDNUSA-N 1 0 296.370 3.797 20 5 CHBDRO Cc1cc(C)[nH+]c(NCc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC001650806919 1118162150 /nfs/dbraw/zinc/16/21/50/1118162150.db2.gz CUOFAXREOCTKEE-UHFFFAOYSA-N 1 0 271.320 3.527 20 5 CHBDRO CC(C)[C@@H](C)C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000084440240 1118356717 /nfs/dbraw/zinc/35/67/17/1118356717.db2.gz SYWJKSLVSORUHL-JTQLQIEISA-N 1 0 270.760 3.630 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C1CCC(C)CC1 ZINC000060332764 1118422950 /nfs/dbraw/zinc/42/29/50/1118422950.db2.gz RIGKNGQHIBYTQW-UHFFFAOYSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-] ZINC000090965510 1118747616 /nfs/dbraw/zinc/74/76/16/1118747616.db2.gz AVFYTAVXXBXPLK-UPJWGTAASA-N 1 0 292.379 3.510 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H](OC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000361815861 1118815217 /nfs/dbraw/zinc/81/52/17/1118815217.db2.gz VSDOHWHDAFEPEE-HOTGVXAUSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])s1 ZINC000084439850 1118943224 /nfs/dbraw/zinc/94/32/24/1118943224.db2.gz LGJLVUPGUCZQMT-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO C[C@@H]([NH2+]CC1Cc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000539071840 1118968750 /nfs/dbraw/zinc/96/87/50/1118968750.db2.gz LFJASDYKLVKSGL-CYBMUJFWSA-N 1 0 296.370 3.660 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000562066868 1119098740 /nfs/dbraw/zinc/09/87/40/1119098740.db2.gz XZUNCBGQDXPBBG-XHDPSFHLSA-N 1 0 292.379 3.833 20 5 CHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000479580019 1119125729 /nfs/dbraw/zinc/12/57/29/1119125729.db2.gz DDZURYAELBPLPC-ZETCQYMHSA-N 1 0 296.676 3.536 20 5 CHBDRO CC(C)[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000158718486 1119151420 /nfs/dbraw/zinc/15/14/20/1119151420.db2.gz DFCUFOYVQCOJBK-UHFFFAOYSA-N 1 0 274.320 3.695 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC(C)(C)C)cccc1[N+](=O)[O-] ZINC000178677893 1119225632 /nfs/dbraw/zinc/22/56/32/1119225632.db2.gz UPFKLMZHUHOIMP-LLVKDONJSA-N 1 0 250.342 3.600 20 5 CHBDRO CC[C@@H](C)[C@H](C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)OC ZINC000362978398 1119252042 /nfs/dbraw/zinc/25/20/42/1119252042.db2.gz ZUXRHXRRZIORPO-KCXAZCMYSA-N 1 0 294.395 3.697 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCC(C)(C)C1 ZINC000149938951 1119272657 /nfs/dbraw/zinc/27/26/57/1119272657.db2.gz VHMUOUVOQKFIFB-CYBMUJFWSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000343016861 1119281589 /nfs/dbraw/zinc/28/15/89/1119281589.db2.gz YDZRNMBOTCFVAU-INIZCTEOSA-N 1 0 274.364 3.668 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000583254484 1119327516 /nfs/dbraw/zinc/32/75/16/1119327516.db2.gz NJUYSIFMHDRJLT-CHWSQXEVSA-N 1 0 292.379 3.518 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccncc2)C1 ZINC000583603104 1119384306 /nfs/dbraw/zinc/38/43/06/1119384306.db2.gz UUMXNDKARUPQEH-DZGCQCFKSA-N 1 0 297.358 3.540 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@H](CCC)OC)c1cccc([N+](=O)[O-])c1 ZINC000378842760 1119573727 /nfs/dbraw/zinc/57/37/27/1119573727.db2.gz PYTOXEUKHMBPDY-JKSUJKDBSA-N 1 0 294.395 3.841 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000158896998 1119591955 /nfs/dbraw/zinc/59/19/55/1119591955.db2.gz MXUSNLWWMRVJSQ-CYBMUJFWSA-N 1 0 292.379 3.662 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543855681 1119596922 /nfs/dbraw/zinc/59/69/22/1119596922.db2.gz KCZAWRADBBZALC-JTQLQIEISA-N 1 0 270.760 3.869 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](C1CC1)[C@@H]1C=CCCC1 ZINC000179242478 1119624447 /nfs/dbraw/zinc/62/44/47/1119624447.db2.gz DRNKSTSMMWDOGR-CQSZACIVSA-N 1 0 272.348 3.668 20 5 CHBDRO CN(Cc1cc(F)cc(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000179314850 1119710340 /nfs/dbraw/zinc/71/03/40/1119710340.db2.gz TWRCDTVEVQBEDZ-UHFFFAOYSA-N 1 0 292.285 3.505 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C1CC1 ZINC000615720419 1119791210 /nfs/dbraw/zinc/79/12/10/1119791210.db2.gz AGVAKCUPAONIAO-RPHSKFLZSA-N 1 0 274.364 3.634 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCC(F)(F)C2)c1 ZINC000311796552 1120107385 /nfs/dbraw/zinc/10/73/85/1120107385.db2.gz BAEZFVTWPMWPSX-SECBINFHSA-N 1 0 290.697 3.526 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])s1 ZINC000062726420 1120205863 /nfs/dbraw/zinc/20/58/63/1120205863.db2.gz VIMZGAUPDCIROC-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1 ZINC000062726476 1120206009 /nfs/dbraw/zinc/20/60/09/1120206009.db2.gz VPKRHRHLBGBKFX-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO CC(C)CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001167735342 1120300253 /nfs/dbraw/zinc/30/02/53/1120300253.db2.gz ZMNMZCYQJLPRHN-UHFFFAOYSA-N 1 0 276.380 3.995 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc1C ZINC000313886338 1120414904 /nfs/dbraw/zinc/41/49/04/1120414904.db2.gz CYKUQNQTFWCLJR-CQSZACIVSA-N 1 0 299.374 3.766 20 5 CHBDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC(C)C ZINC000417358519 1120435411 /nfs/dbraw/zinc/43/54/11/1120435411.db2.gz HZHZXVWWNNAWOE-UKRRQHHQSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1ncsc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000132424625 1120440032 /nfs/dbraw/zinc/44/00/32/1120440032.db2.gz IDQDDTYQPFZEQR-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO CC[C@H]1CCC[C@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000068592694 1120479463 /nfs/dbraw/zinc/47/94/63/1120479463.db2.gz KPSYZCCMFUONGN-KBPBESRZSA-N 1 0 292.379 3.532 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)C2CCCC2)cc1[N+](=O)[O-] ZINC000070306184 1120530569 /nfs/dbraw/zinc/53/05/69/1120530569.db2.gz UNESOPUKVCLMQC-GFCCVEGCSA-N 1 0 262.353 3.572 20 5 CHBDRO COc1ccsc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000922537508 1120548006 /nfs/dbraw/zinc/54/80/06/1120548006.db2.gz HJRMJWZQGARPDQ-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO CCSCCC[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000500366634 1120597606 /nfs/dbraw/zinc/59/76/06/1120597606.db2.gz IKXYKYXWGKGAGT-JLHYYAGUSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCS[C@H](C)C1 ZINC000922833411 1120606605 /nfs/dbraw/zinc/60/66/05/1120606605.db2.gz GQVMSCHVBLXWCB-YPMHNXCESA-N 1 0 294.420 3.585 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCSC3(CCC3)C2)c1 ZINC000922843206 1120609857 /nfs/dbraw/zinc/60/98/57/1120609857.db2.gz SRCXOJYHFSEQKA-ZDUSSCGKSA-N 1 0 292.404 3.503 20 5 CHBDRO CCC[C@H]([NH2+]Cc1cccc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000125519093 1120616334 /nfs/dbraw/zinc/61/63/34/1120616334.db2.gz MDOCNBDJLYUSRH-KRWDZBQOSA-N 1 0 299.374 3.929 20 5 CHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccoc1 ZINC000092935794 1120638837 /nfs/dbraw/zinc/63/88/37/1120638837.db2.gz QTTNXHRXATXSAQ-FNORWQNLSA-N 1 0 286.331 3.723 20 5 CHBDRO Cc1cc(N2CC[C@@H](C)[C@@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302102831 1120648870 /nfs/dbraw/zinc/64/88/70/1120648870.db2.gz VUQXOVDQFMGUGZ-PWSUYJOCSA-N 1 0 285.347 3.686 20 5 CHBDRO C[C@@H](c1ccccn1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350363288 1120651881 /nfs/dbraw/zinc/65/18/81/1120651881.db2.gz XOPNJWSGGUOVNY-LEJCZOIISA-N 1 0 297.358 3.696 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCCCCC1 ZINC000302918019 1120660039 /nfs/dbraw/zinc/66/00/39/1120660039.db2.gz ASHLNQLYIRDPLR-UHFFFAOYSA-N 1 0 262.353 3.749 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH+](C2CCC2)C2CCC2)c1 ZINC000429122968 1120669856 /nfs/dbraw/zinc/66/98/56/1120669856.db2.gz NMLGHBUHMGEEIV-UHFFFAOYSA-N 1 0 260.337 3.502 20 5 CHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000313155925 1120683359 /nfs/dbraw/zinc/68/33/59/1120683359.db2.gz HCMNCKOGPVGODB-ZDUSSCGKSA-N 1 0 276.380 3.901 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000132491998 1120691756 /nfs/dbraw/zinc/69/17/56/1120691756.db2.gz MBQVGZLATCNJMS-CYBMUJFWSA-N 1 0 262.353 3.572 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C/C=C/C1CC1 ZINC001117745254 1120702049 /nfs/dbraw/zinc/70/20/49/1120702049.db2.gz KAUJQTCLIZKLSG-CZSRTNDOSA-N 1 0 272.348 3.554 20 5 CHBDRO CN(Cc1csc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000048609566 1120835213 /nfs/dbraw/zinc/83/52/13/1120835213.db2.gz QENCSOZKDOGELA-AWEZNQCLSA-N 1 0 288.372 3.776 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C2CC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000436470417 1120865455 /nfs/dbraw/zinc/86/54/55/1120865455.db2.gz LDDUACUNBATCQP-GFCCVEGCSA-N 1 0 274.364 3.887 20 5 CHBDRO CC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000051627136 1120962950 /nfs/dbraw/zinc/96/29/50/1120962950.db2.gz GYHDDZSZRQMCBK-CYBMUJFWSA-N 1 0 276.361 3.897 20 5 CHBDRO C[C@H]([NH2+]C[C@]1(C)CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000134110321 1121056336 /nfs/dbraw/zinc/05/63/36/1121056336.db2.gz DHRFDHZLAJZAJW-FZMZJTMJSA-N 1 0 280.393 3.531 20 5 CHBDRO CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000059385830 1121060663 /nfs/dbraw/zinc/06/06/63/1121060663.db2.gz RJKBZUYQDZUIAJ-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C1(C2CCC2)CC1 ZINC000700179673 1121089669 /nfs/dbraw/zinc/08/96/69/1121089669.db2.gz DRALQBUYARFQTP-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000222200418 1121102524 /nfs/dbraw/zinc/10/25/24/1121102524.db2.gz PABXHQSJWYANCN-SCDSUCTJSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@]12C[C@H]1CCCC2 ZINC001175292585 1121258540 /nfs/dbraw/zinc/25/85/40/1121258540.db2.gz LAJYFTFRHLHPPC-GHJWDPDVSA-N 1 0 292.354 3.792 20 5 CHBDRO C[C@H](CC1CCC1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000710251899 1121474516 /nfs/dbraw/zinc/47/45/16/1121474516.db2.gz YUBPAQKKABQNBL-SNVBAGLBSA-N 1 0 282.771 3.917 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000512653364 1121510304 /nfs/dbraw/zinc/51/03/04/1121510304.db2.gz WNNFKPHLMQHFSS-UFNQUYMESA-N 1 0 286.375 3.873 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000433035690 1121532556 /nfs/dbraw/zinc/53/25/56/1121532556.db2.gz NRGAOLBONJSEKA-FZMZJTMJSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000611293073 1121635265 /nfs/dbraw/zinc/63/52/65/1121635265.db2.gz AEOMFMCUDYEGIZ-DYLGSBMWSA-N 1 0 297.358 3.662 20 5 CHBDRO CS[C@@H](C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433297413 1121642064 /nfs/dbraw/zinc/64/20/64/1121642064.db2.gz LEJUUTNMUCOBDB-IINYFYTJSA-N 1 0 294.420 3.658 20 5 CHBDRO CC[C@H]([NH2+]CCCOC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000611403565 1121644093 /nfs/dbraw/zinc/64/40/93/1121644093.db2.gz SDKSEWNKOHIJRG-HNNXBMFYSA-N 1 0 294.395 3.841 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCC(C)(C)C1 ZINC000483108912 1121694804 /nfs/dbraw/zinc/69/48/04/1121694804.db2.gz ILGIHGCAXVMOJJ-AWEZNQCLSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000052337473 1121702929 /nfs/dbraw/zinc/70/29/29/1121702929.db2.gz NEJRRNMVQZOSBD-NSHDSACASA-N 1 0 280.343 3.792 20 5 CHBDRO CC[C@@H]1CCC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC001178386797 1121782381 /nfs/dbraw/zinc/78/23/81/1121782381.db2.gz NCHYTENKUIVJOH-HIFRSBDPSA-N 1 0 276.380 3.696 20 5 CHBDRO CCC[C@@H]([NH2+]CCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000063099273 1121794190 /nfs/dbraw/zinc/79/41/90/1121794190.db2.gz DVFXKDGRPAYNNJ-GFCCVEGCSA-N 1 0 290.285 3.978 20 5 CHBDRO Cc1ccc(C[NH2+]CC[C@@H]2CCCC2(F)F)cc1[N+](=O)[O-] ZINC001179442343 1121878078 /nfs/dbraw/zinc/87/80/78/1121878078.db2.gz CQLFXOLKZMMPGE-ZDUSSCGKSA-N 1 0 298.333 3.818 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)/C=C/Cl)cc1[N+](=O)[O-] ZINC001179625836 1121896973 /nfs/dbraw/zinc/89/69/73/1121896973.db2.gz CHRRIEUKWYPAQU-VOTSOKGWSA-N 1 0 268.744 3.524 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC001179685829 1121898970 /nfs/dbraw/zinc/89/89/70/1121898970.db2.gz QNMCGUVQZWRMBG-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000430034400 1121931771 /nfs/dbraw/zinc/93/17/71/1121931771.db2.gz JSXDZGPXDQXISU-PYEVWLCESA-N 1 0 296.317 3.633 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC001180199381 1121964369 /nfs/dbraw/zinc/96/43/69/1121964369.db2.gz RNGSGNNNEAYHLT-DGCLKSJQSA-N 1 0 276.380 3.690 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000110804345 1121993132 /nfs/dbraw/zinc/99/31/32/1121993132.db2.gz KNJZATNHRVEVLN-LLVKDONJSA-N 1 0 282.771 3.870 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000518581225 1122006321 /nfs/dbraw/zinc/00/63/21/1122006321.db2.gz BDGWZHZWFQKUQV-CHWSQXEVSA-N 1 0 262.353 3.778 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)C1CCC1 ZINC000324951523 1129032740 /nfs/dbraw/zinc/03/27/40/1129032740.db2.gz BPTTVAIQQSMYIN-AWEZNQCLSA-N 1 0 280.343 3.792 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CC[C@@H](C)C1 ZINC000429591129 1122143287 /nfs/dbraw/zinc/14/32/87/1122143287.db2.gz QQQSEONJPUQIDO-OCCSQVGLSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@]1(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C[C@H]2C[C@H]2C1 ZINC001183237560 1122212370 /nfs/dbraw/zinc/21/23/70/1122212370.db2.gz BQYLEJVPGUVIRK-JYAVWHMHSA-N 1 0 294.782 3.774 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000514086983 1122375110 /nfs/dbraw/zinc/37/51/10/1122375110.db2.gz DYERJIIXNFGNRQ-CQSZACIVSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)CCc1cccs1 ZINC000183371550 1129050404 /nfs/dbraw/zinc/05/04/04/1129050404.db2.gz BUBDWXHBPUDCOZ-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC(C)(C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000434754617 1122410282 /nfs/dbraw/zinc/41/02/82/1122410282.db2.gz GKLVNFIZQSNVFV-DGCLKSJQSA-N 1 0 292.379 3.518 20 5 CHBDRO CCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC1CC1 ZINC000435237748 1122447005 /nfs/dbraw/zinc/44/70/05/1122447005.db2.gz OIOZUTTTWMJBLW-FNORWQNLSA-N 1 0 274.364 3.730 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001167960565 1122524708 /nfs/dbraw/zinc/52/47/08/1122524708.db2.gz UZLIWNSDHNPNTM-LBPRGKRZSA-N 1 0 280.343 3.746 20 5 CHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001190771098 1122554942 /nfs/dbraw/zinc/55/49/42/1122554942.db2.gz XIZQFFFDLQECHO-LLVKDONJSA-N 1 0 298.333 3.884 20 5 CHBDRO C[C@H](c1cccs1)N(C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505864137 1122573973 /nfs/dbraw/zinc/57/39/73/1122573973.db2.gz JXZUQRCCKCDCSO-SNVBAGLBSA-N 1 0 294.351 3.988 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000601306259 1122628345 /nfs/dbraw/zinc/62/83/45/1122628345.db2.gz DZKKSTLFKMUWBL-IJLUTSLNSA-N 1 0 288.269 3.586 20 5 CHBDRO C[C@@H]1CC[C@@H]([N@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429600738 1122726946 /nfs/dbraw/zinc/72/69/46/1122726946.db2.gz WTRKEGVAQLQQQM-GHMZBOCLSA-N 1 0 282.771 3.869 20 5 CHBDRO C[N@H+](Cc1csc([N+](=O)[O-])c1)C1CCCCCC1 ZINC000054173167 1122765016 /nfs/dbraw/zinc/76/50/16/1122765016.db2.gz XPAWSGIYBZPBHV-UHFFFAOYSA-N 1 0 268.382 3.811 20 5 CHBDRO C=C/C=C/CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194478304 1122778887 /nfs/dbraw/zinc/77/88/87/1122778887.db2.gz SOJLVIKKRRBIBZ-CWDCEQMOSA-N 1 0 286.375 3.907 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000506622157 1122793042 /nfs/dbraw/zinc/79/30/42/1122793042.db2.gz ALLNFCKXAVMBPQ-LBPRGKRZSA-N 1 0 280.343 3.744 20 5 CHBDRO CCC[C@H](C)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507020288 1122919025 /nfs/dbraw/zinc/91/90/25/1122919025.db2.gz HHMQZBAGYQPYBH-RSPDNQDQSA-N 1 0 262.353 3.728 20 5 CHBDRO CC[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C1CC1 ZINC000507234392 1122941071 /nfs/dbraw/zinc/94/10/71/1122941071.db2.gz SEDFOVOLNHXOFB-UHFFFAOYSA-N 1 0 262.353 3.703 20 5 CHBDRO Cc1ccc(C[NH2+]C2[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000520214708 1123063673 /nfs/dbraw/zinc/06/36/73/1123063673.db2.gz VPDUWRKPUXESQA-CHWSQXEVSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H]1CCC[C@@H]1C ZINC001202134221 1123177201 /nfs/dbraw/zinc/17/72/01/1123177201.db2.gz CQMNACXMKQUVDS-SMDDNHRTSA-N 1 0 276.380 3.737 20 5 CHBDRO C=C/C=C\CC[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000713456112 1123294936 /nfs/dbraw/zinc/29/49/36/1123294936.db2.gz LWBZOZXPZLKSDZ-IYKSTZQJSA-N 1 0 260.337 3.768 20 5 CHBDRO C[C@H](O)C[N@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000776520794 1123345733 /nfs/dbraw/zinc/34/57/33/1123345733.db2.gz GQTAPFYPLPOXTR-AWEZNQCLSA-N 1 0 279.383 3.806 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000852649776 1123410740 /nfs/dbraw/zinc/41/07/40/1123410740.db2.gz BWMSASBCRFGNAE-XSRFYTQQSA-N 1 0 298.333 3.740 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000020526065 1123646066 /nfs/dbraw/zinc/64/60/66/1123646066.db2.gz LZTMFHSPDBMLPH-MBNYWOFBSA-N 1 0 262.353 3.824 20 5 CHBDRO COc1ccc(C[NH2+]C2CCCCCCC2)cc1[N+](=O)[O-] ZINC000020549359 1123648230 /nfs/dbraw/zinc/64/82/30/1123648230.db2.gz CEAADOUZAKYYLO-UHFFFAOYSA-N 1 0 292.379 3.806 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000522712685 1123719874 /nfs/dbraw/zinc/71/98/74/1123719874.db2.gz AJBBDYBDMHEEFZ-ZDUSSCGKSA-N 1 0 292.379 3.616 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccncc1 ZINC000173441040 1123786840 /nfs/dbraw/zinc/78/68/40/1123786840.db2.gz HCTCFVKZDHBPDJ-BLLLJJGKSA-N 1 0 285.347 3.792 20 5 CHBDRO Cc1ccc(COc2ccc([C@@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000864554865 1123935868 /nfs/dbraw/zinc/93/58/68/1123935868.db2.gz OBCQWHKVGIWSCP-GFCCVEGCSA-N 1 0 286.331 3.502 20 5 CHBDRO Cc1ccc(F)cc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000865788074 1124013916 /nfs/dbraw/zinc/01/39/16/1124013916.db2.gz YBZLXYCDRMZCRI-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000034995605 1124021604 /nfs/dbraw/zinc/02/16/04/1124021604.db2.gz NMCPDXOSADIIQD-SMDDNHRTSA-N 1 0 262.353 3.572 20 5 CHBDRO CC(C)[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000866312585 1124050904 /nfs/dbraw/zinc/05/09/04/1124050904.db2.gz OMOMKJBCHMTUIG-KRWDZBQOSA-N 1 0 299.374 3.519 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000444764888 1124061422 /nfs/dbraw/zinc/06/14/22/1124061422.db2.gz COOGOZBUJZLIPE-GFCCVEGCSA-N 1 0 280.343 3.602 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000475619928 1124071710 /nfs/dbraw/zinc/07/17/10/1124071710.db2.gz BDQJPWDKNHKDDD-LBPRGKRZSA-N 1 0 282.409 3.914 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000475619927 1124071987 /nfs/dbraw/zinc/07/19/87/1124071987.db2.gz BDQJPWDKNHKDDD-GFCCVEGCSA-N 1 0 282.409 3.914 20 5 CHBDRO CC(C)(C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(F)F ZINC000866546960 1124081733 /nfs/dbraw/zinc/08/17/33/1124081733.db2.gz QWZXPSNCCAIRAJ-GFCCVEGCSA-N 1 0 298.333 3.853 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000339076706 1124100942 /nfs/dbraw/zinc/10/09/42/1124100942.db2.gz AVFYTAVXXBXPLK-AVGNSLFASA-N 1 0 292.379 3.510 20 5 CHBDRO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000526989369 1124538522 /nfs/dbraw/zinc/53/85/22/1124538522.db2.gz RJJNPOQMJYPHJJ-RYUDHWBXSA-N 1 0 286.331 3.838 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccsc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872021545 1124659180 /nfs/dbraw/zinc/65/91/80/1124659180.db2.gz RXQUKIORPMWNOA-SNVBAGLBSA-N 1 0 294.351 3.689 20 5 CHBDRO C[C@H]([NH2+]CCCC(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872041876 1124664460 /nfs/dbraw/zinc/66/44/60/1124664460.db2.gz WXMKSXLDZVWSFY-QMMMGPOBSA-N 1 0 294.248 3.727 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1(C2CC2)CC1 ZINC000872054874 1124667521 /nfs/dbraw/zinc/66/75/21/1124667521.db2.gz CPAGVXGKPTZRGZ-JTQLQIEISA-N 1 0 292.404 3.910 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872053618 1124667608 /nfs/dbraw/zinc/66/76/08/1124667608.db2.gz LIZHSYNVLIPDHA-ZJUUUORDSA-N 1 0 286.372 3.526 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872057986 1124669011 /nfs/dbraw/zinc/66/90/11/1124669011.db2.gz LTBROGDPBZFILL-RKDXNWHRSA-N 1 0 288.269 3.572 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC(F)(F)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872057983 1124669384 /nfs/dbraw/zinc/66/93/84/1124669384.db2.gz LTBROGDPBZFILL-BDAKNGLRSA-N 1 0 288.269 3.572 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCCSC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872071922 1124674517 /nfs/dbraw/zinc/67/45/17/1124674517.db2.gz ZYEPXJPTWPXTIH-QWRGUYRKSA-N 1 0 298.383 3.528 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])CC(F)F ZINC000872081068 1124677534 /nfs/dbraw/zinc/67/75/34/1124677534.db2.gz FOBHAUZXTCCGPL-IUCAKERBSA-N 1 0 290.285 3.676 20 5 CHBDRO COCC(C)(C)CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000872105206 1124683843 /nfs/dbraw/zinc/68/38/43/1124683843.db2.gz DCBKHNUWMUPZGV-ZDUSSCGKSA-N 1 0 294.395 3.617 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC12CCCC2 ZINC000449288187 1124684542 /nfs/dbraw/zinc/68/45/42/1124684542.db2.gz YBVCCXXWOHHFDV-BBRMVZONSA-N 1 0 288.391 3.838 20 5 CHBDRO CC(C)OC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000872118148 1124688269 /nfs/dbraw/zinc/68/82/69/1124688269.db2.gz ZNMDMMIXLRQYNE-ZDUSSCGKSA-N 1 0 292.379 3.593 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC(C)(F)F ZINC000449353866 1124708656 /nfs/dbraw/zinc/70/86/56/1124708656.db2.gz HRCKCJLMDWEQRU-FLIBITNWSA-N 1 0 284.306 3.633 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000873105869 1124738616 /nfs/dbraw/zinc/73/86/16/1124738616.db2.gz BRTKYOFYEOJSDU-LLVKDONJSA-N 1 0 290.285 3.724 20 5 CHBDRO Cc1c[nH+]ccc1N1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000450755411 1125102189 /nfs/dbraw/zinc/10/21/89/1125102189.db2.gz JHIMTRLWONQOKT-OAHLLOKOSA-N 1 0 297.358 3.682 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000531378682 1125212697 /nfs/dbraw/zinc/21/26/97/1125212697.db2.gz JNOMWEJNEZFAPO-GUYCJALGSA-N 1 0 282.343 3.788 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000129469252 1125336809 /nfs/dbraw/zinc/33/68/09/1125336809.db2.gz KRRXVKMXHRNBSN-WCQYABFASA-N 1 0 262.353 3.824 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(C)(C)CC ZINC000428560274 1125387686 /nfs/dbraw/zinc/38/76/86/1125387686.db2.gz NMJDAAHSDNLACN-UHFFFAOYSA-N 1 0 280.368 3.519 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCC1CCCC1)CC2 ZINC001307524112 1125390956 /nfs/dbraw/zinc/39/09/56/1125390956.db2.gz SPYHBFPSZUMYMA-UHFFFAOYSA-N 1 0 274.364 3.533 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)C1CC(F)(F)C1)c1ccccc1[N+](=O)[O-] ZINC000897461885 1125424226 /nfs/dbraw/zinc/42/42/26/1125424226.db2.gz ZUEFBJPMXFFOQN-QWRGUYRKSA-N 1 0 298.333 3.722 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000090224848 1129275656 /nfs/dbraw/zinc/27/56/56/1129275656.db2.gz ZBFHKMZCNACZLK-INIZCTEOSA-N 1 0 285.347 3.539 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037913723 1129290198 /nfs/dbraw/zinc/29/01/98/1129290198.db2.gz NNKHXIBLCIVLKW-NSHDSACASA-N 1 0 268.744 3.623 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774884 1129452013 /nfs/dbraw/zinc/45/20/13/1129452013.db2.gz HIBFUSRWNQRCMK-LBPRGKRZSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc2ccccc2c1 ZINC001168978241 1129686610 /nfs/dbraw/zinc/68/66/10/1129686610.db2.gz QENDDRUNGZJTCV-GLJUWKHASA-N 1 0 298.386 3.936 20 5 CHBDRO CC(C)[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1F ZINC001168982836 1129687264 /nfs/dbraw/zinc/68/72/64/1129687264.db2.gz JBWXQVGEIXGDOT-ZENOOKHLSA-N 1 0 294.370 3.558 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168965642 1129687800 /nfs/dbraw/zinc/68/78/00/1129687800.db2.gz BODDXPOGGWBKOQ-DFBGVHRSSA-N 1 0 296.798 3.826 20 5 CHBDRO CC(C)C[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168971400 1129688260 /nfs/dbraw/zinc/68/82/60/1129688260.db2.gz KDUQFNSANIUTIV-PVAVHDDUSA-N 1 0 290.407 3.809 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C)cc1C ZINC001168991544 1129688613 /nfs/dbraw/zinc/68/86/13/1129688613.db2.gz HHNOTUXQVYWQSN-YQQAZPJKSA-N 1 0 290.407 3.790 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)c(C)c1 ZINC001169003602 1129689113 /nfs/dbraw/zinc/68/91/13/1129689113.db2.gz ONQXRXUADVYYGG-NOLJZWGESA-N 1 0 294.370 3.620 20 5 CHBDRO Cc1cccc([C@H]([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)C(C)C)c1 ZINC001169004121 1129689443 /nfs/dbraw/zinc/68/94/43/1129689443.db2.gz PZHXUIMFJWEOSV-HYVNUMGLSA-N 1 0 290.407 3.727 20 5 CHBDRO CC(C)CC[NH+](CCC(C)C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046371 1129691431 /nfs/dbraw/zinc/69/14/31/1129691431.db2.gz LIJZMGRHQCIADG-HOTGVXAUSA-N 1 0 284.444 3.826 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001169382691 1129721663 /nfs/dbraw/zinc/72/16/63/1129721663.db2.gz LOTFKTWENDPUSA-LBPRGKRZSA-N 1 0 280.343 3.602 20 5 CHBDRO Cc1cc(Cl)c(NC(C)(C)CC[NH+](C)C)c([N+](=O)[O-])c1 ZINC001169718595 1129751118 /nfs/dbraw/zinc/75/11/18/1129751118.db2.gz YLARPOXOAJOBBF-UHFFFAOYSA-N 1 0 299.802 3.699 20 5 CHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1NC(C)(C)CC[NH+](C)C ZINC001169718736 1129751177 /nfs/dbraw/zinc/75/11/77/1129751177.db2.gz UXZNJJYOTSAZDB-UHFFFAOYSA-N 1 0 293.411 3.662 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCC(C)(C)C1 ZINC000801554991 1129926884 /nfs/dbraw/zinc/92/68/84/1129926884.db2.gz CDCZWNROPQBTNA-LBPRGKRZSA-N 1 0 280.343 3.744 20 5 CHBDRO CCC[NH+](CCC)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746653087 1130133927 /nfs/dbraw/zinc/13/39/27/1130133927.db2.gz AZLFNTBUBTVHTR-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO CC(C)[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC1CC1 ZINC000746657893 1130136109 /nfs/dbraw/zinc/13/61/09/1130136109.db2.gz LPRKKLYTIQVJDB-UHFFFAOYSA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1occc1CN(C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746663381 1130139639 /nfs/dbraw/zinc/13/96/39/1130139639.db2.gz QMXHWSYRPFKQIA-UHFFFAOYSA-N 1 0 294.738 3.782 20 5 CHBDRO CO[C@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000903286809 1130146476 /nfs/dbraw/zinc/14/64/76/1130146476.db2.gz HCHPRUNKFNAXJQ-XPKDYRNWSA-N 1 0 292.379 3.593 20 5 CHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)C(C)(C)C)c([N+](=O)[O-])c1 ZINC001170297373 1130476740 /nfs/dbraw/zinc/47/67/40/1130476740.db2.gz NGMBGCGDLNGOEJ-NWDGAFQWSA-N 1 0 294.395 3.559 20 5 CHBDRO CCC(CC)[N@H+](C)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170351390 1130486376 /nfs/dbraw/zinc/48/63/76/1130486376.db2.gz FWFUXMSXWBAPGQ-LBPRGKRZSA-N 1 0 294.395 3.655 20 5 CHBDRO CCCC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473140 1130614124 /nfs/dbraw/zinc/61/41/24/1130614124.db2.gz QFVRTBHHYFPCMU-UHFFFAOYSA-N 1 0 277.151 3.791 20 5 CHBDRO CN(Cc1c2ccccc2cc2ccccc21)[C@@H]1CC[NH2+]C1 ZINC001235738599 1130774831 /nfs/dbraw/zinc/77/48/31/1130774831.db2.gz FQFPLWAJEIIOEY-QGZVFWFLSA-N 1 0 290.410 3.787 20 5 CHBDRO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001170785342 1130989870 /nfs/dbraw/zinc/98/98/70/1130989870.db2.gz ZVTRRTXLPCCJTE-OCCSQVGLSA-N 1 0 291.395 3.636 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815624441 1131010680 /nfs/dbraw/zinc/01/06/80/1131010680.db2.gz YNOHFQZGZAPSAP-ZJUUUORDSA-N 1 0 291.376 3.650 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799196889 1131076277 /nfs/dbraw/zinc/07/62/77/1131076277.db2.gz ZDHHDDIRPLAPKS-UKRRQHHQSA-N 1 0 297.358 3.540 20 5 CHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C1CC=CC1 ZINC000817408439 1131160819 /nfs/dbraw/zinc/16/08/19/1131160819.db2.gz IBVXOWNBYWNAMX-UHFFFAOYSA-N 1 0 287.146 3.710 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC3(CCC3)C2)c(F)c1 ZINC000348164109 1131890707 /nfs/dbraw/zinc/89/07/07/1131890707.db2.gz AKIBRFYXWSXQRM-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO CC(C)[C@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036787260 1131974694 /nfs/dbraw/zinc/97/46/94/1131974694.db2.gz TXPGEZOTDITFFG-JTQLQIEISA-N 1 0 270.760 3.725 20 5 CHBDRO CC(C)[NH+]1CCC(Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000036970436 1131984836 /nfs/dbraw/zinc/98/48/36/1131984836.db2.gz OREPMMGPRTXNCY-UHFFFAOYSA-N 1 0 297.786 3.533 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000036993412 1131985321 /nfs/dbraw/zinc/98/53/21/1131985321.db2.gz WETKAWACLRXDNV-QWHCGFSZSA-N 1 0 288.347 3.778 20 5 CHBDRO C[C@H]([NH2+]CC[C@@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000715755832 1131989955 /nfs/dbraw/zinc/98/99/55/1131989955.db2.gz RKUSHXHOBJKRHO-FZMZJTMJSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H]([NH2+]CC[C@H]1CCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000715753809 1131990879 /nfs/dbraw/zinc/99/08/79/1131990879.db2.gz KOGBIXCOERWQRQ-SMDDNHRTSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(-c2ccc(F)cc2)cc1 ZINC001229448517 1132069783 /nfs/dbraw/zinc/06/97/83/1132069783.db2.gz CAQRNQXPIGBMDB-AWEZNQCLSA-N 1 0 288.386 3.966 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(C2CCC2)CC1 ZINC001171840947 1132107144 /nfs/dbraw/zinc/10/71/44/1132107144.db2.gz HWOBKLJMRBYNNG-UHFFFAOYSA-N 1 0 292.354 3.746 20 5 CHBDRO CCC(C)(C)c1ccccc1O[C@H](C)C[N+](C)(C)C ZINC001231310587 1132280003 /nfs/dbraw/zinc/28/00/03/1132280003.db2.gz GDPMEOICHUVBNZ-CQSZACIVSA-N 1 0 264.433 3.848 20 5 CHBDRO CCC(C)(C)c1ccccc1O[C@@H](C)C[N+](C)(C)C ZINC001231310585 1132280594 /nfs/dbraw/zinc/28/05/94/1132280594.db2.gz GDPMEOICHUVBNZ-AWEZNQCLSA-N 1 0 264.433 3.848 20 5 CHBDRO CC1(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1 ZINC001172899626 1132347872 /nfs/dbraw/zinc/34/78/72/1132347872.db2.gz OLFLGTMTHXOGCV-OAHLLOKOSA-N 1 0 288.391 3.622 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1CCCCC1)CC2 ZINC001172899409 1132348655 /nfs/dbraw/zinc/34/86/55/1132348655.db2.gz XFOXWNUZBBUNPK-INIZCTEOSA-N 1 0 288.391 3.765 20 5 CHBDRO C[N@H+](CCC1CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919125 1132362010 /nfs/dbraw/zinc/36/20/10/1132362010.db2.gz DPUMDCJHBBFWAE-MRXNPFEDSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@H]1CCCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909938 1132371779 /nfs/dbraw/zinc/37/17/79/1132371779.db2.gz VWLBNXCXZGKCPF-BBRMVZONSA-N 1 0 288.391 3.717 20 5 CHBDRO CC1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172910420 1132372732 /nfs/dbraw/zinc/37/27/32/1132372732.db2.gz ZFSLKAWOLPIRSQ-INIZCTEOSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](C)CC1 ZINC001173221560 1132411205 /nfs/dbraw/zinc/41/12/05/1132411205.db2.gz KHHGTMAHLPDEOL-KBPBESRZSA-N 1 0 276.380 3.648 20 5 CHBDRO CC[C@H](C)C[C@@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173218570 1132411824 /nfs/dbraw/zinc/41/18/24/1132411824.db2.gz QQFZUYPQJRSTRN-BFHYXJOUSA-N 1 0 278.396 3.940 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@H](C)C1 ZINC001173226053 1132412757 /nfs/dbraw/zinc/41/27/57/1132412757.db2.gz KXAXSWUDWPDTLK-KGLIPLIRSA-N 1 0 276.380 3.648 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC001173234425 1132414267 /nfs/dbraw/zinc/41/42/67/1132414267.db2.gz OPGCNEBKICAMRM-CZUORRHYSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC2CCC(CC2)C1 ZINC001173231029 1132414357 /nfs/dbraw/zinc/41/43/57/1132414357.db2.gz IUIWMHLVBISLLP-JEYLPNPQSA-N 1 0 288.391 3.648 20 5 CHBDRO Cc1ccsc1C[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173211199 1132416161 /nfs/dbraw/zinc/41/61/61/1132416161.db2.gz RBDFTROMWZPLAO-GFCCVEGCSA-N 1 0 290.388 3.686 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)c1cccs1 ZINC001173211919 1132416287 /nfs/dbraw/zinc/41/62/87/1132416287.db2.gz VLASKHXTFCMBHM-NEPJUHHUSA-N 1 0 290.388 3.938 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(C)CC1 ZINC001173213521 1132416543 /nfs/dbraw/zinc/41/65/43/1132416543.db2.gz FYXUJCJVPFZYHP-OWYJLGKBSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC[C@H]1C ZINC001173213729 1132416729 /nfs/dbraw/zinc/41/67/29/1132416729.db2.gz HINYDLZUIBCMOD-XJKCOSOUSA-N 1 0 276.380 3.694 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C[NH+]3CC4CC(C4)C3)nc12 ZINC001232224440 1132438966 /nfs/dbraw/zinc/43/89/66/1132438966.db2.gz IDEQYTXEDXDSMO-UHFFFAOYSA-N 1 0 289.382 3.625 20 5 CHBDRO FC[C@H]1CCC[N@@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232227067 1132439500 /nfs/dbraw/zinc/43/95/00/1132439500.db2.gz GMSVUPJKBFWYAM-MRXNPFEDSA-N 1 0 295.361 3.717 20 5 CHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)CC(F)F ZINC000843418710 1132529672 /nfs/dbraw/zinc/52/96/72/1132529672.db2.gz JHXDCYAWEPRUPE-MRVPVSSYSA-N 1 0 292.713 3.629 20 5 CHBDRO O=[N+]([O-])c1cccc(Nc2cccc(C3CC[NH2+]CC3)c2)c1 ZINC001159756659 1132903784 /nfs/dbraw/zinc/90/37/84/1132903784.db2.gz CCFPFNCUENLALR-UHFFFAOYSA-N 1 0 297.358 3.805 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1ccc([C@@H]2CC[NH2+]C2)cc1 ZINC001159775557 1132906711 /nfs/dbraw/zinc/90/67/11/1132906711.db2.gz ITXJUQJTTUPKQI-CQSZACIVSA-N 1 0 297.358 3.724 20 5 CHBDRO CC(C)(C)C(=[NH2+])Nc1cc2cc[nH]c2c([N+](=O)[O-])c1 ZINC001162660199 1133101654 /nfs/dbraw/zinc/10/16/54/1133101654.db2.gz GMFWHNRMTDULCN-UHFFFAOYSA-N 1 0 260.297 3.511 20 5 CHBDRO CCCC[N@H+](C)C[C@@H](C)Nc1cc(C)c([N+](=O)[O-])cc1F ZINC001163423820 1133150367 /nfs/dbraw/zinc/15/03/67/1133150367.db2.gz SNOXXJHOHYTYSG-GFCCVEGCSA-N 1 0 297.374 3.575 20 5 CHBDRO [NH3+]C1CN(Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC001204854250 1133492943 /nfs/dbraw/zinc/49/29/43/1133492943.db2.gz JYRFOGABVNPRKW-UHFFFAOYSA-N 1 0 296.801 3.789 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1cccc(C[NH+](C)C)c1 ZINC001211288576 1134403751 /nfs/dbraw/zinc/40/37/51/1134403751.db2.gz YQVZBYDIASRAGN-UHFFFAOYSA-N 1 0 285.347 3.708 20 5 CHBDRO C[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000308717566 1134977579 /nfs/dbraw/zinc/97/75/79/1134977579.db2.gz YHJNOFPGDSLTKO-IUODEOHRSA-N 1 0 262.353 3.653 20 5 CHBDRO C[NH2+][C@H]1C[C@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001217955174 1135031030 /nfs/dbraw/zinc/03/10/30/1135031030.db2.gz XTPLGGIENSCTEO-SHTZXODSSA-N 1 0 278.355 3.517 20 5 CHBDRO c1ccc2nc3c(cccc3OC3CC4(C[NH2+]C4)C3)cc2c1 ZINC001218056914 1135051102 /nfs/dbraw/zinc/05/11/02/1135051102.db2.gz WEFKDAWWUHNRIC-UHFFFAOYSA-N 1 0 290.366 3.519 20 5 CHBDRO C[C@H]1C[C@@H](Oc2nccc3c4ccccc4ccc32)CC[NH2+]1 ZINC001218061341 1135051936 /nfs/dbraw/zinc/05/19/36/1135051936.db2.gz PKNDFVVHIMRFFC-ZFWWWQNUSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@@H]1C[C@H](Oc2cccc3cc4ccccc4nc32)CC[NH2+]1 ZINC001218058413 1135052759 /nfs/dbraw/zinc/05/27/59/1135052759.db2.gz WYLFGFUZJQQHQO-CZUORRHYSA-N 1 0 292.382 3.907 20 5 CHBDRO c1ccc2cc3cc(O[C@@H]4C[C@@H]5C[NH2+]C[C@H]45)ccc3cc2c1 ZINC001218332970 1135089960 /nfs/dbraw/zinc/08/99/60/1135089960.db2.gz XOMSHUJRTYKFQK-YZGWKJHDSA-N 1 0 289.378 3.980 20 5 CHBDRO c1ccc2cc3cc(O[C@H]4C=CC[NH2+]C4)ccc3cc2c1 ZINC001218334584 1135090019 /nfs/dbraw/zinc/09/00/19/1135090019.db2.gz PBDJSJUORLNSGB-IBGZPJMESA-N 1 0 275.351 3.900 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@@H]1C[C@H]2C[NH2+][C@@H]1C2 ZINC001218491103 1135116346 /nfs/dbraw/zinc/11/63/46/1135116346.db2.gz HRVCUKVEBMXIHO-JBBXEZCESA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OC(c1ccccc1)c1ccccc1 ZINC001223323032 1135328501 /nfs/dbraw/zinc/32/85/01/1135328501.db2.gz ZGVWLLQCFSWYKM-INIZCTEOSA-N 1 0 284.423 3.887 20 5 CHBDRO Cc1ccc2ccccc2c1CO[C@H](C)C[N+](C)(C)C ZINC001223821933 1135388509 /nfs/dbraw/zinc/38/85/09/1135388509.db2.gz ZBYQLNRHHHOBHF-OAHLLOKOSA-N 1 0 272.412 3.760 20 5 CHBDRO CCC[C@@H](OCCC[N+](C)(C)C)c1ccccc1 ZINC001224620689 1135462703 /nfs/dbraw/zinc/46/27/03/1135462703.db2.gz AQPDNANJOMYCSX-MRXNPFEDSA-N 1 0 250.406 3.641 20 5 CHBDRO C[C@@H](OCC[N+](C)(C)C)c1cc(Cl)ccc1Cl ZINC001224776357 1135481571 /nfs/dbraw/zinc/48/15/71/1135481571.db2.gz VTOXMNNLLUBBQH-SNVBAGLBSA-N 1 0 277.215 3.777 20 5 CHBDRO COc1ccc(CCCCCO[C@H](C)C[N+](C)(C)C)cc1 ZINC001224976233 1135497940 /nfs/dbraw/zinc/49/79/40/1135497940.db2.gz VGLDEBJDZSLPDI-MRXNPFEDSA-N 1 0 294.459 3.519 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cc(C(F)(F)F)ccc1Cl ZINC001225324862 1135543532 /nfs/dbraw/zinc/54/35/32/1135543532.db2.gz TUBORLWRONHTGG-SECBINFHSA-N 1 0 296.740 3.832 20 5 CHBDRO CCCCCc1ccc(O[C@@H](C)C[N+](C)(C)C)cc1 ZINC001226390540 1135691274 /nfs/dbraw/zinc/69/12/74/1135691274.db2.gz KBPHDRYZOQVQIV-HNNXBMFYSA-N 1 0 264.433 3.893 20 5 CHBDRO CCOc1ccc2ccc(O[C@H](C)C[N+](C)(C)C)cc2c1 ZINC001226842786 1135748709 /nfs/dbraw/zinc/74/87/09/1135748709.db2.gz ZXDCXYIGXWMZHI-CQSZACIVSA-N 1 0 288.411 3.712 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000348388415 529672274 /nfs/dbraw/zinc/67/22/74/529672274.db2.gz GSJOONBDQCLZIK-DYEKYZERSA-N 1 0 266.316 3.526 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000020522584 171235513 /nfs/dbraw/zinc/23/55/13/171235513.db2.gz JGLKRVQAMWBLOI-RYUDHWBXSA-N 1 0 250.342 3.598 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCc1ccco1)c1ccccc1[N+](=O)[O-] ZINC000020526228 171239423 /nfs/dbraw/zinc/23/94/23/171239423.db2.gz JKQIVBLLOXOEFH-QWHCGFSZSA-N 1 0 288.347 3.860 20 5 CHBDRO CCCCC[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000035135651 172003206 /nfs/dbraw/zinc/00/32/06/172003206.db2.gz RAVYYVPKWGRJQC-GFCCVEGCSA-N 1 0 250.342 3.653 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cccs1 ZINC000035139632 172007792 /nfs/dbraw/zinc/00/77/92/172007792.db2.gz VTNBHKIRNJGDGO-JTQLQIEISA-N 1 0 292.360 3.516 20 5 CHBDRO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000035307947 172121240 /nfs/dbraw/zinc/12/12/40/172121240.db2.gz XYYHGYUGJCLFFR-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000037031325 172899034 /nfs/dbraw/zinc/89/90/34/172899034.db2.gz YUMWEYSVLWTPSS-TZMCWYRMSA-N 1 0 262.353 3.653 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000071205776 176079730 /nfs/dbraw/zinc/07/97/30/176079730.db2.gz RAXHZAWITMDASI-CQDKDKBSSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2occc21)c1ccc([N+](=O)[O-])cc1 ZINC000037177173 260072622 /nfs/dbraw/zinc/07/26/22/260072622.db2.gz KBRQMMBKYFZHAB-NHYWBVRUSA-N 1 0 286.331 3.916 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccc([N+](=O)[O-])cc1 ZINC000037177174 260072811 /nfs/dbraw/zinc/07/28/11/260072811.db2.gz KBRQMMBKYFZHAB-ABAIWWIYSA-N 1 0 286.331 3.916 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H](C)C2 ZINC000180825194 260133167 /nfs/dbraw/zinc/13/31/67/260133167.db2.gz OOCLOETVRDQBOL-UGSOOPFHSA-N 1 0 296.370 3.926 20 5 CHBDRO Cc1nc(C)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000076866785 260166802 /nfs/dbraw/zinc/16/68/02/260166802.db2.gz CPHIJZUVDUBEAG-SECBINFHSA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC2CCCCCC2)c1 ZINC000089560162 260187953 /nfs/dbraw/zinc/18/79/53/260187953.db2.gz NNBWENBLEMMIEM-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000449096898 260212313 /nfs/dbraw/zinc/21/23/13/260212313.db2.gz KHDUGZGYHPUOKJ-JSGCOSHPSA-N 1 0 264.369 3.550 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000517962639 260327442 /nfs/dbraw/zinc/32/74/42/260327442.db2.gz YZWCAZCPVXXMKS-MFKMUULPSA-N 1 0 296.317 3.750 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000090217456 260339557 /nfs/dbraw/zinc/33/95/57/260339557.db2.gz GGOMYABLVDLPCO-NXEZZACHSA-N 1 0 290.285 3.895 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000161632083 261102946 /nfs/dbraw/zinc/10/29/46/261102946.db2.gz TUDXVXNTSVVLIP-JOYOIKCWSA-N 1 0 290.285 3.976 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]Cc2cccs2)cccc1[N+](=O)[O-] ZINC000156512769 261124306 /nfs/dbraw/zinc/12/43/06/261124306.db2.gz RXVCMIMMZDBGMT-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cncs1)c1cccc([N+](=O)[O-])c1 ZINC000161604682 261253851 /nfs/dbraw/zinc/25/38/51/261253851.db2.gz CCSAHKDIIHPGOX-GWCFXTLKSA-N 1 0 291.376 3.853 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000183350415 261485626 /nfs/dbraw/zinc/48/56/26/261485626.db2.gz IIOKOIVHDVMLFK-ZBFHGGJFSA-N 1 0 292.379 3.595 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCC2(F)F)cc1[N+](=O)[O-] ZINC000390592736 262225245 /nfs/dbraw/zinc/22/52/45/262225245.db2.gz SHAOQLGKSXTBGS-WCQYABFASA-N 1 0 298.333 3.989 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000020526307 262246127 /nfs/dbraw/zinc/24/61/27/262246127.db2.gz JDJRUSNCGDHEEM-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000525795589 262348193 /nfs/dbraw/zinc/34/81/93/262348193.db2.gz JJAJWCGIPFFOJN-MRXNPFEDSA-N 1 0 292.379 3.616 20 5 CHBDRO C[C@H](CC(F)(F)F)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000463732573 262393485 /nfs/dbraw/zinc/39/34/85/262393485.db2.gz YUNXLEWODXFMHI-DFVUYQKZSA-N 1 0 288.269 3.539 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccoc1)CCCC2 ZINC000417336798 263802519 /nfs/dbraw/zinc/80/25/19/263802519.db2.gz IGUBZXDRVAUQDP-INIZCTEOSA-N 1 0 286.331 3.745 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC(CC(F)F)C1 ZINC000425366756 264212415 /nfs/dbraw/zinc/21/24/15/264212415.db2.gz QWAVJFOVWFKXCM-WZUFQYTHSA-N 1 0 296.317 3.585 20 5 CHBDRO O=[N+]([O-])c1ccc(CCNc2cc[nH+]c3ccccc23)cc1 ZINC000314645328 265173548 /nfs/dbraw/zinc/17/35/48/265173548.db2.gz LLRUVROFWFMPCZ-UHFFFAOYSA-N 1 0 293.326 3.798 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1c2ccccc2O[C@@H]1C ZINC000367402348 267072129 /nfs/dbraw/zinc/07/21/29/267072129.db2.gz QWYDVUYDCVCCPG-PXAZEXFGSA-N 1 0 298.342 3.515 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCCC[C@@H]1OC)c1cccc([N+](=O)[O-])c1 ZINC000123174108 268004512 /nfs/dbraw/zinc/00/45/12/268004512.db2.gz QTCZFIJGEMDGEB-JYJNAYRXSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000537980707 327660485 /nfs/dbraw/zinc/66/04/85/327660485.db2.gz JIYFDCMVIVNFKC-DRZSPHRISA-N 1 0 264.369 3.988 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1CCCC1)CCC2 ZINC000574956396 327664844 /nfs/dbraw/zinc/66/48/44/327664844.db2.gz SDOHUKINFCITFH-MRXNPFEDSA-N 1 0 274.364 3.752 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCOc2ccccc21 ZINC000171129324 327752197 /nfs/dbraw/zinc/75/21/97/327752197.db2.gz OABVEQAWBVUOBU-OAHLLOKOSA-N 1 0 298.342 3.598 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000040444249 327907222 /nfs/dbraw/zinc/90/72/22/327907222.db2.gz VBMCZAVARWAMNR-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1cccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000040675997 328015517 /nfs/dbraw/zinc/01/55/17/328015517.db2.gz MTSIKXOIOYHUIO-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO CCC1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000040675857 328015560 /nfs/dbraw/zinc/01/55/60/328015560.db2.gz QFHKFKRDLQWZHD-UHFFFAOYSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000040675911 328015588 /nfs/dbraw/zinc/01/55/88/328015588.db2.gz QOFDDTVOMVAURZ-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000048335038 328053128 /nfs/dbraw/zinc/05/31/28/328053128.db2.gz CLKNPCVUUNWEJG-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C2CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000563446112 328066121 /nfs/dbraw/zinc/06/61/21/328066121.db2.gz MVSJTWKKOCQMME-LLVKDONJSA-N 1 0 292.379 3.833 20 5 CHBDRO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000283444060 328113948 /nfs/dbraw/zinc/11/39/48/328113948.db2.gz HARBIHSDIYMASE-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC(C2CCC2)C1 ZINC000571448200 328122547 /nfs/dbraw/zinc/12/25/47/328122547.db2.gz WMTZVBDDSGWHFU-MDWZMJQESA-N 1 0 286.375 3.730 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2CCC[C@@H]2C2CC2)cs1 ZINC000414485641 328185846 /nfs/dbraw/zinc/18/58/46/328185846.db2.gz PSRJUWIPQBGHGP-QWHCGFSZSA-N 1 0 280.393 3.572 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000281042575 328238588 /nfs/dbraw/zinc/23/85/88/328238588.db2.gz HAXWRHZCDUWMDZ-NWDGAFQWSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000281042577 328238590 /nfs/dbraw/zinc/23/85/90/328238590.db2.gz HAXWRHZCDUWMDZ-RYUDHWBXSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000281042572 328238605 /nfs/dbraw/zinc/23/86/05/328238605.db2.gz HAXWRHZCDUWMDZ-NEPJUHHUSA-N 1 0 298.333 3.989 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000049092600 328336550 /nfs/dbraw/zinc/33/65/50/328336550.db2.gz NSSYBWRYOPKLFK-UHTWSYAYSA-N 1 0 264.369 3.988 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC3(C2)CCCCC3)c1 ZINC000303833697 328359951 /nfs/dbraw/zinc/35/99/51/328359951.db2.gz AEZPXFYDVMFAKK-UHFFFAOYSA-N 1 0 274.364 3.751 20 5 CHBDRO C[C@@H]([NH2+]CCOC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000111636195 328370088 /nfs/dbraw/zinc/37/00/88/328370088.db2.gz VKJANCRZTAGNFC-CYBMUJFWSA-N 1 0 292.379 3.595 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[N@H+](CCC1CCCC1)C2 ZINC000535246352 328397880 /nfs/dbraw/zinc/39/78/80/328397880.db2.gz JGHRQLFEIPIPNV-UHFFFAOYSA-N 1 0 274.364 3.533 20 5 CHBDRO CCCC[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000050886719 328450655 /nfs/dbraw/zinc/45/06/55/328450655.db2.gz HJPMDJJGTKJWTL-NEPJUHHUSA-N 1 0 250.342 3.824 20 5 CHBDRO CCC[C@@H]([NH2+]CCOC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000308733234 328515647 /nfs/dbraw/zinc/51/56/47/328515647.db2.gz KJINPWWFIUGHBN-OAHLLOKOSA-N 1 0 294.395 3.841 20 5 CHBDRO CC1(C)CCC[C@@H]1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000388834391 328530461 /nfs/dbraw/zinc/53/04/61/328530461.db2.gz GQECIODJRHZYLB-CYBMUJFWSA-N 1 0 262.353 3.511 20 5 CHBDRO CC(C)OC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000530926288 326897041 /nfs/dbraw/zinc/89/70/41/326897041.db2.gz QIOWAKCMPPSBLR-CYBMUJFWSA-N 1 0 292.379 3.545 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CSC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000338783273 327006504 /nfs/dbraw/zinc/00/65/04/327006504.db2.gz UTXVZNHRFCKZNS-STQMWFEESA-N 1 0 280.393 3.530 20 5 CHBDRO CC[C@@H]1CC[C@@H]1[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000558252331 327081637 /nfs/dbraw/zinc/08/16/37/327081637.db2.gz JYGWSZUIPLDABY-SCRDCRAPSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@H]3C[C@H]32)cc1[N+](=O)[O-] ZINC000558699785 327115670 /nfs/dbraw/zinc/11/56/70/327115670.db2.gz QZAOTOJYNAISNL-FAAHXZRKSA-N 1 0 274.364 3.742 20 5 CHBDRO C[C@@H]1CCC[C@@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000088195111 327130459 /nfs/dbraw/zinc/13/04/59/327130459.db2.gz RIUBXHRJTWCZQF-CHWSQXEVSA-N 1 0 262.353 3.511 20 5 CHBDRO CC(C)(C[NH2+]Cc1csc([N+](=O)[O-])c1)C1=CCCC1 ZINC000308768373 332784271 /nfs/dbraw/zinc/78/42/71/332784271.db2.gz IJGDTXHWXIDQMI-UHFFFAOYSA-N 1 0 280.393 3.882 20 5 CHBDRO CC[C@H]([NH2+]CCCC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000163359985 327612508 /nfs/dbraw/zinc/61/25/08/327612508.db2.gz MOURSTFTWBYJHW-HNNXBMFYSA-N 1 0 262.353 3.826 20 5 CHBDRO Cc1cccc(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000051669115 328627077 /nfs/dbraw/zinc/62/70/77/328627077.db2.gz ARTBSBOBMZGNDS-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCCC2)s1 ZINC000535778500 328631134 /nfs/dbraw/zinc/63/11/34/328631134.db2.gz FFBJTCLZZHXNTN-UHFFFAOYSA-N 1 0 288.372 3.919 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2)cc1 ZINC000053149522 328663495 /nfs/dbraw/zinc/66/34/95/328663495.db2.gz PGXMRIJVSVMMIV-UHFFFAOYSA-N 1 0 294.713 3.677 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1ccc(F)cc1[N+](=O)[O-] ZINC000130242008 328768114 /nfs/dbraw/zinc/76/81/14/328768114.db2.gz VMPKSMOXAHYLQN-LBPRGKRZSA-N 1 0 297.374 3.656 20 5 CHBDRO CC[C@@H]([NH2+]Cc1occc1C)c1cccc([N+](=O)[O-])c1 ZINC000267297498 328839774 /nfs/dbraw/zinc/83/97/74/328839774.db2.gz TUCYAXWTQTXAOK-CQSZACIVSA-N 1 0 274.320 3.737 20 5 CHBDRO C[C@@H]1CCC[C@H](C[NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000507939338 332829932 /nfs/dbraw/zinc/82/99/32/332829932.db2.gz PRYKLNQYTQDWBX-HIFRSBDPSA-N 1 0 276.380 3.553 20 5 CHBDRO COc1ccc(C[NH2+]CC2CCCCCC2)cc1[N+](=O)[O-] ZINC000389790691 328953388 /nfs/dbraw/zinc/95/33/88/328953388.db2.gz XKLXIDRKEQYMEJ-UHFFFAOYSA-N 1 0 292.379 3.663 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC2(CC2)C1 ZINC000187002770 329351259 /nfs/dbraw/zinc/35/12/59/329351259.db2.gz SDUQYYWZTUFMIJ-GFCCVEGCSA-N 1 0 260.337 3.532 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000035253371 330244289 /nfs/dbraw/zinc/24/42/89/330244289.db2.gz WVVSUKIIHUTOLR-RISCZKNCSA-N 1 0 262.353 3.572 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000536870726 330263858 /nfs/dbraw/zinc/26/38/58/330263858.db2.gz PLKWMXKLVDJUKJ-DRZSPHRISA-N 1 0 264.369 3.988 20 5 CHBDRO Cc1ccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000536870688 330263986 /nfs/dbraw/zinc/26/39/86/330263986.db2.gz PBPFNWRSGOQAFS-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000105461422 330326545 /nfs/dbraw/zinc/32/65/45/330326545.db2.gz JKHKYSNXOKWZOU-OQHXTRMZSA-N 1 0 298.342 3.664 20 5 CHBDRO Cc1ccc(C[NH2+]C2(C)CCCCC2)cc1[N+](=O)[O-] ZINC000045042777 330337324 /nfs/dbraw/zinc/33/73/24/330337324.db2.gz XKHRWRWFDCXLFS-UHFFFAOYSA-N 1 0 262.353 3.716 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2C[C@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000424334397 330342892 /nfs/dbraw/zinc/34/28/92/330342892.db2.gz VKTNTYLDFINJRO-TUKIKUTGSA-N 1 0 274.364 3.742 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C(C)C)C1CCCC1 ZINC000533369158 330359985 /nfs/dbraw/zinc/35/99/85/330359985.db2.gz QXIOMRYDJUUWOF-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO C[C@H]1CC([NH2+]Cc2csc([N+](=O)[O-])c2)C[C@H](C)C1 ZINC000084461343 330361847 /nfs/dbraw/zinc/36/18/47/330361847.db2.gz FFLGHMGNKWGZIE-NXEZZACHSA-N 1 0 268.382 3.571 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000515509593 330478921 /nfs/dbraw/zinc/47/89/21/330478921.db2.gz SMPUUCYFHLZQGS-FFSVYQOJSA-N 1 0 274.364 3.600 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(C)n1 ZINC000429266578 330541461 /nfs/dbraw/zinc/54/14/61/330541461.db2.gz JBCQVXSKVZSLMU-UHFFFAOYSA-N 1 0 299.374 3.632 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CC23CCCC3)cccc1[N+](=O)[O-] ZINC000429433671 330546436 /nfs/dbraw/zinc/54/64/36/330546436.db2.gz WEJWWUDXRYSRGR-DOMZBBRYSA-N 1 0 274.364 3.887 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)C1CCCCC1 ZINC000430217686 330564477 /nfs/dbraw/zinc/56/44/77/330564477.db2.gz KDBLBWDZDGNOEK-LBPRGKRZSA-N 1 0 292.379 3.662 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]CCC2CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433290166 330622525 /nfs/dbraw/zinc/62/25/25/330622525.db2.gz VYAXZAPTSWRXQW-OAHLLOKOSA-N 1 0 274.364 3.707 20 5 CHBDRO CC1(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433290280 330622602 /nfs/dbraw/zinc/62/26/02/330622602.db2.gz RDERVTOILHIWPY-CQSZACIVSA-N 1 0 274.364 3.707 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCCS2)cc1[N+](=O)[O-] ZINC000156356227 330730443 /nfs/dbraw/zinc/73/04/43/330730443.db2.gz VFXGPUTXBYHDBR-TZMCWYRMSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1cc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000449244412 330909345 /nfs/dbraw/zinc/90/93/45/330909345.db2.gz SHLGHVLNHGWDMW-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CCC1CC1 ZINC000449246523 330909487 /nfs/dbraw/zinc/90/94/87/330909487.db2.gz BVPYSFWMCPPHGK-QWHCGFSZSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H](F)CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553151 331033910 /nfs/dbraw/zinc/03/39/10/331033910.db2.gz XPYAJBMUILJVJM-JSGCOSHPSA-N 1 0 280.343 3.522 20 5 CHBDRO C[C@H](F)CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553150 331034022 /nfs/dbraw/zinc/03/40/22/331034022.db2.gz XPYAJBMUILJVJM-GXTWGEPZSA-N 1 0 280.343 3.522 20 5 CHBDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000452031847 331051041 /nfs/dbraw/zinc/05/10/41/331051041.db2.gz BJYIBIDUGZSQGR-XNRPHZJLSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1(c2ccccc2)CC1 ZINC000453177925 331097554 /nfs/dbraw/zinc/09/75/54/331097554.db2.gz RQHMNHVLEWOFNE-AWEZNQCLSA-N 1 0 296.370 3.805 20 5 CHBDRO COC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CCCC1 ZINC000453224384 331103489 /nfs/dbraw/zinc/10/34/89/331103489.db2.gz NACXRCUAJRPWKJ-ZDUSSCGKSA-N 1 0 292.379 3.513 20 5 CHBDRO CC[C@@H](N[C@@H](CC)c1cccc([N+](=O)[O-])c1)C(F)F ZINC000453242962 331106407 /nfs/dbraw/zinc/10/64/07/331106407.db2.gz IRHHIWFCRJWPGM-NWDGAFQWSA-N 1 0 272.295 3.679 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459774310 331300142 /nfs/dbraw/zinc/30/01/42/331300142.db2.gz ITVCNXWMSUNVFW-ICCXJUOJSA-N 1 0 280.755 3.526 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000459797142 331301614 /nfs/dbraw/zinc/30/16/14/331301614.db2.gz ZXBRGIAJEGPZQF-MPTQWLOMSA-N 1 0 274.364 3.742 20 5 CHBDRO CC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000463520002 331348894 /nfs/dbraw/zinc/34/88/94/331348894.db2.gz WATFYKDVRBPNJH-NSHDSACASA-N 1 0 298.358 3.609 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]C[C@H]1CC=CCC1 ZINC000478226787 331701116 /nfs/dbraw/zinc/70/11/16/331701116.db2.gz JBXJICTURLCTLU-LBPRGKRZSA-N 1 0 294.782 3.737 20 5 CHBDRO CC1CCC(C)([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000478299539 331703157 /nfs/dbraw/zinc/70/31/57/331703157.db2.gz QDLQKZRDKNZPFX-UHFFFAOYSA-N 1 0 280.343 3.792 20 5 CHBDRO CCc1cccnc1[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000478497910 331707499 /nfs/dbraw/zinc/70/74/99/331707499.db2.gz LETXCIPNYBAMLP-ZDUSSCGKSA-N 1 0 299.374 3.711 20 5 CHBDRO COCC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000511052600 332925898 /nfs/dbraw/zinc/92/58/98/332925898.db2.gz YPZHRBZFTLEYHF-DOMZBBRYSA-N 1 0 294.395 3.697 20 5 CHBDRO COCC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000511052605 332925946 /nfs/dbraw/zinc/92/59/46/332925946.db2.gz YPZHRBZFTLEYHF-WFASDCNBSA-N 1 0 294.395 3.697 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000489126460 332042323 /nfs/dbraw/zinc/04/23/23/332042323.db2.gz BVYPFSLDQXVETQ-ZDUSSCGKSA-N 1 0 276.380 3.854 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@H](C)[C@H](C)C1 ZINC000490036533 332077881 /nfs/dbraw/zinc/07/78/81/332077881.db2.gz FVJOFTXDIRHTCX-FRRDWIJNSA-N 1 0 262.353 3.552 20 5 CHBDRO COc1cc(C[N@@H+]2CCCC(C)(C)CC2)ccc1[N+](=O)[O-] ZINC000490055326 332079109 /nfs/dbraw/zinc/07/91/09/332079109.db2.gz BLILEGXUELIINT-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO CCOc1cc(C[N@H+](CC(C)C)C2CC2)ccc1[N+](=O)[O-] ZINC000492356853 332393983 /nfs/dbraw/zinc/39/39/83/332393983.db2.gz LODNUJWJKPNAFD-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494445571 332473439 /nfs/dbraw/zinc/47/34/39/332473439.db2.gz JTCRTMVUBCRKIK-QMMMGPOBSA-N 1 0 276.258 3.502 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000252032054 334373310 /nfs/dbraw/zinc/37/33/10/334373310.db2.gz ZLBDWOJQOKPNKC-QJPTWQEYSA-N 1 0 250.342 3.680 20 5 CHBDRO CCSCCC[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000502377926 332655608 /nfs/dbraw/zinc/65/56/08/332655608.db2.gz UMQGCVSXUVZLQR-ZDUSSCGKSA-N 1 0 296.436 3.649 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCC23CCC3)cc1 ZINC000502450009 332660299 /nfs/dbraw/zinc/66/02/99/332660299.db2.gz FOTYXVGZQXLBPZ-MRXNPFEDSA-N 1 0 288.391 3.840 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1 ZINC000503040991 332679454 /nfs/dbraw/zinc/67/94/54/332679454.db2.gz CWZLYRYHWOMULK-SJLPKXTDSA-N 1 0 296.370 3.531 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000504930415 332725576 /nfs/dbraw/zinc/72/55/76/332725576.db2.gz PTRUSKIOCKZXRI-OLZOCXBDSA-N 1 0 294.395 3.936 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000504930414 332725652 /nfs/dbraw/zinc/72/56/52/332725652.db2.gz PTRUSKIOCKZXRI-CHWSQXEVSA-N 1 0 294.395 3.936 20 5 CHBDRO CCC(CC)[C@H](CNc1ccc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000513101868 333004384 /nfs/dbraw/zinc/00/43/84/333004384.db2.gz IRAMLCZHGWELJO-HNNXBMFYSA-N 1 0 297.374 3.512 20 5 CHBDRO CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000513655106 333029648 /nfs/dbraw/zinc/02/96/48/333029648.db2.gz LBEUXFCVPXOIAB-CQDKDKBSSA-N 1 0 262.353 3.680 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCCC(F)(F)C1 ZINC000513897386 333048121 /nfs/dbraw/zinc/04/81/21/333048121.db2.gz PWXSWGYKKRMVCO-GFCCVEGCSA-N 1 0 298.333 3.852 20 5 CHBDRO COc1ccc(C[NH2+]C[C@@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000223449145 333208093 /nfs/dbraw/zinc/20/80/93/333208093.db2.gz SZGMZCULASPXBA-CHWSQXEVSA-N 1 0 292.379 3.519 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000523550812 333332598 /nfs/dbraw/zinc/33/25/98/333332598.db2.gz ALJOFIOCYAMEPZ-AWEZNQCLSA-N 1 0 262.353 3.749 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000235300799 333367509 /nfs/dbraw/zinc/36/75/09/333367509.db2.gz ASTYUWBEDQQDOX-YPMHNXCESA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]([NH2+]CCCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000037177038 333507850 /nfs/dbraw/zinc/50/78/50/333507850.db2.gz XHYOHGJLVHSKJI-CQSZACIVSA-N 1 0 284.359 3.878 20 5 CHBDRO CC[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000539084769 333656726 /nfs/dbraw/zinc/65/67/26/333656726.db2.gz UOZJXGWSDDBXNX-INIZCTEOSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)CC2 ZINC000540150391 333713283 /nfs/dbraw/zinc/71/32/83/333713283.db2.gz GOIQIDPWJIHPGG-SFHVURJKSA-N 1 0 296.370 3.723 20 5 CHBDRO CC(C)=CCC[C@H](C)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000540150827 333713600 /nfs/dbraw/zinc/71/36/00/333713600.db2.gz LWBBLUMECOIPAH-AWEZNQCLSA-N 1 0 276.380 3.862 20 5 CHBDRO CCCC[C@H](CC)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000069378306 333759623 /nfs/dbraw/zinc/75/96/23/333759623.db2.gz SUKDJEGLQQPNOZ-AWEZNQCLSA-N 1 0 264.369 3.696 20 5 CHBDRO CCCC[C@@H](COC)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000134055615 334079020 /nfs/dbraw/zinc/07/90/20/334079020.db2.gz SXVLACKOOMIONY-KGLIPLIRSA-N 1 0 294.395 3.759 20 5 CHBDRO CS[C@H]1CCCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000134596639 334096577 /nfs/dbraw/zinc/09/65/77/334096577.db2.gz LUTILWQSUCVTOI-DOMZBBRYSA-N 1 0 294.420 3.873 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCC(C)(C)O1 ZINC000547980615 334133203 /nfs/dbraw/zinc/13/32/03/334133203.db2.gz AUFKRYWJJHATJZ-TZMCWYRMSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000080347404 334170653 /nfs/dbraw/zinc/17/06/53/334170653.db2.gz MMGUDJKPOHEADJ-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H](C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000081046040 334177276 /nfs/dbraw/zinc/17/72/76/334177276.db2.gz ZLPUPJNCKNGHHS-DOMZBBRYSA-N 1 0 264.369 3.928 20 5 CHBDRO Cc1cccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549172097 334186897 /nfs/dbraw/zinc/18/68/97/334186897.db2.gz QPFVKTHYWBMKEB-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO C[C@H]([NH2+]CC12CCC(CC1)C2)c1ccc([N+](=O)[O-])cc1 ZINC000550126486 334213696 /nfs/dbraw/zinc/21/36/96/334213696.db2.gz WLMSLTOCKIMXMC-FUJMWEONSA-N 1 0 274.364 3.826 20 5 CHBDRO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCC[C@H]21 ZINC000550444431 334222674 /nfs/dbraw/zinc/22/26/74/334222674.db2.gz VKFSCVIINCJXFI-HUUCEWRRSA-N 1 0 274.364 3.605 20 5 CHBDRO C[N@@H+]1CCCC[C@H]1CCSc1cccc([N+](=O)[O-])c1 ZINC000551462280 334250976 /nfs/dbraw/zinc/25/09/76/334250976.db2.gz ZZSSFOJSBSTPHH-LBPRGKRZSA-N 1 0 280.393 3.561 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CC2CCC1CC2 ZINC000552083810 334287037 /nfs/dbraw/zinc/28/70/37/334287037.db2.gz YZIUKKGGDOCMQN-YHUUQREXSA-N 1 0 286.375 3.776 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@H]1C ZINC000552086311 334287728 /nfs/dbraw/zinc/28/77/28/334287728.db2.gz CFMOLMLVSOJSSX-UPJWGTAASA-N 1 0 294.420 3.854 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2(C)CCC2)cccc1[N+](=O)[O-] ZINC000090219893 334358708 /nfs/dbraw/zinc/35/87/08/334358708.db2.gz RPPVBOXPZWPXIG-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000251816018 334370259 /nfs/dbraw/zinc/37/02/59/334370259.db2.gz MQIPGLOGXFOXFG-YRGRVCCFSA-N 1 0 292.379 3.518 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000554363865 334424801 /nfs/dbraw/zinc/42/48/01/334424801.db2.gz OFLSFNTXIDQSJS-UONOGXRCSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000554738876 334450227 /nfs/dbraw/zinc/45/02/27/334450227.db2.gz MUXCOWQTSYXXSY-CXAGYDPISA-N 1 0 296.370 3.975 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccoc1 ZINC000094868962 334506788 /nfs/dbraw/zinc/50/67/88/334506788.db2.gz WVPDOCHAZJLBNH-WDEREUQCSA-N 1 0 260.293 3.600 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccoc1 ZINC000094868960 334506871 /nfs/dbraw/zinc/50/68/71/334506871.db2.gz WVPDOCHAZJLBNH-QWRGUYRKSA-N 1 0 260.293 3.600 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCc2ccsc2)cccc1[N+](=O)[O-] ZINC000177727292 335382416 /nfs/dbraw/zinc/38/24/16/335382416.db2.gz IEHAJXAGSKLDIF-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCO1 ZINC000578637209 335656932 /nfs/dbraw/zinc/65/69/32/335656932.db2.gz PBCJQGJGSHLOQY-KCQAQPDRSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC000581196059 336023028 /nfs/dbraw/zinc/02/30/28/336023028.db2.gz CZQYNBNKOPLIMW-INIZCTEOSA-N 1 0 296.370 3.974 20 5 CHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000383626635 336115997 /nfs/dbraw/zinc/11/59/97/336115997.db2.gz UIFHWZUPYNSXFD-YPMHNXCESA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H](CCC(C)(C)C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000386061101 336165433 /nfs/dbraw/zinc/16/54/33/336165433.db2.gz XHPLLQSTJWXAHF-ZDUSSCGKSA-N 1 0 278.396 3.942 20 5 CHBDRO CC(C)([NH2+]Cc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000291746857 519323697 /nfs/dbraw/zinc/32/36/97/519323697.db2.gz PRVVISZZLNDKMY-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO CC(C)([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000299632147 519324337 /nfs/dbraw/zinc/32/43/37/519324337.db2.gz NRUCJWPOIYLLJE-UHFFFAOYSA-N 1 0 276.361 3.681 20 5 CHBDRO CC(C)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000299656572 519324634 /nfs/dbraw/zinc/32/46/34/519324634.db2.gz UQTKJKHWMITGGB-UHFFFAOYSA-N 1 0 270.332 3.620 20 5 CHBDRO CCC[C@@H]([NH2+]C1CC(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000163379953 520768443 /nfs/dbraw/zinc/76/84/43/520768443.db2.gz IBNJHUWCCYELMZ-ABIUDSBCSA-N 1 0 262.353 3.824 20 5 CHBDRO CCC[C@H]([NH2+]Cc1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000020141425 521162991 /nfs/dbraw/zinc/16/29/91/521162991.db2.gz NBRQCFNNPHJENL-INIZCTEOSA-N 1 0 285.347 3.621 20 5 CHBDRO CC[C@H]([NH2+]C[C@@]1(C)CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000122012995 522623356 /nfs/dbraw/zinc/62/33/56/522623356.db2.gz WNTSDPHWCZVIAY-LSDHHAIUSA-N 1 0 294.420 3.921 20 5 CHBDRO COC1(C[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000277104429 522640809 /nfs/dbraw/zinc/64/08/09/522640809.db2.gz LXDUAHXAFLMXEK-STQMWFEESA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccoc1C)c1cccc([N+](=O)[O-])c1 ZINC000358022422 522660898 /nfs/dbraw/zinc/66/08/98/522660898.db2.gz VZRVMCULSFQCLB-HNNXBMFYSA-N 1 0 274.320 3.737 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000063152254 522887592 /nfs/dbraw/zinc/88/75/92/522887592.db2.gz XGBHPVYIXNAOCS-CQSZACIVSA-N 1 0 276.361 3.897 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)CC12CCC2 ZINC000357019728 524297668 /nfs/dbraw/zinc/29/76/68/524297668.db2.gz CSRAAEKVVPFBLV-NSHDSACASA-N 1 0 280.393 3.668 20 5 CHBDRO C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000337512849 524429218 /nfs/dbraw/zinc/42/92/18/524429218.db2.gz WNWCIGWQRFHWGU-LYRGGWFBSA-N 1 0 274.364 3.750 20 5 CHBDRO Cc1ccccc1C(C)(C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000292916326 525074867 /nfs/dbraw/zinc/07/48/67/525074867.db2.gz HUPQRYMBCPUJQL-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc([N+](=O)[O-])cc1 ZINC000130587467 525649598 /nfs/dbraw/zinc/64/95/98/525649598.db2.gz NJRUIQQKHGTNJA-BDJLRTHQSA-N 1 0 298.342 3.639 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000156728955 525744128 /nfs/dbraw/zinc/74/41/28/525744128.db2.gz FEHVGBPRKHXJJV-NFAWXSAZSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccsc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291669346 525857743 /nfs/dbraw/zinc/85/77/43/525857743.db2.gz GFEWQOWGYJUOQK-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO C[C@H](c1cccs1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774591 526153122 /nfs/dbraw/zinc/15/31/22/526153122.db2.gz WAJMFFJFRLVPRL-SNVBAGLBSA-N 1 0 294.351 3.988 20 5 CHBDRO Cc1ncc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000040997555 527275859 /nfs/dbraw/zinc/27/58/59/527275859.db2.gz ZAFCEDLJRXISAY-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@H]2CC[C@@H](F)C2)c2cc([N+](=O)[O-])ccc21 ZINC000331636485 527748728 /nfs/dbraw/zinc/74/87/28/527748728.db2.gz SJCHWJGXQIMIDY-ZETOZRRWSA-N 1 0 292.354 3.797 20 5 CHBDRO CC[C@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113312365 1125494352 /nfs/dbraw/zinc/49/43/52/1125494352.db2.gz BUYOFCSPIKMGHI-JTQLQIEISA-N 1 0 291.376 3.606 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449100329 1122844231 /nfs/dbraw/zinc/84/42/31/1122844231.db2.gz WEVGCAFRVBIWGN-XQQFMLRXSA-N 1 0 264.369 3.550 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cc(Cl)cc(C(F)(F)F)c1 ZINC001227845631 1131749383 /nfs/dbraw/zinc/74/93/83/1131749383.db2.gz MFVRZKRFYQTRKT-SECBINFHSA-N 1 0 296.740 3.832 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC000251997769 1125533195 /nfs/dbraw/zinc/53/31/95/1125533195.db2.gz ZSUFFIFHQVRPFH-YRGRVCCFSA-N 1 0 292.379 3.518 20 5 CHBDRO CN1CC[C@@H]([NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000729682669 1125548386 /nfs/dbraw/zinc/54/83/86/1125548386.db2.gz YOEQDSZFBZCWBH-QGZVFWFLSA-N 1 0 290.410 3.787 20 5 CHBDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC000885926576 1125627249 /nfs/dbraw/zinc/62/72/49/1125627249.db2.gz GAASNDKQRVQHRM-MRXNPFEDSA-N 1 0 297.358 3.635 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[N@H+](CC1CC1)C1CCCCC1 ZINC000885983690 1125633134 /nfs/dbraw/zinc/63/31/34/1125633134.db2.gz MPTDNKGYTKABAJ-UHFFFAOYSA-N 1 0 289.379 3.535 20 5 CHBDRO CCc1ccc(C(C)(C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886111619 1125651317 /nfs/dbraw/zinc/65/13/17/1125651317.db2.gz FOWFVWYVFSAJIQ-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3cccnc32)cc1[N+](=O)[O-] ZINC000886550118 1125688362 /nfs/dbraw/zinc/68/83/62/1125688362.db2.gz SLUYATTVMKDVFR-DOMZBBRYSA-N 1 0 297.358 3.636 20 5 CHBDRO Cc1ccc([C@@H](C)C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000237367145 1125688954 /nfs/dbraw/zinc/68/89/54/1125688954.db2.gz SAXVIWGLAMMWRL-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000169130590 1125704553 /nfs/dbraw/zinc/70/45/53/1125704553.db2.gz BZKLSHULUZOHGB-MRXNPFEDSA-N 1 0 288.322 3.975 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CC2)CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000886824595 1125721609 /nfs/dbraw/zinc/72/16/09/1125721609.db2.gz CGZLXIWRWVXUBT-SNVBAGLBSA-N 1 0 278.327 3.717 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000090035850 1125738590 /nfs/dbraw/zinc/73/85/90/1125738590.db2.gz SMJVUIZKBWUZND-CHWSQXEVSA-N 1 0 260.337 3.663 20 5 CHBDRO Cc1cc(NC[C@H]2C[C@@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000159447489 1126741551 /nfs/dbraw/zinc/74/15/51/1126741551.db2.gz OFBIAKZBAUIACP-GXSJLCMTSA-N 1 0 271.320 3.519 20 5 CHBDRO Cc1cc(NC[C@H]2C[C@H]2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000159447761 1126741607 /nfs/dbraw/zinc/74/16/07/1126741607.db2.gz OFBIAKZBAUIACP-MWLCHTKSSA-N 1 0 271.320 3.519 20 5 CHBDRO CC[N@H+](CC1CCC1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000483131152 1126768947 /nfs/dbraw/zinc/76/89/47/1126768947.db2.gz YVEBBNPAEFMNOD-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO CC[C@@H]([NH2+]CCCOCC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000036721135 1126799232 /nfs/dbraw/zinc/79/92/32/1126799232.db2.gz ZDUHTABDSGTJEK-MRXNPFEDSA-N 1 0 294.395 3.698 20 5 CHBDRO C[C@H]1CC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000793347762 1130548258 /nfs/dbraw/zinc/54/82/58/1130548258.db2.gz ZJWHYMAORJICPD-WDEREUQCSA-N 1 0 282.771 3.774 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CC[C@@H]2C2CC2)c1 ZINC000797905814 1126832067 /nfs/dbraw/zinc/83/20/67/1126832067.db2.gz PTSQKPPOHHVLLL-OCCSQVGLSA-N 1 0 280.755 3.526 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@@H]2C2CC2)c1 ZINC000797905815 1126831846 /nfs/dbraw/zinc/83/18/46/1126831846.db2.gz PTSQKPPOHHVLLL-TZMCWYRMSA-N 1 0 280.755 3.526 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCCc2ccccn2)cccc1[N+](=O)[O-] ZINC000181487783 1126856833 /nfs/dbraw/zinc/85/68/33/1126856833.db2.gz AZRLUDREQUOKRM-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccnc1 ZINC000192609294 1126962123 /nfs/dbraw/zinc/96/21/23/1126962123.db2.gz KZOQTOPNKGBZHW-SJCJKPOMSA-N 1 0 297.358 3.718 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccnc1 ZINC000192609313 1126962401 /nfs/dbraw/zinc/96/24/01/1126962401.db2.gz KZOQTOPNKGBZHW-PXAZEXFGSA-N 1 0 297.358 3.718 20 5 CHBDRO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000266806012 1126988116 /nfs/dbraw/zinc/98/81/16/1126988116.db2.gz UBRTZMGRMPVCCT-CYBMUJFWSA-N 1 0 282.343 3.935 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1 ZINC000323740476 1127053785 /nfs/dbraw/zinc/05/37/85/1127053785.db2.gz QAIOKUBPGDQOJU-LBPRGKRZSA-N 1 0 268.744 3.526 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000042814598 1127076765 /nfs/dbraw/zinc/07/67/65/1127076765.db2.gz FTTYANXRPQTOMD-CVEARBPZSA-N 1 0 292.379 3.595 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)C[C@@H]1CCCO1 ZINC000156752266 1127179551 /nfs/dbraw/zinc/17/95/51/1127179551.db2.gz JVUCJRMLDHBAOE-IPYPFGDCSA-N 1 0 292.379 3.511 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001170845409 1131128688 /nfs/dbraw/zinc/12/86/88/1131128688.db2.gz BEMJHWDJYILJKV-CYBMUJFWSA-N 1 0 264.369 3.914 20 5 CHBDRO C[C@@H](CF)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000588930512 1127207537 /nfs/dbraw/zinc/20/75/37/1127207537.db2.gz KABMGVKYNGPERF-JTQLQIEISA-N 1 0 294.351 3.771 20 5 CHBDRO CC[C@H](CSC)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000589206624 1127216339 /nfs/dbraw/zinc/21/63/39/1127216339.db2.gz YBHGOOWJDCYQKO-RCQQVGEISA-N 1 0 294.420 3.681 20 5 CHBDRO CC[C@@H](CSC)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000589206622 1127216509 /nfs/dbraw/zinc/21/65/09/1127216509.db2.gz YBHGOOWJDCYQKO-KGXGESDWSA-N 1 0 294.420 3.681 20 5 CHBDRO CC(C)c1ccc(C[NH+]2CC(C3CC3)C2)cc1[N+](=O)[O-] ZINC000589736773 1127234899 /nfs/dbraw/zinc/23/48/99/1127234899.db2.gz LJWZENRZVQNPMC-UHFFFAOYSA-N 1 0 274.364 3.560 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000591255938 1127289921 /nfs/dbraw/zinc/28/99/21/1127289921.db2.gz KEMDHVQUNGDQMT-HOSYDEDBSA-N 1 0 284.306 3.598 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C1(C2CCC2)CC1 ZINC000593083141 1127372461 /nfs/dbraw/zinc/37/24/61/1127372461.db2.gz ZHHLILZJBNUYTH-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000592399608 1127373087 /nfs/dbraw/zinc/37/30/87/1127373087.db2.gz NYNAFWBXQQGEGR-XDQVBPFNSA-N 1 0 274.364 3.742 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761045767 1127408383 /nfs/dbraw/zinc/40/83/83/1127408383.db2.gz QZLYSMHFCFWEBS-NXEZZACHSA-N 1 0 288.269 3.540 20 5 CHBDRO C[C@@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000594725394 1127429955 /nfs/dbraw/zinc/42/99/55/1127429955.db2.gz KCAAHBLWZMLFOW-MFKMUULPSA-N 1 0 284.306 3.681 20 5 CHBDRO CC[C@](C)([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000594982068 1127442880 /nfs/dbraw/zinc/44/28/80/1127442880.db2.gz YOXLZXAIIRCZOI-HNNXBMFYSA-N 1 0 262.353 3.572 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CCCCC1 ZINC000595006370 1127445629 /nfs/dbraw/zinc/44/56/29/1127445629.db2.gz JLZQTFXNTXEKMY-LLVKDONJSA-N 1 0 278.352 3.587 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CC12CCCC2 ZINC000595044179 1127450686 /nfs/dbraw/zinc/45/06/86/1127450686.db2.gz LTODJTALJWHWNK-NHYWBVRUSA-N 1 0 290.363 3.587 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000595076053 1127453063 /nfs/dbraw/zinc/45/30/63/1127453063.db2.gz CWABLCBFAQMOJZ-MRXNPFEDSA-N 1 0 288.347 3.861 20 5 CHBDRO C[C@@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595081269 1127453585 /nfs/dbraw/zinc/45/35/85/1127453585.db2.gz RFOMZYOUEFMZGK-MFKMUULPSA-N 1 0 284.306 3.681 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000595081150 1127453658 /nfs/dbraw/zinc/45/36/58/1127453658.db2.gz QHKPCSNUKMEWDU-DOMZBBRYSA-N 1 0 276.380 3.694 20 5 CHBDRO CC[C@@H]([NH2+]CCCc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000595093431 1127454903 /nfs/dbraw/zinc/45/49/03/1127454903.db2.gz JKHMEYWXXUQQHZ-MRXNPFEDSA-N 1 0 288.347 3.861 20 5 CHBDRO CC(C)CC1([NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000595094822 1127455183 /nfs/dbraw/zinc/45/51/83/1127455183.db2.gz JMJRBSCMTSVRQL-CQSZACIVSA-N 1 0 274.364 3.750 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCc1ccco1 ZINC000595094603 1127455366 /nfs/dbraw/zinc/45/53/66/1127455366.db2.gz ZJEJBWHAIUYTHB-ZDUSSCGKSA-N 1 0 288.347 3.780 20 5 CHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000359293443 1127456401 /nfs/dbraw/zinc/45/64/01/1127456401.db2.gz FLEHWNOBCZSDNQ-CZUORRHYSA-N 1 0 274.364 3.607 20 5 CHBDRO CC[C@H](CC(F)F)C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000595289092 1127458346 /nfs/dbraw/zinc/45/83/46/1127458346.db2.gz NZBIOCDKTIIFOY-LLVKDONJSA-N 1 0 286.322 3.708 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000595411499 1127461612 /nfs/dbraw/zinc/46/16/12/1127461612.db2.gz RLAYXLZCVKUQAA-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000359541036 1127467021 /nfs/dbraw/zinc/46/70/21/1127467021.db2.gz CYVQNYJDXHYYAS-BLLLJJGKSA-N 1 0 292.354 3.746 20 5 CHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000359541039 1127467416 /nfs/dbraw/zinc/46/74/16/1127467416.db2.gz CYVQNYJDXHYYAS-MLGOLLRUSA-N 1 0 292.354 3.746 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](CCF)C1 ZINC000595754386 1127474805 /nfs/dbraw/zinc/47/48/05/1127474805.db2.gz APBKLWMIZUGQNI-QWHCGFSZSA-N 1 0 280.343 3.727 20 5 CHBDRO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000595821322 1127476602 /nfs/dbraw/zinc/47/66/02/1127476602.db2.gz YSFZYWXVYXZZTC-VOMCLLRMSA-N 1 0 298.333 3.740 20 5 CHBDRO CCC1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCC1 ZINC000227763089 1127504961 /nfs/dbraw/zinc/50/49/61/1127504961.db2.gz GCRJCYXAIYRKEM-UHFFFAOYSA-N 1 0 282.771 3.918 20 5 CHBDRO CC(C)CC[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602506019 1127588488 /nfs/dbraw/zinc/58/84/88/1127588488.db2.gz RQBRVBKDBMZALS-NSHDSACASA-N 1 0 291.351 3.650 20 5 CHBDRO CC(C)CC[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602506017 1127588623 /nfs/dbraw/zinc/58/86/23/1127588623.db2.gz RQBRVBKDBMZALS-LLVKDONJSA-N 1 0 291.351 3.650 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CC1(F)F ZINC000598677584 1127631140 /nfs/dbraw/zinc/63/11/40/1127631140.db2.gz PLLBRNXBXSIEBM-WCQYABFASA-N 1 0 298.333 3.551 20 5 CHBDRO CC(C)CC[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000061003109 1127633180 /nfs/dbraw/zinc/63/31/80/1127633180.db2.gz BWKHRJXYEJXRLG-UHFFFAOYSA-N 1 0 264.369 3.854 20 5 CHBDRO CCC([NH2+]Cc1ccc([N+](=O)[O-])cc1)(C1CC1)C1CC1 ZINC000598988388 1127647729 /nfs/dbraw/zinc/64/77/29/1127647729.db2.gz RBWGDNLOFWAEAQ-UHFFFAOYSA-N 1 0 274.364 3.653 20 5 CHBDRO C[C@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000599084050 1127656664 /nfs/dbraw/zinc/65/66/64/1127656664.db2.gz QVQDCKSXMWIRPQ-ZIEJDFEHSA-N 1 0 274.364 3.682 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@@H](C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000603873317 1127679887 /nfs/dbraw/zinc/67/98/87/1127679887.db2.gz LLWGTBCSOULYPZ-LBPRGKRZSA-N 1 0 264.369 3.770 20 5 CHBDRO Cc1noc(C[N@@H+](C)C[C@@H](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000599633287 1127684279 /nfs/dbraw/zinc/68/42/79/1127684279.db2.gz PLTXSQLBNIMWRC-LLVKDONJSA-N 1 0 295.383 3.539 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000297197729 1127690834 /nfs/dbraw/zinc/69/08/34/1127690834.db2.gz FUVYCUBLECBRRC-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@H]1CCC[N@H+](CCCCNc2ccc([N+](=O)[O-])s2)C1 ZINC000604409275 1127703489 /nfs/dbraw/zinc/70/34/89/1127703489.db2.gz MTBBFXJNVGLLEE-LBPRGKRZSA-N 1 0 297.424 3.580 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000604419158 1127704594 /nfs/dbraw/zinc/70/45/94/1127704594.db2.gz WQMSZJOXFDCVHH-GFCCVEGCSA-N 1 0 276.380 3.854 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000604484442 1127706241 /nfs/dbraw/zinc/70/62/41/1127706241.db2.gz NECXRDKVRCWMHH-QGZVFWFLSA-N 1 0 298.342 3.638 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)CC2CCC2)cccc1[N+](=O)[O-] ZINC000231884378 1127859392 /nfs/dbraw/zinc/85/93/92/1127859392.db2.gz TWZZSOBIGCWORI-NSHDSACASA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1c(C[NH+]2CCC(C)(C)CC2)cccc1[N+](=O)[O-] ZINC000608886228 1127893848 /nfs/dbraw/zinc/89/38/48/1127893848.db2.gz RMTXOSPUIBACGX-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000539826811 1127943980 /nfs/dbraw/zinc/94/39/80/1127943980.db2.gz ZBVOIPDTGWRQGG-STMXVASLSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1cccc([C@@H]2CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000544187841 1127962106 /nfs/dbraw/zinc/96/21/06/1127962106.db2.gz XVQAICMHSHKMFL-MRXNPFEDSA-N 1 0 296.370 3.893 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCC1 ZINC000540168264 1127964719 /nfs/dbraw/zinc/96/47/19/1127964719.db2.gz HDPWBMOQMBAQMT-NSHDSACASA-N 1 0 280.393 3.608 20 5 CHBDRO CCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000544611914 1127979356 /nfs/dbraw/zinc/97/93/56/1127979356.db2.gz NZOGFVKYUBGBDH-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCC[C@@H]2C2CC2)c(Cl)c1 ZINC000468031401 1127987844 /nfs/dbraw/zinc/98/78/44/1127987844.db2.gz QAUXQJNIQITSEK-HIFRSBDPSA-N 1 0 294.782 3.917 20 5 CHBDRO CC[C@@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540917837 1128001694 /nfs/dbraw/zinc/00/16/94/1128001694.db2.gz GWLNLROWSHKZHT-BXUZGUMPSA-N 1 0 296.798 3.959 20 5 CHBDRO CS[C@@H](C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000541381531 1128021476 /nfs/dbraw/zinc/02/14/76/1128021476.db2.gz OXZQAQIOEQDZGP-AWEZNQCLSA-N 1 0 296.436 3.771 20 5 CHBDRO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC(C)C ZINC000541999700 1128046735 /nfs/dbraw/zinc/04/67/35/1128046735.db2.gz UEKSQPYOPZQZDN-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO Cc1cc(N2CC=C(C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000542123362 1128051899 /nfs/dbraw/zinc/05/18/99/1128051899.db2.gz RNNDQZMSEFRQFQ-UHFFFAOYSA-N 1 0 283.331 3.608 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC1CCC1 ZINC000470176957 1128065505 /nfs/dbraw/zinc/06/55/05/1128065505.db2.gz ZHGLYWOYPBQLDB-LCYFTJDESA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]2CCC[C@H]21 ZINC000470207396 1128066184 /nfs/dbraw/zinc/06/61/84/1128066184.db2.gz VPJYJULEFUBZRM-GDKQZQJFSA-N 1 0 286.375 3.873 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C2CC=CC2)cc1[N+](=O)[O-] ZINC000151983648 1128089020 /nfs/dbraw/zinc/08/90/20/1128089020.db2.gz YDBOKMRCONUBPC-UHFFFAOYSA-N 1 0 260.337 3.526 20 5 CHBDRO CCOc1cc(C[N@H+](C(C)C)C2CCC2)ccc1[N+](=O)[O-] ZINC000492543230 1128102667 /nfs/dbraw/zinc/10/26/67/1128102667.db2.gz YKWKFPLKHJOARB-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO CCOc1cc(C[NH2+][C@H]2CCCC2(C)C)ccc1[N+](=O)[O-] ZINC000492911584 1128116459 /nfs/dbraw/zinc/11/64/59/1128116459.db2.gz JITJIQIOOUTOOE-HNNXBMFYSA-N 1 0 292.379 3.662 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)cc1Cl ZINC000761510152 1128132342 /nfs/dbraw/zinc/13/23/42/1128132342.db2.gz DSFLXQNLKFODEV-CHWSQXEVSA-N 1 0 294.782 3.870 20 5 CHBDRO CC1(C)CCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761526480 1128132849 /nfs/dbraw/zinc/13/28/49/1128132849.db2.gz NDTQUADOVKBBPQ-CYBMUJFWSA-N 1 0 282.771 3.917 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761527491 1128133804 /nfs/dbraw/zinc/13/38/04/1128133804.db2.gz HSVLMSQXQYUMGB-SNVBAGLBSA-N 1 0 270.760 3.772 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C)CC1 ZINC000609193643 1128170872 /nfs/dbraw/zinc/17/08/72/1128170872.db2.gz QZQAXAZXAINNNN-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@H]1C ZINC000609193664 1128171021 /nfs/dbraw/zinc/17/10/21/1128171021.db2.gz RVVAJKJLSKGIHY-CYBMUJFWSA-N 1 0 292.379 3.756 20 5 CHBDRO CC[C@H](C[C@@](C)(O)CC)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000926493331 1128175507 /nfs/dbraw/zinc/17/55/07/1128175507.db2.gz QTZPEUOMVSHDPM-BJJXKVORSA-N 1 0 294.395 3.575 20 5 CHBDRO CC[N@H+](CCC1CC1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494652277 1128185760 /nfs/dbraw/zinc/18/57/60/1128185760.db2.gz IDZPZYBYTCDZIK-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO Cc1occc1C[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000092438489 1128276894 /nfs/dbraw/zinc/27/68/94/1128276894.db2.gz SOWCGWLCUHDENU-FNORWQNLSA-N 1 0 286.331 3.641 20 5 CHBDRO CC(C)=CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193351399 1128280689 /nfs/dbraw/zinc/28/06/89/1128280689.db2.gz OBXFOPIEHFZFET-HNNXBMFYSA-N 1 0 260.337 3.528 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1CF)c1cccc([N+](=O)[O-])c1 ZINC000930208327 1128307222 /nfs/dbraw/zinc/30/72/22/1128307222.db2.gz NCVIWYZPAOINQG-LBPRGKRZSA-N 1 0 288.322 3.915 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000916152114 1128409707 /nfs/dbraw/zinc/40/97/07/1128409707.db2.gz NKILBOYLNKXRFI-CYBMUJFWSA-N 1 0 282.343 3.714 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCCC[C@H]1F ZINC000562735913 1128419668 /nfs/dbraw/zinc/41/96/68/1128419668.db2.gz SKDURVODLYQDLR-KCPJHIHWSA-N 1 0 280.343 3.835 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1cncs1 ZINC000934194818 1128453826 /nfs/dbraw/zinc/45/38/26/1128453826.db2.gz HPPMIMUIMVJBTI-WDEREUQCSA-N 1 0 291.376 3.772 20 5 CHBDRO CCC[NH+](CCC)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037403742 1128492992 /nfs/dbraw/zinc/49/29/92/1128492992.db2.gz NEDBHVNZZBXBPY-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO Cc1ccc([C@H](C)C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000237542781 1128516246 /nfs/dbraw/zinc/51/62/46/1128516246.db2.gz SAXVIWGLAMMWRL-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H](c2ccccc2)C2CC2)c1 ZINC000556882523 1128632937 /nfs/dbraw/zinc/63/29/37/1128632937.db2.gz KOEVEQPXOVTDQP-GOSISDBHSA-N 1 0 296.370 3.878 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1CCCC12CC2 ZINC000601138114 1128700746 /nfs/dbraw/zinc/70/07/46/1128700746.db2.gz PDEZHYFFCYLZDH-DRDHIDPGSA-N 1 0 272.348 3.530 20 5 CHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1C=CCCC1 ZINC000609417620 1128714359 /nfs/dbraw/zinc/71/43/59/1128714359.db2.gz VDNJBWKHVHNBQX-OAHLLOKOSA-N 1 0 274.364 3.914 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCCC[C@H]1C ZINC000430240066 1117908969 /nfs/dbraw/zinc/90/89/69/1117908969.db2.gz CBMBWCJDINZAEM-IUODEOHRSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000336812840 1117938470 /nfs/dbraw/zinc/93/84/70/1117938470.db2.gz SILHQICNXJTRQQ-KGLIPLIRSA-N 1 0 262.353 3.824 20 5 CHBDRO CCCC[C@@H](C)[N@H+](CCCC)Cc1c([N+](=O)[O-])ncn1C ZINC000339649857 1117946107 /nfs/dbraw/zinc/94/61/07/1117946107.db2.gz HEXYUPPXGWTEER-CYBMUJFWSA-N 1 0 296.415 3.509 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Cl)c(F)c2)cc1 ZINC000043389767 1118078254 /nfs/dbraw/zinc/07/82/54/1118078254.db2.gz KAQQQSIEPNNCRJ-UHFFFAOYSA-N 1 0 294.713 3.677 20 5 CHBDRO C[C@@H]1C[C@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001648800234 1118125768 /nfs/dbraw/zinc/12/57/68/1118125768.db2.gz XZXLBKFKEVKLPT-YPMHNXCESA-N 1 0 286.331 3.600 20 5 CHBDRO Cc1ccc(C[C@@H](C)[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000610003514 1118279617 /nfs/dbraw/zinc/27/96/17/1118279617.db2.gz GFXRRMUSQIGOIN-OAHLLOKOSA-N 1 0 298.386 3.966 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH+]2C3CCCC2CCC3)cc1 ZINC000610370033 1118362164 /nfs/dbraw/zinc/36/21/64/1118362164.db2.gz QZZOHPSFSLSRMN-UHFFFAOYSA-N 1 0 274.364 3.544 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C)(C)CC1 ZINC000610368497 1118362342 /nfs/dbraw/zinc/36/23/42/1118362342.db2.gz CNIQKKHBOFIQLM-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1c(C[NH2+]C2C[C@@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000084974849 1118481015 /nfs/dbraw/zinc/48/10/15/1118481015.db2.gz QQADEAKDIOIZLQ-RYUDHWBXSA-N 1 0 276.380 3.818 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2Nc1cc(C2CC2)ccn1 ZINC000580783870 1118503716 /nfs/dbraw/zinc/50/37/16/1118503716.db2.gz NLOPRXNPYLVIFV-OAHLLOKOSA-N 1 0 295.342 3.967 20 5 CHBDRO Cc1ncc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000616357420 1128787150 /nfs/dbraw/zinc/78/71/50/1128787150.db2.gz AGTGTSFMSGNZPP-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000510671352 1118785769 /nfs/dbraw/zinc/78/57/69/1118785769.db2.gz ZLHCIONWOLPDSG-DZGCQCFKSA-N 1 0 294.370 3.645 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC2)CC1 ZINC000611177672 1118809914 /nfs/dbraw/zinc/80/99/14/1118809914.db2.gz TXYGYTDLWDAGTK-GFCCVEGCSA-N 1 0 260.337 3.532 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1Cc2ccccc21 ZINC000610810584 1118894544 /nfs/dbraw/zinc/89/45/44/1118894544.db2.gz CVCVBEYXAIBSBS-HIFRSBDPSA-N 1 0 296.370 3.894 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H](C)c2ccncc2)cccc1[N+](=O)[O-] ZINC000610831191 1118897752 /nfs/dbraw/zinc/89/77/52/1118897752.db2.gz JLBWDVJZDNZFSK-JSGCOSHPSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@H]2CCCF)cccc1[N+](=O)[O-] ZINC000510995236 1118932300 /nfs/dbraw/zinc/93/23/00/1118932300.db2.gz QXICSXNQKYPVIO-DZGCQCFKSA-N 1 0 294.370 3.911 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC2(CC2)C1 ZINC000274563998 1118934244 /nfs/dbraw/zinc/93/42/44/1118934244.db2.gz XXIGVZQSVBZMSO-LBPRGKRZSA-N 1 0 260.337 3.532 20 5 CHBDRO C[N@H+](CCCc1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511073434 1119009738 /nfs/dbraw/zinc/00/97/38/1119009738.db2.gz PSMPJIXDRZMHHA-UHFFFAOYSA-N 1 0 298.386 3.702 20 5 CHBDRO CC(C)C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000612181078 1119229819 /nfs/dbraw/zinc/22/98/19/1119229819.db2.gz CGFFLDYFUMDLQY-UHFFFAOYSA-N 1 0 270.760 3.772 20 5 CHBDRO O=[N+]([O-])c1ccc(Oc2cccc(-n3ccnc3)c2)cc1 ZINC000091484249 1119241342 /nfs/dbraw/zinc/24/13/42/1119241342.db2.gz QZNUEZVJZCOVMG-UHFFFAOYSA-N 1 0 281.271 3.573 20 5 CHBDRO CC(C)CC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC001167633308 1119247457 /nfs/dbraw/zinc/24/74/57/1119247457.db2.gz DKGDGOOHCSFMQU-UHFFFAOYSA-N 1 0 276.380 3.853 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2C2CC2)c(Cl)c1 ZINC000611780488 1119387617 /nfs/dbraw/zinc/38/76/17/1119387617.db2.gz IGYXWLLTRIMGDF-AWEZNQCLSA-N 1 0 280.755 3.623 20 5 CHBDRO CC1=C[C@H](C)C[C@H](C[NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000583901333 1119431786 /nfs/dbraw/zinc/43/17/86/1119431786.db2.gz YIKQYMNAVCUTKH-ZFWWWQNUSA-N 1 0 288.391 3.719 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cs1 ZINC000294233430 1119623280 /nfs/dbraw/zinc/62/32/80/1119623280.db2.gz OLJPEBJBZABPQK-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2CCCCC2(F)F)cs1 ZINC000295085668 1119852368 /nfs/dbraw/zinc/85/23/68/1119852368.db2.gz ITHYHQXIBWSBFA-JTQLQIEISA-N 1 0 290.335 3.571 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1(C2CCC2)CCC1 ZINC000414180966 1119928842 /nfs/dbraw/zinc/92/88/42/1119928842.db2.gz MFZJJUXWBXINMO-ZDUSSCGKSA-N 1 0 288.391 3.838 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H](C)CCOC)c1cccc([N+](=O)[O-])c1 ZINC000414194277 1119933595 /nfs/dbraw/zinc/93/35/95/1119933595.db2.gz IPPTURJLYHIQAZ-CJNGLKHVSA-N 1 0 294.395 3.698 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)C1CCC(F)(F)CC1 ZINC000616092162 1120032235 /nfs/dbraw/zinc/03/22/35/1120032235.db2.gz RVJNBXUGZRSVIP-LLVKDONJSA-N 1 0 298.333 3.898 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)CC(C)(C)C ZINC000311881266 1120115643 /nfs/dbraw/zinc/11/56/43/1120115643.db2.gz WOUGBTKHCCPKFL-UHFFFAOYSA-N 1 0 268.332 3.602 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@@H]2CCCC[C@@H]21 ZINC000541108997 1120148380 /nfs/dbraw/zinc/14/83/80/1120148380.db2.gz FUAOUBMWBDYHRF-DJSGYFEHSA-N 1 0 292.354 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC3(C2)CCCCC3)c(F)c1 ZINC000314186548 1120174779 /nfs/dbraw/zinc/17/47/79/1120174779.db2.gz PBRQIPRBHMCOOD-UHFFFAOYSA-N 1 0 292.354 3.890 20 5 CHBDRO CC(C)[C@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000221382834 1120258283 /nfs/dbraw/zinc/25/82/83/1120258283.db2.gz NBCYCFLCZFZCBI-GJZGRUSLSA-N 1 0 276.380 3.899 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC(C)(C)C ZINC000542931767 1120259963 /nfs/dbraw/zinc/25/99/63/1120259963.db2.gz TYHHLMPPFFDJAN-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000104323348 1120288965 /nfs/dbraw/zinc/28/89/65/1120288965.db2.gz JAAOGAJWCBSQSZ-MFKMUULPSA-N 1 0 282.771 3.917 20 5 CHBDRO C[NH+](C)C1(CNc2ccccc2[N+](=O)[O-])CCCCCC1 ZINC000024585641 1120291362 /nfs/dbraw/zinc/29/13/62/1120291362.db2.gz ZVMACTYZJYGQAP-UHFFFAOYSA-N 1 0 291.395 3.661 20 5 CHBDRO CC(C)[N@H+](CCOC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1 ZINC000065953515 1120371168 /nfs/dbraw/zinc/37/11/68/1120371168.db2.gz YPFKJPILSROSGE-UHFFFAOYSA-N 1 0 294.395 3.620 20 5 CHBDRO Cc1ccc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000301816483 1120374468 /nfs/dbraw/zinc/37/44/68/1120374468.db2.gz JKQHRVOAILWKHP-UHFFFAOYSA-N 1 0 291.395 3.624 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)nc1C ZINC000313886331 1120414972 /nfs/dbraw/zinc/41/49/72/1120414972.db2.gz CYKUQNQTFWCLJR-AWEZNQCLSA-N 1 0 299.374 3.766 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H]2CC23CC3)c2cc([N+](=O)[O-])ccc21 ZINC000417334026 1120429806 /nfs/dbraw/zinc/42/98/06/1120429806.db2.gz GQOCTVDSKWDRFP-XHDPSFHLSA-N 1 0 286.375 3.707 20 5 CHBDRO C[NH+](C)CCCCNc1ccc(C(C)(C)C)cc1[N+](=O)[O-] ZINC001161730730 1120492653 /nfs/dbraw/zinc/49/26/53/1120492653.db2.gz CNUOJCCXHFXYCQ-UHFFFAOYSA-N 1 0 293.411 3.646 20 5 CHBDRO CS[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000117393168 1120499258 /nfs/dbraw/zinc/49/92/58/1120499258.db2.gz JSHUQAMPNORMHB-KGLIPLIRSA-N 1 0 294.420 3.667 20 5 CHBDRO C[C@@]1(c2ccccc2)CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532293345 1120499484 /nfs/dbraw/zinc/49/94/84/1120499484.db2.gz UWIDGHRFABLGNF-GOSISDBHSA-N 1 0 296.370 3.758 20 5 CHBDRO C[C@H](c1ccco1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000131043940 1120510521 /nfs/dbraw/zinc/51/05/21/1120510521.db2.gz WTQFZRGHUAGMGT-OQHXTRMZSA-N 1 0 286.331 3.894 20 5 CHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000543448305 1120525615 /nfs/dbraw/zinc/52/56/15/1120525615.db2.gz KJYQSYJTGWFKMH-AWEZNQCLSA-N 1 0 284.359 3.563 20 5 CHBDRO Cc1ccsc1[C@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000070091908 1120528711 /nfs/dbraw/zinc/52/87/11/1120528711.db2.gz PVAPRFJOAGNEDA-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@H]1CCC[N@@H+](C(C)(C)CNc2sccc2[N+](=O)[O-])C1 ZINC000301994867 1120529172 /nfs/dbraw/zinc/52/91/72/1120529172.db2.gz PAJNPQNZDPYOMI-NSHDSACASA-N 1 0 297.424 3.579 20 5 CHBDRO C[C@@H]1CCC[C@H](CC[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000070546757 1120532343 /nfs/dbraw/zinc/53/23/43/1120532343.db2.gz RSEGVJKABLJCEX-ZIAGYGMSSA-N 1 0 276.380 3.901 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cc(Cl)cs2)cc1 ZINC000093094883 1120553168 /nfs/dbraw/zinc/55/31/68/1120553168.db2.gz YFQNWIVWOPXZEF-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]CC2CCC(F)(F)CC2)cs1 ZINC000330406701 1120585032 /nfs/dbraw/zinc/58/50/32/1120585032.db2.gz NYRNDZUGDMELOM-UHFFFAOYSA-N 1 0 290.335 3.571 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCc2cccs2)cccc1[N+](=O)[O-] ZINC000155586802 1120592093 /nfs/dbraw/zinc/59/20/93/1120592093.db2.gz SLCDVHMJLAGLFY-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000338899477 1120638823 /nfs/dbraw/zinc/63/88/23/1120638823.db2.gz DFZREAKNWRZTRC-UHFFFAOYSA-N 1 0 288.269 3.598 20 5 CHBDRO C[C@H](c1ccccn1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350363287 1120651457 /nfs/dbraw/zinc/65/14/57/1120651457.db2.gz XOPNJWSGGUOVNY-IUCKJTJTSA-N 1 0 297.358 3.696 20 5 CHBDRO CSC(C)(C)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000132401305 1120689429 /nfs/dbraw/zinc/68/94/29/1120689429.db2.gz RLJSHFQHVDONIQ-NSHDSACASA-N 1 0 282.409 3.695 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000222029227 1120961493 /nfs/dbraw/zinc/96/14/93/1120961493.db2.gz WBFTXMDZMYINBD-YPMHNXCESA-N 1 0 262.353 3.600 20 5 CHBDRO CC[C@H]([NH2+]CCC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000163506531 1121025130 /nfs/dbraw/zinc/02/51/30/1121025130.db2.gz SDHLNEVZPRKXEE-HNNXBMFYSA-N 1 0 262.353 3.826 20 5 CHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC001174781665 1121029487 /nfs/dbraw/zinc/02/94/87/1121029487.db2.gz YTHPZUCPZIAMSW-SMDDNHRTSA-N 1 0 280.343 3.887 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH+](CC2CC2)CC2CC2)ccc1Cl ZINC000070505276 1128984328 /nfs/dbraw/zinc/98/43/28/1128984328.db2.gz FXFHNDHZERZMKV-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO O=[N+]([O-])c1ccc(F)c(Nc2cc[nH+]c(C3CC3)c2)c1 ZINC001175734649 1121441521 /nfs/dbraw/zinc/44/15/21/1121441521.db2.gz ABKBYNUCKWGWKC-UHFFFAOYSA-N 1 0 273.267 3.750 20 5 CHBDRO Cc1c(C[N@H+]2CC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000466705814 1121556102 /nfs/dbraw/zinc/55/61/02/1121556102.db2.gz ADCYIHVEGIUGKC-AWEZNQCLSA-N 1 0 276.380 3.771 20 5 CHBDRO CC(C)C[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000466719579 1121566535 /nfs/dbraw/zinc/56/65/35/1121566535.db2.gz XHKVXIYDKZTZGI-HNNXBMFYSA-N 1 0 276.380 3.505 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC12CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000429442607 1121585528 /nfs/dbraw/zinc/58/55/28/1121585528.db2.gz LOBDIOQJDHDAIZ-SWLSCSKDSA-N 1 0 274.364 3.968 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)C1CCC1 ZINC000611337296 1121638234 /nfs/dbraw/zinc/63/82/34/1121638234.db2.gz YDDPRWNAVNLRMN-VXGBXAGGSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCC(F)(F)C1 ZINC000611475830 1121650933 /nfs/dbraw/zinc/65/09/33/1121650933.db2.gz JLRNTNAIJUZBJV-MNOVXSKESA-N 1 0 284.306 3.742 20 5 CHBDRO Cc1ccc(C[NH+]2CCC(F)(C3CC3)CC2)cc1[N+](=O)[O-] ZINC001176753902 1121692752 /nfs/dbraw/zinc/69/27/52/1121692752.db2.gz NPVITRKIYFKGHR-UHFFFAOYSA-N 1 0 292.354 3.617 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000397812201 1121698409 /nfs/dbraw/zinc/69/84/09/1121698409.db2.gz GUTQXQRWQSKCDG-WHOFXGATSA-N 1 0 294.420 3.920 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CC3CC=CC3)o2)c1 ZINC001203149845 1121716571 /nfs/dbraw/zinc/71/65/71/1121716571.db2.gz ULNHEYVMFQEBSB-UHFFFAOYSA-N 1 0 298.342 3.911 20 5 CHBDRO CC(C)(F)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179314386 1121870807 /nfs/dbraw/zinc/87/08/07/1121870807.db2.gz BKJSWBODHHLUQQ-UHFFFAOYSA-N 1 0 292.310 3.693 20 5 CHBDRO CC(C)([NH2+]CC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC001180666126 1122006495 /nfs/dbraw/zinc/00/64/95/1122006495.db2.gz QYEMXNUCWRVFDM-UHFFFAOYSA-N 1 0 276.380 4.000 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CCCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000183350433 1122021599 /nfs/dbraw/zinc/02/15/99/1122021599.db2.gz IIOKOIVHDVMLFK-GDBMZVCRSA-N 1 0 292.379 3.595 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@H]1C ZINC000501927171 1122024467 /nfs/dbraw/zinc/02/44/67/1122024467.db2.gz JQOIBTKJTVYSBP-IUODEOHRSA-N 1 0 292.379 3.660 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CC[C@@H](C)C1 ZINC000429591130 1122142846 /nfs/dbraw/zinc/14/28/46/1122142846.db2.gz QQQSEONJPUQIDO-TZMCWYRMSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000505571194 1122422358 /nfs/dbraw/zinc/42/23/58/1122422358.db2.gz WGHFPEQRHPTTRJ-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000716534514 1122424056 /nfs/dbraw/zinc/42/40/56/1122424056.db2.gz WYWCWBHIRDWRIK-RCCPXBDUSA-N 1 0 294.782 3.630 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCSC(C)(C)CC2)cc1[N+](=O)[O-] ZINC000435053811 1122431262 /nfs/dbraw/zinc/43/12/62/1122431262.db2.gz WHOIPFHUDUAFNN-UHFFFAOYSA-N 1 0 294.420 3.621 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000505640140 1122447003 /nfs/dbraw/zinc/44/70/03/1122447003.db2.gz YEFHRARDNQWLFF-BBRMVZONSA-N 1 0 296.370 3.975 20 5 CHBDRO CC[NH+](CC)CC[C@@H](C)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001187926246 1122447101 /nfs/dbraw/zinc/44/71/01/1122447101.db2.gz GXPUPOFQZQXSOP-LLVKDONJSA-N 1 0 299.802 3.781 20 5 CHBDRO CC[NH+](CC)CC[C@H](C)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001187926247 1122447246 /nfs/dbraw/zinc/44/72/46/1122447246.db2.gz GXPUPOFQZQXSOP-NSHDSACASA-N 1 0 299.802 3.781 20 5 CHBDRO CCC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC1CC1 ZINC000435237747 1122447532 /nfs/dbraw/zinc/44/75/32/1122447532.db2.gz OIOZUTTTWMJBLW-ALCCZGGFSA-N 1 0 274.364 3.730 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@@H](F)C1 ZINC000515059664 1122473615 /nfs/dbraw/zinc/47/36/15/1122473615.db2.gz NLKFMKROESKHEV-YNEHKIRRSA-N 1 0 280.343 3.835 20 5 CHBDRO Cc1cc(N2CCC=C(C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000435588526 1122476547 /nfs/dbraw/zinc/47/65/47/1122476547.db2.gz MZQHZVFYMKHKMN-UHFFFAOYSA-N 1 0 283.331 3.608 20 5 CHBDRO Cc1ccc(Cn2cnc3c2C[C@H](C)[C@H](C)C3)cc1[N+](=O)[O-] ZINC001189416762 1122501147 /nfs/dbraw/zinc/50/11/47/1122501147.db2.gz ZWKVKVLFIJMEBF-OLZOCXBDSA-N 1 0 299.374 3.519 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@H]12 ZINC000515548297 1122509380 /nfs/dbraw/zinc/50/93/80/1122509380.db2.gz RHIXYHKHOLELLH-XYPHTWIQSA-N 1 0 288.391 3.995 20 5 CHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CCCC1 ZINC000516299907 1122585576 /nfs/dbraw/zinc/58/55/76/1122585576.db2.gz PMBLZEGTFKJJLJ-UHFFFAOYSA-N 1 0 276.380 3.995 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000437041312 1122606845 /nfs/dbraw/zinc/60/68/45/1122606845.db2.gz AGONLUBLMUHACH-DAXOMENPSA-N 1 0 288.391 3.694 20 5 CHBDRO CC[C@@H](C)c1ccc([C@H]([NH2+]CC[N+](=O)[O-])C(C)C)cc1 ZINC001191961624 1122625220 /nfs/dbraw/zinc/62/52/20/1122625220.db2.gz YYFAPZZCWYCSRF-CZUORRHYSA-N 1 0 278.396 3.764 20 5 CHBDRO CC(C)CC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C(C)(C)C ZINC001192603881 1122653259 /nfs/dbraw/zinc/65/32/59/1122653259.db2.gz ICHDMLDCHIPAJE-AWEZNQCLSA-N 1 0 293.411 3.930 20 5 CHBDRO COc1ccc(C[N@@H+]2CCCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000438361287 1122693023 /nfs/dbraw/zinc/69/30/23/1122693023.db2.gz WKIKQARVRDRHFV-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC1CC2(CCC2)C1 ZINC001193743484 1122711770 /nfs/dbraw/zinc/71/17/70/1122711770.db2.gz OZLCDRJEEIEEGK-UHFFFAOYSA-N 1 0 288.391 3.649 20 5 CHBDRO CCN(Cc1occc1C)Cc1ccccc1[N+](=O)[O-] ZINC000507132936 1122722811 /nfs/dbraw/zinc/72/28/11/1122722811.db2.gz XPDQQQGEDWPDTK-UHFFFAOYSA-N 1 0 274.320 3.518 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000518581227 1122768856 /nfs/dbraw/zinc/76/88/56/1122768856.db2.gz BDGWZHZWFQKUQV-QWHCGFSZSA-N 1 0 262.353 3.778 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426488824 1122804860 /nfs/dbraw/zinc/80/48/60/1122804860.db2.gz XYWRPEXWKYCUAJ-GXFFZTMASA-N 1 0 280.755 3.623 20 5 CHBDRO CCSCC[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543631616 1122945348 /nfs/dbraw/zinc/94/53/48/1122945348.db2.gz MHOFOSWDQHUPHA-ZDUSSCGKSA-N 1 0 296.436 3.867 20 5 CHBDRO C[N@H+](CCC1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000507617078 1122977121 /nfs/dbraw/zinc/97/71/21/1122977121.db2.gz QORDLJKYAGIHFP-UHFFFAOYSA-N 1 0 276.380 3.997 20 5 CHBDRO CC[C@H]([NH2+]CCC(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000294097016 1123061268 /nfs/dbraw/zinc/06/12/68/1123061268.db2.gz BOWPHNGONVOVPB-LBPRGKRZSA-N 1 0 272.295 3.681 20 5 CHBDRO CCC1(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC001200864232 1123062259 /nfs/dbraw/zinc/06/22/59/1123062259.db2.gz SJJTYAJPIPUGSR-UHFFFAOYSA-N 1 0 276.380 3.998 20 5 CHBDRO Cc1cc(C)cc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000850522210 1123279820 /nfs/dbraw/zinc/27/98/20/1123279820.db2.gz IWTOIEQVGLPNOU-CYBMUJFWSA-N 1 0 299.374 3.645 20 5 CHBDRO CCC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000449417122 1123331544 /nfs/dbraw/zinc/33/15/44/1123331544.db2.gz XCMMSDZKPCMYSP-UHFFFAOYSA-N 1 0 286.331 3.887 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CCC(C)(C)C1 ZINC000544612624 1123368286 /nfs/dbraw/zinc/36/82/86/1123368286.db2.gz KGLQBCNBMAMZFV-ZDUSSCGKSA-N 1 0 262.353 3.572 20 5 CHBDRO CC[C@@H](CC(F)F)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000851869760 1123385937 /nfs/dbraw/zinc/38/59/37/1123385937.db2.gz QCPDTHXEWMTERZ-NSHDSACASA-N 1 0 298.333 3.634 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C1(C)CC1 ZINC000776883484 1123557147 /nfs/dbraw/zinc/55/71/47/1123557147.db2.gz YWWRBXZRHGQUOT-OLZOCXBDSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)C1(C)CC1 ZINC000776883482 1123559429 /nfs/dbraw/zinc/55/94/29/1123559429.db2.gz YWWRBXZRHGQUOT-CHWSQXEVSA-N 1 0 276.380 3.694 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2csc([C@H]3CCCC[NH2+]3)n2)cc1 ZINC000053251596 1123572530 /nfs/dbraw/zinc/57/25/30/1123572530.db2.gz VYNIYQSVISZCMD-GFCCVEGCSA-N 1 0 289.360 3.533 20 5 CHBDRO C[C@@H](O)CC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000114771064 1123579342 /nfs/dbraw/zinc/57/93/42/1123579342.db2.gz NZWCKTIGOOQKMQ-CQSZACIVSA-N 1 0 279.383 3.854 20 5 CHBDRO C[C@@H]([NH2+]CCCCOC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000475312389 1123839048 /nfs/dbraw/zinc/83/90/48/1123839048.db2.gz XUHRRRBTEHGGCU-CYBMUJFWSA-N 1 0 294.395 3.841 20 5 CHBDRO Cc1ccc(C[NH2+]CCCc2ccccc2)cc1[N+](=O)[O-] ZINC000034995225 1124021093 /nfs/dbraw/zinc/02/10/93/1124021093.db2.gz OXOIMOKSRXVGNF-UHFFFAOYSA-N 1 0 284.359 3.626 20 5 CHBDRO C[C@@H]1CCCCC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000088508030 1124060997 /nfs/dbraw/zinc/06/09/97/1124060997.db2.gz RMDGVAWKMVALRE-TZMCWYRMSA-N 1 0 262.353 3.653 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000086230115 1129163907 /nfs/dbraw/zinc/16/39/07/1129163907.db2.gz VJKRZMVMQUCZGF-UHFFFAOYSA-N 1 0 291.351 3.794 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000088747818 1124096327 /nfs/dbraw/zinc/09/63/27/1124096327.db2.gz BMRXYPVWDAORTB-TZMCWYRMSA-N 1 0 260.337 3.663 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000525273840 1124119804 /nfs/dbraw/zinc/11/98/04/1124119804.db2.gz ZKALKBJZKFXEEQ-IVMMDQJWSA-N 1 0 274.364 3.748 20 5 CHBDRO C[N@H+](CCC1CCCC1)Cc1ccccc1[N+](=O)[O-] ZINC000525634626 1124450830 /nfs/dbraw/zinc/45/08/30/1124450830.db2.gz GKGMBBADZGXVKN-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO CC1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000447584785 1124491757 /nfs/dbraw/zinc/49/17/57/1124491757.db2.gz HHQZOKIJBHAWCM-HNNXBMFYSA-N 1 0 274.364 3.752 20 5 CHBDRO CC1(C)C[C@@H]1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447578504 1124497688 /nfs/dbraw/zinc/49/76/88/1124497688.db2.gz FWKPSFJQEFCSJP-IUODEOHRSA-N 1 0 274.364 3.608 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H](C)C1 ZINC000485765818 1124614716 /nfs/dbraw/zinc/61/47/16/1124614716.db2.gz MCBOCMFUXDBOEA-AAEUAGOBSA-N 1 0 262.353 3.696 20 5 CHBDRO c1ccc2cc3c(cc2c1)ncnc3C1=CCC[NH2+]CC1 ZINC001238940943 1131275161 /nfs/dbraw/zinc/27/51/61/1131275161.db2.gz RAKOEAVSHZPUAD-UHFFFAOYSA-N 1 0 275.355 3.550 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000872081607 1124677543 /nfs/dbraw/zinc/67/75/43/1124677543.db2.gz IGGSKPJFNIHBJM-YFKTTZPYSA-N 1 0 292.404 3.766 20 5 CHBDRO COC1(C[C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000449350876 1124698311 /nfs/dbraw/zinc/69/83/11/1124698311.db2.gz XMZQPLYMCLUMAU-OLZOCXBDSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccccc1 ZINC000873007465 1124733990 /nfs/dbraw/zinc/73/39/90/1124733990.db2.gz RECMIMRVQHLRTD-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc(F)cc1 ZINC000873006440 1124734399 /nfs/dbraw/zinc/73/43/99/1124734399.db2.gz IBBZMNCKLHFQQO-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]2C2CC2)o1 ZINC000449429585 1124735366 /nfs/dbraw/zinc/73/53/66/1124735366.db2.gz XDFLQOGZTHZRAB-HNNXBMFYSA-N 1 0 298.342 3.839 20 5 CHBDRO C[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC001170947869 1131289837 /nfs/dbraw/zinc/28/98/37/1131289837.db2.gz BRWOEYZHFLVHBK-IAQYHMDHSA-N 1 0 280.343 3.792 20 5 CHBDRO O=[N+]([O-])c1ccccc1CN1CC2(CCC2)[C@@H]1c1ccco1 ZINC000449633770 1124832468 /nfs/dbraw/zinc/83/24/68/1124832468.db2.gz QDPDCXMUGDQNMK-INIZCTEOSA-N 1 0 298.342 3.915 20 5 CHBDRO C[C@@H](c1ccccc1F)N(C)Cc1ccc([N+](=O)[O-])cc1 ZINC000052074198 1125373930 /nfs/dbraw/zinc/37/39/30/1125373930.db2.gz VAHUDPCFCQIBGW-LBPRGKRZSA-N 1 0 288.322 3.927 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2csc([C@H]3CCCC[NH2+]3)n2)c1 ZINC000053251879 1125424192 /nfs/dbraw/zinc/42/41/92/1125424192.db2.gz IACIEHMJPULGAF-GFCCVEGCSA-N 1 0 289.360 3.533 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC12CCC2)c1ccccc1[N+](=O)[O-] ZINC000282846756 1125431279 /nfs/dbraw/zinc/43/12/79/1125431279.db2.gz TURJSPJFEPEDCD-SMDDNHRTSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@@H]1c2ccccc2CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000139501623 1129202301 /nfs/dbraw/zinc/20/23/01/1129202301.db2.gz XQKISUJOPZCWJJ-CQSZACIVSA-N 1 0 296.370 3.757 20 5 CHBDRO O[C@@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)C1CC1 ZINC000734844186 1129323962 /nfs/dbraw/zinc/32/39/62/1129323962.db2.gz HLWOYAPRGFSCAM-FQEVSTJZSA-N 1 0 291.394 3.854 20 5 CHBDRO CCc1ccc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)o1 ZINC000090910057 1129336421 /nfs/dbraw/zinc/33/64/21/1129336421.db2.gz ZXIIFCFUPBXWMD-LBPRGKRZSA-N 1 0 288.347 3.644 20 5 CHBDRO Cc1cccc(C)c1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000738302938 1129392043 /nfs/dbraw/zinc/39/20/43/1129392043.db2.gz BTRLLYNTXWNYDI-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094773912 1129451666 /nfs/dbraw/zinc/45/16/66/1129451666.db2.gz LGVDYCYCIZTCMH-AWEZNQCLSA-N 1 0 280.343 3.792 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094773486 1129451940 /nfs/dbraw/zinc/45/19/40/1129451940.db2.gz LGWZARFXRGKZAC-OCCSQVGLSA-N 1 0 280.343 3.792 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1C ZINC000252216492 1129558900 /nfs/dbraw/zinc/55/89/00/1129558900.db2.gz XVKOUWJXNCMXHX-MNOVXSKESA-N 1 0 282.771 3.869 20 5 CHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001168965133 1129687779 /nfs/dbraw/zinc/68/77/79/1129687779.db2.gz YHPJFDIDECJTJK-DZGCQCFKSA-N 1 0 280.412 3.524 20 5 CHBDRO CSc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169004509 1129689462 /nfs/dbraw/zinc/68/94/62/1129689462.db2.gz RCLZMMVXBUPWOT-SGMGOOAPSA-N 1 0 294.420 3.505 20 5 CHBDRO CCCCC1CCC([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168987286 1129689758 /nfs/dbraw/zinc/68/97/58/1129689758.db2.gz HXONJTIKRFXONM-KNIAUWFNSA-N 1 0 282.428 3.770 20 5 CHBDRO CCCCC1CCC([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168987285 1129689896 /nfs/dbraw/zinc/68/98/96/1129689896.db2.gz HXONJTIKRFXONM-GYTBAZASSA-N 1 0 282.428 3.770 20 5 CHBDRO C[C@]12C[C@H]1CCC[C@@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000800481590 1129877371 /nfs/dbraw/zinc/87/73/71/1129877371.db2.gz AVEFZCWXGOVQHG-UGFHNGPFSA-N 1 0 294.782 3.917 20 5 CHBDRO C[C@H]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001461381859 1129912766 /nfs/dbraw/zinc/91/27/66/1129912766.db2.gz KLULGXJADRHSNI-GXFFZTMASA-N 1 0 282.771 3.569 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC(C)(C)C1 ZINC000801539451 1129925820 /nfs/dbraw/zinc/92/58/20/1129925820.db2.gz GWQNJRWLHCYDQU-NSHDSACASA-N 1 0 280.343 3.602 20 5 CHBDRO CC[C@H]([NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000903244729 1130135273 /nfs/dbraw/zinc/13/52/73/1130135273.db2.gz CGXNQMRFGWMRIE-BBRMVZONSA-N 1 0 299.374 3.834 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000903245848 1130135517 /nfs/dbraw/zinc/13/55/17/1130135517.db2.gz OWSLSVQNPLNIED-ZIAGYGMSSA-N 1 0 299.374 3.753 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1cscn1)c1ccccc1[N+](=O)[O-] ZINC000903246865 1130135955 /nfs/dbraw/zinc/13/59/55/1130135955.db2.gz XWXCYUWSYNWMAO-QWRGUYRKSA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCSC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000903284170 1130146268 /nfs/dbraw/zinc/14/62/68/1130146268.db2.gz PVMVCAOZIORNFV-YPMHNXCESA-N 1 0 294.420 3.920 20 5 CHBDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000790697316 1130326824 /nfs/dbraw/zinc/32/68/24/1130326824.db2.gz ZBAVWCLDVSUWIG-QGZVFWFLSA-N 1 0 296.370 3.989 20 5 CHBDRO COc1ccc(C[C@H](C)[NH+](C(C)C)C(C)C)c([N+](=O)[O-])c1 ZINC001170328673 1130483584 /nfs/dbraw/zinc/48/35/84/1130483584.db2.gz LFIDYHDBKDVOTH-ZDUSSCGKSA-N 1 0 294.395 3.653 20 5 CHBDRO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000811472651 1130614001 /nfs/dbraw/zinc/61/40/01/1130614001.db2.gz LJHJEGNWTGEEKE-ZETCQYMHSA-N 1 0 289.162 3.790 20 5 CHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC(C)(C)C ZINC000812890514 1130723759 /nfs/dbraw/zinc/72/37/59/1130723759.db2.gz FVNFDDDITOJZJD-UHFFFAOYSA-N 1 0 268.332 3.602 20 5 CHBDRO CC(C)C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783620583 1130843561 /nfs/dbraw/zinc/84/35/61/1130843561.db2.gz PGQZIXNDBLCOJQ-UHFFFAOYSA-N 1 0 270.760 3.772 20 5 CHBDRO C[C@H]1C[C@@H](C(C)(C)C)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001170785341 1130989619 /nfs/dbraw/zinc/98/96/19/1130989619.db2.gz ZVTRRTXLPCCJTE-JSGCOSHPSA-N 1 0 291.395 3.636 20 5 CHBDRO CC(C)CC1(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000815595799 1131005808 /nfs/dbraw/zinc/00/58/08/1131005808.db2.gz BRYYODSNXVGERU-GFCCVEGCSA-N 1 0 291.395 3.654 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(C(F)(F)F)c(Cl)c1 ZINC001227831930 1131747365 /nfs/dbraw/zinc/74/73/65/1131747365.db2.gz MBWZEKJWTMYIQU-SECBINFHSA-N 1 0 296.740 3.832 20 5 CHBDRO CC[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000835032972 1131761436 /nfs/dbraw/zinc/76/14/36/1131761436.db2.gz AXOCCZNYTDDEPM-ZETCQYMHSA-N 1 0 277.151 3.790 20 5 CHBDRO Cc1cc(OC2CC[NH+](C(C)(C)C)CC2)cc([N+](=O)[O-])c1 ZINC001228839933 1131962652 /nfs/dbraw/zinc/96/26/52/1131962652.db2.gz ZYBFCDICYYSAOK-UHFFFAOYSA-N 1 0 292.379 3.545 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000036993659 1131986094 /nfs/dbraw/zinc/98/60/94/1131986094.db2.gz JKPUBLQUWCANGR-LRDDRELGSA-N 1 0 288.347 3.860 20 5 CHBDRO C[NH+](C)[C@H]1CCC[C@H](Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000715573264 1131989065 /nfs/dbraw/zinc/98/90/65/1131989065.db2.gz OODDTVGWXPNXAW-RYUDHWBXSA-N 1 0 297.786 3.533 20 5 CHBDRO C[N@@H+]1CC[C@H](Oc2c3ccccc3c(O)c3ccccc32)C1 ZINC001229025667 1132001504 /nfs/dbraw/zinc/00/15/04/1132001504.db2.gz XLLSBPMAWXHODI-ZDUSSCGKSA-N 1 0 293.366 3.782 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)C1CCC1 ZINC000324675540 1132150473 /nfs/dbraw/zinc/15/04/73/1132150473.db2.gz MFFRRQXNYXZRHU-HNNXBMFYSA-N 1 0 276.380 3.962 20 5 CHBDRO C[C@H]1CCC[C@H]1[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172896027 1132360466 /nfs/dbraw/zinc/36/04/66/1132360466.db2.gz LCAFEBGTDLUGTD-YLQAJVPDSA-N 1 0 288.391 3.620 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1[C@H](C)CC[C@@H]1C ZINC001173218488 1132411391 /nfs/dbraw/zinc/41/13/91/1132411391.db2.gz BFUIXJHBNQXWRH-RSUWNVLCSA-N 1 0 276.380 3.550 20 5 CHBDRO CCC[NH+](CCC)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173223576 1132412526 /nfs/dbraw/zinc/41/25/26/1132412526.db2.gz AZKOVICYTQEOJQ-CYBMUJFWSA-N 1 0 264.369 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC[C@@H]1C ZINC001173227370 1132412768 /nfs/dbraw/zinc/41/27/68/1132412768.db2.gz QGMDUPPVNQFLSF-UONOGXRCSA-N 1 0 276.380 3.790 20 5 CHBDRO CCC[NH+](CCC)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173223577 1132413000 /nfs/dbraw/zinc/41/30/00/1132413000.db2.gz AZKOVICYTQEOJQ-ZDUSSCGKSA-N 1 0 264.369 3.648 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC001173233586 1132413951 /nfs/dbraw/zinc/41/39/51/1132413951.db2.gz JQVGBYHUUDBPHH-CXAGYDPISA-N 1 0 299.374 3.662 20 5 CHBDRO CC(C)[C@H]1CCC[N@@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230996 1132414101 /nfs/dbraw/zinc/41/41/01/1132414101.db2.gz IBGJWAJHBUDISM-CZUORRHYSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]1c1ccccc1 ZINC001173233760 1132414126 /nfs/dbraw/zinc/41/41/26/1132414126.db2.gz NETIMAOYHQFIIN-KSSFIOAISA-N 1 0 296.370 3.973 20 5 CHBDRO CC(C)C([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001173233273 1132414244 /nfs/dbraw/zinc/41/42/44/1132414244.db2.gz HTWCAVCZPVSNIZ-ZDUSSCGKSA-N 1 0 278.396 3.796 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001173209354 1132416032 /nfs/dbraw/zinc/41/60/32/1132416032.db2.gz BRKVBYYUIRLSAO-DGCLKSJQSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccccc1CC[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173210760 1132416094 /nfs/dbraw/zinc/41/60/94/1132416094.db2.gz MWOFOBMXTJBLCP-OAHLLOKOSA-N 1 0 298.386 3.667 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)s1 ZINC001173211574 1132416116 /nfs/dbraw/zinc/41/61/16/1132416116.db2.gz SWWVOEICUBQNQU-LLVKDONJSA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1cc(C)cc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173213176 1132416816 /nfs/dbraw/zinc/41/68/16/1132416816.db2.gz GCGFARHHXXTAEH-HNNXBMFYSA-N 1 0 298.386 3.932 20 5 CHBDRO C[C@H]1CCC[N@@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232219884 1132439382 /nfs/dbraw/zinc/43/93/82/1132439382.db2.gz VNHKOZNOQJKORR-ZDUSSCGKSA-N 1 0 277.371 3.767 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@@H+]2CCCC[C@H]2C)c1 ZINC001162152897 1133054838 /nfs/dbraw/zinc/05/48/38/1133054838.db2.gz JKJVHHQQVCEHAL-ZIAGYGMSSA-N 1 0 291.395 3.578 20 5 CHBDRO C[NH+](C)CCc1ccc(Nc2ccsc2[N+](=O)[O-])cc1 ZINC001162438504 1133078258 /nfs/dbraw/zinc/07/82/58/1133078258.db2.gz YGJVUXYHIMNHJX-UHFFFAOYSA-N 1 0 291.376 3.504 20 5 CHBDRO CC(C)[NH+]1CCC(CCNc2sccc2[N+](=O)[O-])CC1 ZINC001163830779 1133178346 /nfs/dbraw/zinc/17/83/46/1133178346.db2.gz AYTXBUDIBIKFQK-UHFFFAOYSA-N 1 0 297.424 3.579 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(C)o1 ZINC001203271187 1133309141 /nfs/dbraw/zinc/30/91/41/1133309141.db2.gz QNKBVSXORLQDRV-WQLSENKSSA-N 1 0 286.331 3.689 20 5 CHBDRO CC[N@H+](Cc1c(C)ccc([N+](=O)[O-])c1C)C1CCC1 ZINC001204682134 1133475509 /nfs/dbraw/zinc/47/55/09/1133475509.db2.gz PGMFOWBXBKENFL-UHFFFAOYSA-N 1 0 262.353 3.586 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCc1ccccc1-c1ccccc1 ZINC001206602485 1133725904 /nfs/dbraw/zinc/72/59/04/1133725904.db2.gz VBXNMTXJIRUNRP-INIZCTEOSA-N 1 0 284.423 3.965 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1Nc1cc[nH+]c(C2CC2)c1 ZINC001210445310 1134216389 /nfs/dbraw/zinc/21/63/89/1134216389.db2.gz YTSRQTXIYCKHCI-UHFFFAOYSA-N 1 0 285.303 3.619 20 5 CHBDRO Cc1ccc(Nc2c[nH+]ccc2N2CCCC2)cc1[N+](=O)[O-] ZINC001213665820 1134476698 /nfs/dbraw/zinc/47/66/98/1134476698.db2.gz MYZAZTXUZMIAGG-UHFFFAOYSA-N 1 0 298.346 3.642 20 5 CHBDRO Cc1ccc(Nc2ccccc2C[NH+](C)C)cc1[N+](=O)[O-] ZINC001213669958 1134476703 /nfs/dbraw/zinc/47/67/03/1134476703.db2.gz AFHQZXDRPUCDKY-UHFFFAOYSA-N 1 0 285.347 3.708 20 5 CHBDRO Cc1ccc(Nc2c[nH+]ccc2N2CCCC2)c([N+](=O)[O-])c1 ZINC001214169560 1134515691 /nfs/dbraw/zinc/51/56/91/1134515691.db2.gz SZJFGQVYAMVDCA-UHFFFAOYSA-N 1 0 298.346 3.642 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403713394 1134842383 /nfs/dbraw/zinc/84/23/83/1134842383.db2.gz XYGVRGYLJBOCFW-GIPNMCIBSA-N 1 0 280.755 3.526 20 5 CHBDRO c1ccc2c(c1)nc(OC1CC[NH2+]CC1)c1ccccc21 ZINC001217964081 1135033140 /nfs/dbraw/zinc/03/31/40/1135033140.db2.gz GURQGDKGRPSWJF-UHFFFAOYSA-N 1 0 278.355 3.519 20 5 CHBDRO C[C@H]1C[C@@H](Oc2cccc3ccc4cccnc4c32)CC[NH2+]1 ZINC001218058002 1135051537 /nfs/dbraw/zinc/05/15/37/1135051537.db2.gz VJDVLLIJOKJNOD-BBRMVZONSA-N 1 0 292.382 3.907 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2O[C@H]1[C@@H]2C[C@H]1C[NH2+]C2 ZINC001218149624 1135063094 /nfs/dbraw/zinc/06/30/94/1135063094.db2.gz RKLSWLQSJVTQQH-MNZLEMJZSA-N 1 0 289.378 3.980 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@H]3CCC34C[NH2+]C4)c12 ZINC001218240905 1135072967 /nfs/dbraw/zinc/07/29/67/1135072967.db2.gz PCLDBORKTONPFW-INIZCTEOSA-N 1 0 290.366 3.519 20 5 CHBDRO C[C@@H]1C[NH2+]CC[C@@H]1Oc1cccc2ccc3cccnc3c21 ZINC001218419717 1135102124 /nfs/dbraw/zinc/10/21/24/1135102124.db2.gz OXYJVOJWCQVXTN-CJNGLKHVSA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@@H]1C[NH2+]CC[C@H]1Oc1nccc2c3ccccc3ccc21 ZINC001218426419 1135103571 /nfs/dbraw/zinc/10/35/71/1135103571.db2.gz WVXHKJMJDRWARB-FZKQIMNGSA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000316526960 1135167749 /nfs/dbraw/zinc/16/77/49/1135167749.db2.gz ZGEZSPWKQSPIRO-GTNSWQLSSA-N 1 0 297.358 3.515 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCc1cccc2ccsc21 ZINC001224030338 1135412405 /nfs/dbraw/zinc/41/24/05/1135412405.db2.gz OXSJIYUJXKZUJN-LBPRGKRZSA-N 1 0 264.414 3.513 20 5 CHBDRO C[C@H](OCCC[N+](C)(C)C)c1ccccc1C(F)(F)F ZINC001224619086 1135462723 /nfs/dbraw/zinc/46/27/23/1135462723.db2.gz KGKIYEVQBIWSIP-LBPRGKRZSA-N 1 0 290.349 3.879 20 5 CHBDRO C[C@H](OCC[N+](C)(C)C)c1cc(Cl)ccc1Cl ZINC001224776355 1135481615 /nfs/dbraw/zinc/48/16/15/1135481615.db2.gz VTOXMNNLLUBBQH-JTQLQIEISA-N 1 0 277.215 3.777 20 5 CHBDRO O=[N+]([O-])c1ccc([C@@H](Oc2ccncc2)C(F)(F)F)cc1 ZINC001225294355 1135537245 /nfs/dbraw/zinc/53/72/45/1135537245.db2.gz HSFSMBAXTRZESU-GFCCVEGCSA-N 1 0 298.220 3.672 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccccc1Oc1ccccc1 ZINC001225508463 1135579900 /nfs/dbraw/zinc/57/99/00/1135579900.db2.gz AOJKAOKIXKXSPY-HNNXBMFYSA-N 1 0 286.395 3.952 20 5 CHBDRO Cc1cccc(OC2CC[NH+](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC001225635810 1135600866 /nfs/dbraw/zinc/60/08/66/1135600866.db2.gz PSWPPCCYKIJLCU-UHFFFAOYSA-N 1 0 292.379 3.545 20 5 CHBDRO CCCCCc1ccc(O[C@H](C)C[N+](C)(C)C)cc1 ZINC001226390830 1135691737 /nfs/dbraw/zinc/69/17/37/1135691737.db2.gz KBPHDRYZOQVQIV-OAHLLOKOSA-N 1 0 264.433 3.893 20 5 CHBDRO CCCCC(=O)c1ccc(O[C@@H](C)C[N+](C)(C)C)cc1 ZINC001226772192 1135740019 /nfs/dbraw/zinc/74/00/19/1135740019.db2.gz OMQYGGGUXIWTEA-AWEZNQCLSA-N 1 0 278.416 3.533 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc(Cc2ccccc2)c1 ZINC001226873673 1135753265 /nfs/dbraw/zinc/75/32/65/1135753265.db2.gz ONRROGMNEVBUON-MRXNPFEDSA-N 1 0 284.423 3.751 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CC[C@@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000574662217 335037989 /nfs/dbraw/zinc/03/79/89/335037989.db2.gz GKTAPTWOQKMOMQ-UONOGXRCSA-N 1 0 276.380 3.818 20 5 CHBDRO COc1ccc(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000519968916 260035439 /nfs/dbraw/zinc/03/54/39/260035439.db2.gz VXLRSALXGJSINS-OCCSQVGLSA-N 1 0 292.379 3.614 20 5 CHBDRO CCCC[NH2+][C@@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000021518579 171314641 /nfs/dbraw/zinc/31/46/41/171314641.db2.gz CDJQEWHOKBGILD-AWEZNQCLSA-N 1 0 250.342 3.826 20 5 CHBDRO C[C@@H]([NH2+]CC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000037259257 173069180 /nfs/dbraw/zinc/06/91/80/173069180.db2.gz CWGDTVMUEZMJLF-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000037403651 173180012 /nfs/dbraw/zinc/18/00/12/173180012.db2.gz FYBDOAZIZPKZET-GHMZBOCLSA-N 1 0 282.771 3.726 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000042553226 174791364 /nfs/dbraw/zinc/79/13/64/174791364.db2.gz NACPUXICQAZXPI-UTUOFQBUSA-N 1 0 250.342 3.680 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000071205774 176079628 /nfs/dbraw/zinc/07/96/28/176079628.db2.gz RAXHZAWITMDASI-TUKIKUTGSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CCCC(F)(F)F ZINC000344531836 225080793 /nfs/dbraw/zinc/08/07/93/225080793.db2.gz FMGULEOVNBLINW-UTCJRWHESA-N 1 0 288.269 3.540 20 5 CHBDRO Cc1ccc(CCC[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cn1 ZINC000354567425 227034593 /nfs/dbraw/zinc/03/45/93/227034593.db2.gz MUDVGKGUFSNTMY-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1cc(NCCCCc2ccc([N+](=O)[O-])cc2)cc[nH+]1 ZINC000302562546 227865485 /nfs/dbraw/zinc/86/54/85/227865485.db2.gz MAHGDAVZRSTLKZ-UHFFFAOYSA-N 1 0 285.347 3.733 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000519968896 260035506 /nfs/dbraw/zinc/03/55/06/260035506.db2.gz UFZFOHOFEHLEQK-IUODEOHRSA-N 1 0 276.380 3.914 20 5 CHBDRO C[C@H](NCc1csc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000037771886 260116337 /nfs/dbraw/zinc/11/63/37/260116337.db2.gz JCCPVUGWLMOAGL-QMMMGPOBSA-N 1 0 298.314 3.785 20 5 CHBDRO Cc1ncsc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000071212586 260160172 /nfs/dbraw/zinc/16/01/72/260160172.db2.gz WOQCTNPJSIVMHQ-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000317599459 260284572 /nfs/dbraw/zinc/28/45/72/260284572.db2.gz NVMSFYUMPDBASY-QGZVFWFLSA-N 1 0 299.374 3.929 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1CCCC1(F)F ZINC000449491245 260652105 /nfs/dbraw/zinc/65/21/05/260652105.db2.gz FYJWYMZDNQDWLV-RYWCDNDXSA-N 1 0 296.317 3.633 20 5 CHBDRO CC[C@H](C)C[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000088293454 260731287 /nfs/dbraw/zinc/73/12/87/260731287.db2.gz YUGZQIMWVZNZEB-WCQYABFASA-N 1 0 264.369 3.818 20 5 CHBDRO CC[C@H](C)C[C@@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000088297608 260749794 /nfs/dbraw/zinc/74/97/94/260749794.db2.gz SCBDJBIRBSPMER-NWDGAFQWSA-N 1 0 280.368 3.518 20 5 CHBDRO CSC(C)(C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000154261259 261089499 /nfs/dbraw/zinc/08/94/99/261089499.db2.gz NYBVLVQCYITCEA-LLVKDONJSA-N 1 0 282.409 3.695 20 5 CHBDRO Cc1c([C@H](C)[NH2+]Cc2cccs2)cccc1[N+](=O)[O-] ZINC000156512893 261124861 /nfs/dbraw/zinc/12/48/61/261124861.db2.gz RXVCMIMMZDBGMT-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000318503141 261223088 /nfs/dbraw/zinc/22/30/88/261223088.db2.gz JOXIPXZVLGHDCH-KRWDZBQOSA-N 1 0 296.370 3.989 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000318503143 261223370 /nfs/dbraw/zinc/22/33/70/261223370.db2.gz JOXIPXZVLGHDCH-QGZVFWFLSA-N 1 0 296.370 3.989 20 5 CHBDRO CC[N@H+](Cc1ccccn1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000161123318 261237414 /nfs/dbraw/zinc/23/74/14/261237414.db2.gz FMTMYCHAYMPHFI-CYBMUJFWSA-N 1 0 285.347 3.573 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000518774338 261637381 /nfs/dbraw/zinc/63/73/81/261637381.db2.gz AMNGHMMOLBTDMI-IUODEOHRSA-N 1 0 276.380 3.996 20 5 CHBDRO CCC[C@H]([NH2+]CCCCF)c1cccc([N+](=O)[O-])c1 ZINC000311719689 262339920 /nfs/dbraw/zinc/33/99/20/262339920.db2.gz PESSBQPOZVVEAX-AWEZNQCLSA-N 1 0 268.332 3.775 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]2c2ccco2)cc1[N+](=O)[O-] ZINC000414344595 262847229 /nfs/dbraw/zinc/84/72/29/262847229.db2.gz RRGPDNRHJANWAQ-IACUBPJLSA-N 1 0 286.331 3.703 20 5 CHBDRO CCOC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000189348530 264292024 /nfs/dbraw/zinc/29/20/24/264292024.db2.gz FPAQHVOQYPIXCI-ZFWWWQNUSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@@H]([NH2+]CC1CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000525858709 264503524 /nfs/dbraw/zinc/50/35/24/264503524.db2.gz UMEMIMCUUFPZAT-LLVKDONJSA-N 1 0 262.353 3.682 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000226173841 266031487 /nfs/dbraw/zinc/03/14/87/266031487.db2.gz XOXSDEGMCHOOOO-XUJVJEKNSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1c(C[NH2+]C2CCC3(CC3)CC2)cccc1[N+](=O)[O-] ZINC000362921508 267061069 /nfs/dbraw/zinc/06/10/69/267061069.db2.gz FPOODMVUANTOOV-UHFFFAOYSA-N 1 0 274.364 3.716 20 5 CHBDRO CC[C@H]([NH2+]CCC=C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000397750000 327920564 /nfs/dbraw/zinc/92/05/64/327920564.db2.gz FMKYSLOUVHTVBB-HNNXBMFYSA-N 1 0 262.353 3.992 20 5 CHBDRO CC[C@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540917840 327935877 /nfs/dbraw/zinc/93/58/77/327935877.db2.gz GWLNLROWSHKZHT-SMDDNHRTSA-N 1 0 296.798 3.959 20 5 CHBDRO C[C@@H]1CCC[C@@](CNc2ccccc2[N+](=O)[O-])([NH+](C)C)C1 ZINC000040669963 328015277 /nfs/dbraw/zinc/01/52/77/328015277.db2.gz YYMITHVCKPSMSE-CZUORRHYSA-N 1 0 291.395 3.517 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccsc1 ZINC000531681894 328020856 /nfs/dbraw/zinc/02/08/56/328020856.db2.gz AUWSQPSGSSMAAO-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])o1 ZINC000160847022 328089612 /nfs/dbraw/zinc/08/96/12/328089612.db2.gz XQMWEIIHRAMQAW-FNORWQNLSA-N 1 0 286.331 3.641 20 5 CHBDRO COC1([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CCC1 ZINC000414307101 328154433 /nfs/dbraw/zinc/15/44/33/328154433.db2.gz OSBARWHAJOYEIE-STQMWFEESA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000388759630 328300611 /nfs/dbraw/zinc/30/06/11/328300611.db2.gz DLVPKPCASIBTPS-LALPHHSUSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000388759635 328300647 /nfs/dbraw/zinc/30/06/47/328300647.db2.gz DLVPKPCASIBTPS-ZOWXZIJZSA-N 1 0 262.353 3.824 20 5 CHBDRO CCCC[C@H](COC)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000531969184 328356306 /nfs/dbraw/zinc/35/63/06/328356306.db2.gz RNXSVWLPUKXDIB-UKRRQHHQSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@@H](c1ccccc1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000532038680 328396912 /nfs/dbraw/zinc/39/69/12/328396912.db2.gz VOCWATCMFAIICM-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000398213976 326875203 /nfs/dbraw/zinc/87/52/03/326875203.db2.gz LACRMCQASZLKJE-VXGBXAGGSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CC[C@H]2C2CC2)cc1 ZINC000558268929 327084072 /nfs/dbraw/zinc/08/40/72/327084072.db2.gz MYHYJWUYLFSWID-IRXDYDNUSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@H]([NH2+]C1CC(C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000558293436 327085890 /nfs/dbraw/zinc/08/58/90/327085890.db2.gz GEQVLRCQCYSVCD-PUSIOWJLSA-N 1 0 288.269 3.586 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]3C[C@H]32)cc1[N+](=O)[O-] ZINC000558699786 327115675 /nfs/dbraw/zinc/11/56/75/327115675.db2.gz QZAOTOJYNAISNL-MHEUCROKSA-N 1 0 274.364 3.742 20 5 CHBDRO CC(C)(C)C1CC([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000559322309 327159144 /nfs/dbraw/zinc/15/91/44/327159144.db2.gz JQEWRYHGGKDTLA-UHFFFAOYSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCC2(F)CCC2)cccc1[N+](=O)[O-] ZINC000554372323 327215836 /nfs/dbraw/zinc/21/58/36/327215836.db2.gz LCMSSAPLMATXLS-GFCCVEGCSA-N 1 0 280.343 3.836 20 5 CHBDRO CC1(C)C[C@@H]([NH2+][C@@H]2CCC[C@@H]2F)c2cc([N+](=O)[O-])ccc21 ZINC000559917521 327271134 /nfs/dbraw/zinc/27/11/34/327271134.db2.gz QJFNGAKWURYCOD-RRFJBIMHSA-N 1 0 292.354 3.797 20 5 CHBDRO CC(C)=CCC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000562310985 327467721 /nfs/dbraw/zinc/46/77/21/327467721.db2.gz OHCNKFRNYRPHCP-CYBMUJFWSA-N 1 0 262.353 3.910 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)C1CCCCC1 ZINC000052338162 328641133 /nfs/dbraw/zinc/64/11/33/328641133.db2.gz MPCUDZOQIYGOEO-LBPRGKRZSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1csc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000563898035 328699466 /nfs/dbraw/zinc/69/94/66/328699466.db2.gz BQEYFJACOBVPRB-AWEZNQCLSA-N 1 0 288.372 3.742 20 5 CHBDRO C[C@H]([NH2+][C@@H](C1CC1)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000324663208 328772085 /nfs/dbraw/zinc/77/20/85/328772085.db2.gz ISQXOQOAXYQDJG-MEDUHNTESA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1cc(N2C[C@H](C)[C@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302157998 328831143 /nfs/dbraw/zinc/83/11/43/328831143.db2.gz JCOPGDRXBRTRLN-PHIMTYICSA-N 1 0 285.347 3.544 20 5 CHBDRO CC[C@H]([NH2+]CC1(SC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000193802285 329062986 /nfs/dbraw/zinc/06/29/86/329062986.db2.gz ZDEVAKFMAHMXJB-AWEZNQCLSA-N 1 0 294.420 3.921 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCC2(CC2)C1 ZINC000186999011 329352899 /nfs/dbraw/zinc/35/28/99/329352899.db2.gz NHTGYGPHTPCXJD-ZDUSSCGKSA-N 1 0 274.364 3.840 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C[C@H]1C ZINC000251966693 329937153 /nfs/dbraw/zinc/93/71/53/329937153.db2.gz XYATZFKNFFDMML-FOGDFJRCSA-N 1 0 268.382 3.571 20 5 CHBDRO CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CCO1 ZINC000421854584 330088644 /nfs/dbraw/zinc/08/86/44/330088644.db2.gz KWLSFCFZUOAPOR-HZSPNIEDSA-N 1 0 292.379 3.511 20 5 CHBDRO CCCC[C@H](C[NH3+])N[C@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000423301651 330189038 /nfs/dbraw/zinc/18/90/38/330189038.db2.gz UHMWYMNNSWYPOB-GDBMZVCRSA-N 1 0 293.411 3.543 20 5 CHBDRO Cc1cc(N)cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000423472512 330205273 /nfs/dbraw/zinc/20/52/73/330205273.db2.gz FZKVLKIWEXHVEM-ZDUSSCGKSA-N 1 0 299.374 3.645 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(C(C)C)CC1 ZINC000536838398 330232930 /nfs/dbraw/zinc/23/29/30/330232930.db2.gz IHBVCKRWUUZWKF-CYBMUJFWSA-N 1 0 276.380 3.990 20 5 CHBDRO CC(C)c1ccc(C[N@H+]2[C@H](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000527238788 330240475 /nfs/dbraw/zinc/24/04/75/330240475.db2.gz VQDGSMRFOFYDEX-TXEJJXNPSA-N 1 0 262.353 3.701 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000035257021 330244951 /nfs/dbraw/zinc/24/49/51/330244951.db2.gz YPCIHQHRDHAXFJ-UKRRQHHQSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000424145917 330292151 /nfs/dbraw/zinc/29/21/51/330292151.db2.gz VUTDYJAESLCDRX-WPGHFRTFSA-N 1 0 274.364 3.682 20 5 CHBDRO C[C@H]([NH2+][C@H]1C[C@@H]1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000536879202 330315424 /nfs/dbraw/zinc/31/54/24/330315424.db2.gz UCEIQTZOQXDJLO-OWQGQXMQSA-N 1 0 296.370 3.877 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000424329018 330341876 /nfs/dbraw/zinc/34/18/76/330341876.db2.gz RMPZDDSZRXPRIF-KBPBESRZSA-N 1 0 260.337 3.578 20 5 CHBDRO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]2CC3CCC2CC3)c(F)c1 ZINC000432997845 330611802 /nfs/dbraw/zinc/61/18/02/330611802.db2.gz YOIYNRFFCVYINP-HEEBCNDISA-N 1 0 296.317 3.541 20 5 CHBDRO CC1(C)C[C@H]([NH2+]Cc2ccoc2)c2cc([N+](=O)[O-])ccc21 ZINC000433170309 330618710 /nfs/dbraw/zinc/61/87/10/330618710.db2.gz VUHWATCMRCBCIR-HNNXBMFYSA-N 1 0 286.331 3.700 20 5 CHBDRO CC1(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000434757763 330644407 /nfs/dbraw/zinc/64/44/07/330644407.db2.gz QKIJOAXPZIIJDB-UHFFFAOYSA-N 1 0 282.771 3.571 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1CCC2(CC2)CC1 ZINC000434772249 330644883 /nfs/dbraw/zinc/64/48/83/330644883.db2.gz CMCJEBPKPLXTDF-HWKANZROSA-N 1 0 286.375 3.920 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@@H](C)C1 ZINC000437044206 330691767 /nfs/dbraw/zinc/69/17/67/330691767.db2.gz LEZLCPZIOFNTQM-NFAWXSAZSA-N 1 0 276.380 3.694 20 5 CHBDRO CC(C)[C@H]1CC[C@@H]1[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449350914 330917438 /nfs/dbraw/zinc/91/74/38/330917438.db2.gz YCGKMAPRKOYJQR-GLQYFDAESA-N 1 0 262.353 3.680 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CCCC1(F)F ZINC000449491242 330930575 /nfs/dbraw/zinc/93/05/75/330930575.db2.gz FYJWYMZDNQDWLV-AGLBCWCQSA-N 1 0 296.317 3.633 20 5 CHBDRO CSCCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451542892 331033263 /nfs/dbraw/zinc/03/32/63/331033263.db2.gz AQJKKBSAYBWYKK-AWEZNQCLSA-N 1 0 294.420 3.527 20 5 CHBDRO CC[C@H](F)C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543734 331033572 /nfs/dbraw/zinc/03/35/72/331033572.db2.gz CJRZNEFMMCGMPM-KBPBESRZSA-N 1 0 280.343 3.522 20 5 CHBDRO CCC1([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000453273963 331109817 /nfs/dbraw/zinc/10/98/17/331109817.db2.gz ALAAVHOCQICSME-HIFRSBDPSA-N 1 0 288.391 3.838 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCC2CC(F)(F)C2)cc1[N+](=O)[O-] ZINC000453399052 331128500 /nfs/dbraw/zinc/12/85/00/331128500.db2.gz AKJMOTGJCNKQJB-NSHDSACASA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCC2CC(F)(F)C2)cc1[N+](=O)[O-] ZINC000453399051 331128520 /nfs/dbraw/zinc/12/85/20/331128520.db2.gz AKJMOTGJCNKQJB-LLVKDONJSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCC2CC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000453403866 331129021 /nfs/dbraw/zinc/12/90/21/331129021.db2.gz DFDHZVKMXFQPJB-LLVKDONJSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C1CC1)C1CCC1 ZINC000453600797 331135838 /nfs/dbraw/zinc/13/58/38/331135838.db2.gz CICYEJBJFXQXMO-INIZCTEOSA-N 1 0 274.364 3.572 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000164056645 331157373 /nfs/dbraw/zinc/15/73/73/331157373.db2.gz XHLBQDMOXCDDNN-JSGCOSHPSA-N 1 0 282.409 3.777 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC1CCC(F)(F)CC1 ZINC000459286761 331274592 /nfs/dbraw/zinc/27/45/92/331274592.db2.gz HUAJAVWZGKYSPY-UHFFFAOYSA-N 1 0 298.333 3.852 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459753334 331298550 /nfs/dbraw/zinc/29/85/50/331298550.db2.gz IXUAMFVRXHDKKV-DRPJVOAASA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459797144 331301628 /nfs/dbraw/zinc/30/16/28/331301628.db2.gz ZXBRGIAJEGPZQF-SHUKQUCYSA-N 1 0 274.364 3.742 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])C(C)(C)C ZINC000464488465 331361432 /nfs/dbraw/zinc/36/14/32/331361432.db2.gz ASSGAQSDXGOOTH-CQSZACIVSA-N 1 0 298.358 3.657 20 5 CHBDRO Cc1ccccc1[C@H]1C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000466400547 331395045 /nfs/dbraw/zinc/39/50/45/331395045.db2.gz DKBKJNGSEKYPBL-WKILWMFISA-N 1 0 296.370 3.939 20 5 CHBDRO CC1=CCC[C@H](C)[C@@H]1C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468003093 331426570 /nfs/dbraw/zinc/42/65/70/331426570.db2.gz HPPIDHCTGHWSSP-GOEBONIOSA-N 1 0 288.391 3.719 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)C ZINC000468630016 331437767 /nfs/dbraw/zinc/43/77/67/331437767.db2.gz KJGWWQXFEFZEML-XYOKQWHBSA-N 1 0 262.353 3.634 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000469784154 331458505 /nfs/dbraw/zinc/45/85/05/331458505.db2.gz VJMJBBOPSHCWNW-LLVKDONJSA-N 1 0 296.798 3.959 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1CCSCC1)c1ccccc1[N+](=O)[O-] ZINC000474892275 331603262 /nfs/dbraw/zinc/60/32/62/331603262.db2.gz RSZHECNWIQXLHU-RYUDHWBXSA-N 1 0 294.420 3.777 20 5 CHBDRO C[C@H]1Cc2ccccc2[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000482516684 331836431 /nfs/dbraw/zinc/83/64/31/331836431.db2.gz CDFSRLZLYZUENF-UGSOOPFHSA-N 1 0 296.370 3.660 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(F)F)CC1 ZINC000483549441 331879059 /nfs/dbraw/zinc/87/90/59/331879059.db2.gz YEMPXHHWDUNNGB-SNVBAGLBSA-N 1 0 284.306 3.633 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C)[C@H]1C ZINC000490067356 332079893 /nfs/dbraw/zinc/07/98/93/332079893.db2.gz MGHMCNSXHMFOMY-UHTWSYAYSA-N 1 0 262.353 3.695 20 5 CHBDRO C[C@H]([NH2+]C1CC(OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000490131096 332082364 /nfs/dbraw/zinc/08/23/64/332082364.db2.gz SQVMXNDGRYLBFK-ZOODHJKOSA-N 1 0 292.379 3.592 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490429313 332089445 /nfs/dbraw/zinc/08/94/45/332089445.db2.gz DYAJWASUDKCOHB-CQSZACIVSA-N 1 0 280.343 3.744 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)c1 ZINC000491582380 332241313 /nfs/dbraw/zinc/24/13/13/332241313.db2.gz XLLSZOFIBUICHM-ZDUSSCGKSA-N 1 0 298.333 3.900 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492278554 332390225 /nfs/dbraw/zinc/39/02/25/332390225.db2.gz WMIKGBCDNYFBQP-SNVBAGLBSA-N 1 0 270.760 3.726 20 5 CHBDRO CCC[C@H](C)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000492310153 332391946 /nfs/dbraw/zinc/39/19/46/332391946.db2.gz GCBLDZDKSOSIRN-LBPRGKRZSA-N 1 0 264.369 3.856 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000495440165 332518978 /nfs/dbraw/zinc/51/89/78/332518978.db2.gz PNPGOUSHQQXXTA-GHMZBOCLSA-N 1 0 284.787 3.815 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)cccc1[N+](=O)[O-] ZINC000502451609 332660578 /nfs/dbraw/zinc/66/05/78/332660578.db2.gz LGNLVUZHLUAEII-NUEKZKHPSA-N 1 0 274.364 3.572 20 5 CHBDRO CCCC[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504912523 332724682 /nfs/dbraw/zinc/72/46/82/332724682.db2.gz XEMJFHXXRFRIBL-GFCCVEGCSA-N 1 0 282.409 3.855 20 5 CHBDRO CCCCC[NH2+][C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000504927213 332725338 /nfs/dbraw/zinc/72/53/38/332725338.db2.gz NTVFKEHLBPUMKN-GFCCVEGCSA-N 1 0 280.368 3.834 20 5 CHBDRO C[C@@H]1CC[C@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000513106066 333004569 /nfs/dbraw/zinc/00/45/69/333004569.db2.gz GMPFRUQFOPVTTP-IAQYHMDHSA-N 1 0 286.331 3.743 20 5 CHBDRO COc1ccc(C[N@@H+]2CCC[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000513753310 333037710 /nfs/dbraw/zinc/03/77/10/333037710.db2.gz BYDVEHBZTXCMTC-HNNXBMFYSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000311920648 333074351 /nfs/dbraw/zinc/07/43/51/333074351.db2.gz DQOGJFXGJMOFNX-SMDDNHRTSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000178655888 333076601 /nfs/dbraw/zinc/07/66/01/333076601.db2.gz YQIOBWYYWZDVJY-LHRNQBEKSA-N 1 0 282.343 3.959 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1(C3CC3)CC1)CCC2 ZINC000516860822 333084419 /nfs/dbraw/zinc/08/44/19/333084419.db2.gz OCOMEYYZEDVRMT-OAHLLOKOSA-N 1 0 272.348 3.504 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CC12CCCC2 ZINC000517173029 333094014 /nfs/dbraw/zinc/09/40/14/333094014.db2.gz POXNNIRFVXIGJW-DZGCQCFKSA-N 1 0 272.348 3.504 20 5 CHBDRO CCOc1cc(C[N@H+](CC2CC2)C(C)C)ccc1[N+](=O)[O-] ZINC000517655399 333105186 /nfs/dbraw/zinc/10/51/86/333105186.db2.gz HUGFILNLDIBCLN-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CCC1CC1 ZINC000182916952 333118027 /nfs/dbraw/zinc/11/80/27/333118027.db2.gz QFSOSGJWDFFODW-GFCCVEGCSA-N 1 0 262.353 3.696 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCCC2CCCC2)c1 ZINC000220720023 333168648 /nfs/dbraw/zinc/16/86/48/333168648.db2.gz MJXYYYRTGGFFJM-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@@](C)(O)CCC)c1cccc([N+](=O)[O-])c1 ZINC000223508115 333208826 /nfs/dbraw/zinc/20/88/26/333208826.db2.gz RJXKLOKIEUIVBP-CVEARBPZSA-N 1 0 294.395 3.577 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@H](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000226183110 333253401 /nfs/dbraw/zinc/25/34/01/333253401.db2.gz CRBNQPYOPZOHTD-SGMGOOAPSA-N 1 0 292.379 3.518 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CCc1ccccc1)C1CC1 ZINC000195732298 333262461 /nfs/dbraw/zinc/26/24/61/333262461.db2.gz VLDYANPMLBAPGV-UHFFFAOYSA-N 1 0 296.370 3.802 20 5 CHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000522418964 333286748 /nfs/dbraw/zinc/28/67/48/333286748.db2.gz VZDSXMYEIIKKTH-YOEHRIQHSA-N 1 0 296.370 3.973 20 5 CHBDRO Cc1ccc(C[C@H](C)[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000523438805 333326796 /nfs/dbraw/zinc/32/67/96/333326796.db2.gz REWABNYJPKOJIG-HNNXBMFYSA-N 1 0 298.386 3.966 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000523552900 333332908 /nfs/dbraw/zinc/33/29/08/333332908.db2.gz BVIWSGFJBOYOAU-AWEZNQCLSA-N 1 0 262.353 3.749 20 5 CHBDRO CC1CCC([N@H+](C)CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000523702023 333340153 /nfs/dbraw/zinc/34/01/53/333340153.db2.gz XIPIDDTXOQQZNO-UHFFFAOYSA-N 1 0 276.380 3.648 20 5 CHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000303671710 333345276 /nfs/dbraw/zinc/34/52/76/333345276.db2.gz JVYIHFPOAMEJKP-HNNXBMFYSA-N 1 0 262.353 3.605 20 5 CHBDRO CCC(C)(C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000236858289 333375856 /nfs/dbraw/zinc/37/58/56/333375856.db2.gz YCTHCXVBCWBVFV-UHFFFAOYSA-N 1 0 264.369 3.996 20 5 CHBDRO CCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236864166 333375883 /nfs/dbraw/zinc/37/58/83/333375883.db2.gz WVYKEOXNFUWMKS-UHFFFAOYSA-N 1 0 276.361 3.823 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000524766854 333387664 /nfs/dbraw/zinc/38/76/64/333387664.db2.gz XKBWFUUUHKTDBD-OAHLLOKOSA-N 1 0 262.353 3.607 20 5 CHBDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000576021255 335142537 /nfs/dbraw/zinc/14/25/37/335142537.db2.gz WSYYFIBKHHIYAU-AQGQNPDFSA-N 1 0 274.364 3.871 20 5 CHBDRO C[C@@H]([NH2+]CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000037249717 333523886 /nfs/dbraw/zinc/52/38/86/333523886.db2.gz LQHCNVFUBPZWOL-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO CC(C)CCC[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037562618 333534838 /nfs/dbraw/zinc/53/48/38/333534838.db2.gz MDAUZGZOMBDQFZ-NSHDSACASA-N 1 0 270.398 3.961 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCC1CC1 ZINC000530326545 333542161 /nfs/dbraw/zinc/54/21/61/333542161.db2.gz VARUNANCNOVYPK-RAXLEYEMSA-N 1 0 274.364 3.778 20 5 CHBDRO CC(C)=CCC[C@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000537968096 333552074 /nfs/dbraw/zinc/55/20/74/333552074.db2.gz QDNNNZILQLWOFK-AWEZNQCLSA-N 1 0 292.379 3.698 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC(C)(C)C ZINC000537991942 333569769 /nfs/dbraw/zinc/56/97/69/333569769.db2.gz ULDSBONXXKJFRA-GFCCVEGCSA-N 1 0 264.369 3.990 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)cc1 ZINC000538399650 333588731 /nfs/dbraw/zinc/58/87/31/333588731.db2.gz VWSBLOYCCWUCMY-RRFJBIMHSA-N 1 0 274.364 3.653 20 5 CHBDRO Cc1cc(Cl)ccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000129037093 333739331 /nfs/dbraw/zinc/73/93/31/333739331.db2.gz WYHVHSIBDJEJKC-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000546888689 334054247 /nfs/dbraw/zinc/05/42/47/334054247.db2.gz UJOCRWVYJNKHKX-ZJUUUORDSA-N 1 0 290.285 3.976 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000078463069 334133969 /nfs/dbraw/zinc/13/39/69/334133969.db2.gz OOJRRGUPKLBNIY-BZPMIXESSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc(C[NH2+]C2CCC(C)(C)CC2)cc1[N+](=O)[O-] ZINC000079676337 334159651 /nfs/dbraw/zinc/15/96/51/334159651.db2.gz WUIFDIFFQCYSLX-UHFFFAOYSA-N 1 0 276.380 3.962 20 5 CHBDRO Cc1ccsc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000564358540 334175534 /nfs/dbraw/zinc/17/55/34/334175534.db2.gz SIQKRFPGGOBTKI-UHFFFAOYSA-N 1 0 290.388 3.905 20 5 CHBDRO CC[C@H]([NH2+]C[C@H](C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000081046042 334177266 /nfs/dbraw/zinc/17/72/66/334177266.db2.gz ZLPUPJNCKNGHHS-WFASDCNBSA-N 1 0 264.369 3.928 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCC[C@@H](C2CC2)C1 ZINC000081638248 334201693 /nfs/dbraw/zinc/20/16/93/334201693.db2.gz BDBXVWQFIOGXBO-UKRRQHHQSA-N 1 0 274.364 3.653 20 5 CHBDRO CC1=CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000551279308 334244816 /nfs/dbraw/zinc/24/48/16/334244816.db2.gz DWBCQILFFIOVCT-LBPRGKRZSA-N 1 0 280.755 3.837 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000249384296 334332979 /nfs/dbraw/zinc/33/29/79/334332979.db2.gz WYUJSULLGRCRIC-QJPTWQEYSA-N 1 0 250.342 3.680 20 5 CHBDRO C[C@@H]([NH2+]CC1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000552898765 334350045 /nfs/dbraw/zinc/35/00/45/334350045.db2.gz CPTPHBBVKPJCEQ-CYBMUJFWSA-N 1 0 296.370 3.660 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2(C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000090772750 334367678 /nfs/dbraw/zinc/36/76/78/334367678.db2.gz MBBCWCGGFXKBBR-GFCCVEGCSA-N 1 0 274.364 3.744 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@H]1C ZINC000252195130 334376322 /nfs/dbraw/zinc/37/63/22/334376322.db2.gz SFRMHZKYFACQCC-XUJVJEKNSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000554738878 334450307 /nfs/dbraw/zinc/45/03/07/334450307.db2.gz MUXCOWQTSYXXSY-GUYCJALGSA-N 1 0 296.370 3.975 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000566678215 334660122 /nfs/dbraw/zinc/66/01/22/334660122.db2.gz XEWBOEAFVDDXKF-WCFLWFBJSA-N 1 0 266.316 3.526 20 5 CHBDRO Cc1cscc1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000566747789 334662908 /nfs/dbraw/zinc/66/29/08/334662908.db2.gz KKDMHPQHEQPXOC-CQSZACIVSA-N 1 0 288.372 3.742 20 5 CHBDRO O=[N+]([O-])c1ccc(OCCC[NH+]2CCCCC2)c(Cl)c1 ZINC000566759487 334663347 /nfs/dbraw/zinc/66/33/47/334663347.db2.gz KKCSSGNTJJYHGN-UHFFFAOYSA-N 1 0 298.770 3.503 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC(C)(F)F ZINC000567015558 334673518 /nfs/dbraw/zinc/67/35/18/334673518.db2.gz YIMURNOLFSDHLN-LLVKDONJSA-N 1 0 286.322 3.989 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000324327599 334884310 /nfs/dbraw/zinc/88/43/10/334884310.db2.gz PTKQSQCSWWJDJR-FZMZJTMJSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H]1CC2CCC1CC2 ZINC000381776854 336072810 /nfs/dbraw/zinc/07/28/10/336072810.db2.gz ZACLBLNEDXTTKY-PSPOIRCVSA-N 1 0 294.420 3.961 20 5 CHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000383626633 336115946 /nfs/dbraw/zinc/11/59/46/336115946.db2.gz UIFHWZUPYNSXFD-WCQYABFASA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@H](CC(C)(C)C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000384490769 336124941 /nfs/dbraw/zinc/12/49/41/336124941.db2.gz KUOFPVAACFVEAE-SECBINFHSA-N 1 0 256.371 3.571 20 5 CHBDRO Cc1ccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000581919176 336165786 /nfs/dbraw/zinc/16/57/86/336165786.db2.gz AYAIKMRAWLOFSR-ZDUSSCGKSA-N 1 0 288.347 3.698 20 5 CHBDRO CCSCC[C@@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000581954009 336178859 /nfs/dbraw/zinc/17/88/59/336178859.db2.gz GPGXOAWDRSNGPP-BXUZGUMPSA-N 1 0 294.420 3.703 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC23CCCC3)cc1[N+](=O)[O-] ZINC000387101058 336185203 /nfs/dbraw/zinc/18/52/03/336185203.db2.gz HGQPYUPNLFIQKP-WFASDCNBSA-N 1 0 274.364 3.887 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000387189701 336187733 /nfs/dbraw/zinc/18/77/33/336187733.db2.gz WFFZHIIMXKJSHC-SMDDNHRTSA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](C)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000480666341 533944381 /nfs/dbraw/zinc/94/43/81/533944381.db2.gz ZYWSSKLVLLOUIJ-PSASIEDQSA-N 1 0 290.285 3.752 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1cccnc1 ZINC000290314973 521329222 /nfs/dbraw/zinc/32/92/22/521329222.db2.gz CKRRCBGKEYPCEA-AWEZNQCLSA-N 1 0 299.374 3.881 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000050015539 522883476 /nfs/dbraw/zinc/88/34/76/522883476.db2.gz YHBMIKAPBHYWLH-OAHLLOKOSA-N 1 0 288.322 3.975 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1C ZINC000050564680 524232352 /nfs/dbraw/zinc/23/23/52/524232352.db2.gz JKNWDXIKNWROJR-GHMZBOCLSA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000050225122 524594958 /nfs/dbraw/zinc/59/49/58/524594958.db2.gz RNZNBHCFUPPMKO-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCCc3sccc32)c1 ZINC000061329425 527386438 /nfs/dbraw/zinc/38/64/38/527386438.db2.gz HYKCHJCLEFNGQY-AWEZNQCLSA-N 1 0 288.372 3.824 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353610671 529057891 /nfs/dbraw/zinc/05/78/91/529057891.db2.gz WHNVWDZHPKJTTL-UHFFFAOYSA-N 1 0 268.382 3.668 20 5 CHBDRO CC[C@@H]([NH2+]CCC1(OC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000294483280 529160137 /nfs/dbraw/zinc/16/01/37/529160137.db2.gz HKDLJOJEPHETKQ-OAHLLOKOSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000130286936 1125619789 /nfs/dbraw/zinc/61/97/89/1125619789.db2.gz YQWKOUAKWNWZMA-INIZCTEOSA-N 1 0 286.331 3.541 20 5 CHBDRO CO[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000886562118 1125691681 /nfs/dbraw/zinc/69/16/81/1125691681.db2.gz QRWVRCZBWNDYOC-HZSPNIEDSA-N 1 0 292.379 3.593 20 5 CHBDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000121968895 1125780828 /nfs/dbraw/zinc/78/08/28/1125780828.db2.gz LZEDDBBJPIGMLZ-CHWSQXEVSA-N 1 0 294.395 3.757 20 5 CHBDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000121968741 1125781723 /nfs/dbraw/zinc/78/17/23/1125781723.db2.gz LZEDDBBJPIGMLZ-STQMWFEESA-N 1 0 294.395 3.757 20 5 CHBDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000482515261 1126762754 /nfs/dbraw/zinc/76/27/54/1126762754.db2.gz VYLAIAMRJOYIDC-FZSTZKMBSA-N 1 0 274.364 3.728 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000036721121 1126798875 /nfs/dbraw/zinc/79/88/75/1126798875.db2.gz WAPWTQJKPZLZHW-WBMJQRKESA-N 1 0 285.347 3.792 20 5 CHBDRO CC[C@@H]([NH2+]CCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000036721104 1126799208 /nfs/dbraw/zinc/79/92/08/1126799208.db2.gz GPOOVYCHCQBCQP-OAHLLOKOSA-N 1 0 290.388 3.940 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC[C@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000180260479 1126841594 /nfs/dbraw/zinc/84/15/94/1126841594.db2.gz KNSXTKUCTLYNTF-UONOGXRCSA-N 1 0 292.379 3.513 20 5 CHBDRO CC[C@H](C[C@](C)(O)CC)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000924798371 1126852672 /nfs/dbraw/zinc/85/26/72/1126852672.db2.gz NIGKRIXGJQJSPH-XNRPHZJLSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CCc1ccncc1 ZINC000181482256 1126856124 /nfs/dbraw/zinc/85/61/24/1126856124.db2.gz GLBJUMUATZZNKR-CQSZACIVSA-N 1 0 299.374 3.534 20 5 CHBDRO O=[N+]([O-])c1cccc(COc2ccc([C@@H]3CCC[NH2+]3)cc2)c1 ZINC000905617880 1126909800 /nfs/dbraw/zinc/90/98/00/1126909800.db2.gz RQUGIPOUSLRDFU-KRWDZBQOSA-N 1 0 298.342 3.598 20 5 CHBDRO O=[N+]([O-])c1ccc(COc2ccc([C@@H]3CCC[NH2+]3)cc2)cc1 ZINC000905616086 1126909991 /nfs/dbraw/zinc/90/99/91/1126909991.db2.gz CQIOJEVYXNSTHV-KRWDZBQOSA-N 1 0 298.342 3.598 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCCC(F)(F)F ZINC000149060796 1126925027 /nfs/dbraw/zinc/92/50/27/1126925027.db2.gz IPKHKVDCZJONCK-UHFFFAOYSA-N 1 0 296.676 3.680 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccsc1)CCC2 ZINC000192669440 1126963505 /nfs/dbraw/zinc/96/35/05/1126963505.db2.gz ZDJUKDJJODYXJP-HNNXBMFYSA-N 1 0 288.372 3.824 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000487291784 1127030774 /nfs/dbraw/zinc/03/07/74/1127030774.db2.gz RZMRUPQBBCPLQX-NEPJUHHUSA-N 1 0 250.342 3.634 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000042553328 1127055029 /nfs/dbraw/zinc/05/50/29/1127055029.db2.gz UPVNJESWPIUHNT-NXEZZACHSA-N 1 0 270.760 3.772 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cncs2)cc1[N+](=O)[O-] ZINC000271474708 1127084888 /nfs/dbraw/zinc/08/48/88/1127084888.db2.gz JLIMABLZHMFNPD-WDEREUQCSA-N 1 0 291.376 3.772 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccncc1C)c1cccc([N+](=O)[O-])c1 ZINC000271511814 1127087321 /nfs/dbraw/zinc/08/73/21/1127087321.db2.gz NXGUGZWLSONDDT-KRWDZBQOSA-N 1 0 299.374 3.582 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1CN1CC[C@@H]1c1ccccc1 ZINC000348541387 1127121029 /nfs/dbraw/zinc/12/10/29/1127121029.db2.gz WTENIOCTGZRILN-OAHLLOKOSA-N 1 0 286.306 3.681 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000350053190 1127171358 /nfs/dbraw/zinc/17/13/58/1127171358.db2.gz YYNJMRWUIGIGID-KRWDZBQOSA-N 1 0 297.358 3.539 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](C3CC3)C2)c(Cl)c1 ZINC000588977730 1127209101 /nfs/dbraw/zinc/20/91/01/1127209101.db2.gz GPAIBIWJGFTOHU-LBPRGKRZSA-N 1 0 294.782 3.870 20 5 CHBDRO CC(C)CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000045751703 1127293357 /nfs/dbraw/zinc/29/33/57/1127293357.db2.gz IKEQXUDJUOKFGO-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H]1C[C@H](C)CC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355108023 1127317477 /nfs/dbraw/zinc/31/74/77/1127317477.db2.gz KBYJZIVHXZCVIQ-GHMZBOCLSA-N 1 0 268.382 3.524 20 5 CHBDRO Cc1ccccc1C1([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000592138185 1127337666 /nfs/dbraw/zinc/33/76/66/1127337666.db2.gz WBBJVSGISXNJLJ-UHFFFAOYSA-N 1 0 282.343 3.682 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC23CCCC3)c(Cl)c1 ZINC000593038662 1127369238 /nfs/dbraw/zinc/36/92/38/1127369238.db2.gz LIKQDVMCDRVUGI-UHFFFAOYSA-N 1 0 280.755 3.767 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C1(C2CCC2)CC1 ZINC000594507432 1127419699 /nfs/dbraw/zinc/41/96/99/1127419699.db2.gz NCXQELVAUPGHLG-AWEZNQCLSA-N 1 0 272.348 3.504 20 5 CHBDRO C[C@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000594725392 1127429719 /nfs/dbraw/zinc/42/97/19/1127429719.db2.gz KCAAHBLWZMLFOW-GWCFXTLKSA-N 1 0 284.306 3.681 20 5 CHBDRO CC[C@@](C)([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000594982070 1127443151 /nfs/dbraw/zinc/44/31/51/1127443151.db2.gz YOXLZXAIIRCZOI-OAHLLOKOSA-N 1 0 262.353 3.572 20 5 CHBDRO CC[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000594980251 1127443183 /nfs/dbraw/zinc/44/31/83/1127443183.db2.gz NQDQNMOGQUOYDH-HNNXBMFYSA-N 1 0 262.353 3.572 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CCc2ccoc2)cc1[N+](=O)[O-] ZINC000594983988 1127443897 /nfs/dbraw/zinc/44/38/97/1127443897.db2.gz ZBJKEZFCIVXJLI-UHFFFAOYSA-N 1 0 288.347 3.644 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CCC3(CC3(F)F)CC2)cc1 ZINC000594982712 1127443932 /nfs/dbraw/zinc/44/39/32/1127443932.db2.gz GPVHRZRNBWVEEF-UHFFFAOYSA-N 1 0 296.317 3.652 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C(C)C)C1CC1 ZINC000595097952 1127452289 /nfs/dbraw/zinc/45/22/89/1127452289.db2.gz AGAIQMHABXIKSG-ZBEGNZNMSA-N 1 0 292.379 3.689 20 5 CHBDRO CCSC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595102083 1127452599 /nfs/dbraw/zinc/45/25/99/1127452599.db2.gz ZWWKSYLJYPSKSN-NSHDSACASA-N 1 0 280.393 3.531 20 5 CHBDRO CC(C)(F)CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000595084043 1127453330 /nfs/dbraw/zinc/45/33/30/1127453330.db2.gz IKNNDCAVVHCRBE-CQSZACIVSA-N 1 0 280.343 3.700 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@H](C)O2)cc1[N+](=O)[O-] ZINC000595078910 1127453763 /nfs/dbraw/zinc/45/37/63/1127453763.db2.gz HGPNAELRXDIQKP-YDHLFZDLSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000595093328 1127454696 /nfs/dbraw/zinc/45/46/96/1127454696.db2.gz ZVPFKKXPOPJZKO-DIFFPNOSSA-N 1 0 298.342 3.639 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000595093327 1127454912 /nfs/dbraw/zinc/45/49/12/1127454912.db2.gz ZVPFKKXPOPJZKO-APPDUMDISA-N 1 0 298.342 3.639 20 5 CHBDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)C1 ZINC000359302885 1127457393 /nfs/dbraw/zinc/45/73/93/1127457393.db2.gz PDALCEXQNIQGRG-BBRMVZONSA-N 1 0 274.364 3.607 20 5 CHBDRO CCCC1CCC([N@H+](C)Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595462887 1127463570 /nfs/dbraw/zinc/46/35/70/1127463570.db2.gz XMURSLWVKLZAKV-UHFFFAOYSA-N 1 0 295.383 3.682 20 5 CHBDRO Cc1noc(C[NH2+][C@H]2CCC[C@H]2CCC(C)C)c1[N+](=O)[O-] ZINC000595452167 1127463724 /nfs/dbraw/zinc/46/37/24/1127463724.db2.gz ZEPUOOZWYQZWQA-STQMWFEESA-N 1 0 295.383 3.586 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000293579562 1127507063 /nfs/dbraw/zinc/50/70/63/1127507063.db2.gz DVCFOTSYLWRQNX-OLZOCXBDSA-N 1 0 299.374 3.897 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000597074980 1127527220 /nfs/dbraw/zinc/52/72/20/1127527220.db2.gz IAMXLXFCWSNAAF-XBFCOCLRSA-N 1 0 294.782 3.569 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H]4C[C@@H]4C3)o2)c1 ZINC000597222052 1127536770 /nfs/dbraw/zinc/53/67/70/1127536770.db2.gz BNHPTGMBXKVFAP-TZMCWYRMSA-N 1 0 298.342 3.697 20 5 CHBDRO CC[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000598678928 1127631071 /nfs/dbraw/zinc/63/10/71/1127631071.db2.gz AVBIMNYIQPENKZ-YPMHNXCESA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC[C@H]2CC2(F)F)cccc1[N+](=O)[O-] ZINC000598679597 1127631085 /nfs/dbraw/zinc/63/10/85/1127631085.db2.gz KPJGENWQTHYIFA-MNOVXSKESA-N 1 0 284.306 3.599 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC(C)C1 ZINC000598676290 1127632561 /nfs/dbraw/zinc/63/25/61/1127632561.db2.gz GMUFESUHOZCHJR-ROKHWSDSSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000599060169 1127654572 /nfs/dbraw/zinc/65/45/72/1127654572.db2.gz TXSLFLDKYUDKCD-TUAOUCFPSA-N 1 0 298.333 3.879 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CC2(CCC2)C1 ZINC000593721569 1127665911 /nfs/dbraw/zinc/66/59/11/1127665911.db2.gz PTUIVQYERFLMIJ-GFCCVEGCSA-N 1 0 274.364 3.887 20 5 CHBDRO CCCC[N@H+](CC)Cc1cccc([N+](=O)[O-])c1C ZINC000603837995 1127673918 /nfs/dbraw/zinc/67/39/18/1127673918.db2.gz RBTBWJBBGNFKFT-UHFFFAOYSA-N 1 0 250.342 3.525 20 5 CHBDRO CCc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000603824292 1127674172 /nfs/dbraw/zinc/67/41/72/1127674172.db2.gz UTOLXUBBUBWXJR-UHFFFAOYSA-N 1 0 284.359 3.789 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000603847296 1127676061 /nfs/dbraw/zinc/67/60/61/1127676061.db2.gz PDUKWLZXSQMMHV-UNEWFSDZSA-N 1 0 288.391 3.995 20 5 CHBDRO CCCCC[N@H+](CCOc1ccccc1[N+](=O)[O-])C(C)C ZINC000603845648 1127676246 /nfs/dbraw/zinc/67/62/46/1127676246.db2.gz DXENEXVGEFFCOI-UHFFFAOYSA-N 1 0 294.395 3.874 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C2(CC)CC2)cc1[N+](=O)[O-] ZINC000296618451 1127678436 /nfs/dbraw/zinc/67/84/36/1127678436.db2.gz WSBBMVKMNUGKPG-NSHDSACASA-N 1 0 278.352 3.587 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012773 1127689328 /nfs/dbraw/zinc/68/93/28/1127689328.db2.gz YTFFGZSKAWOUGV-CQSZACIVSA-N 1 0 292.379 3.628 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000604013250 1127689661 /nfs/dbraw/zinc/68/96/61/1127689661.db2.gz YAPJRJYMNTWLTG-OAHLLOKOSA-N 1 0 274.364 3.749 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000604419159 1127704859 /nfs/dbraw/zinc/70/48/59/1127704859.db2.gz WQMSZJOXFDCVHH-LBPRGKRZSA-N 1 0 276.380 3.854 20 5 CHBDRO Cc1ccsc1CN(C)Cc1ccccc1[N+](=O)[O-] ZINC000061798667 1127718457 /nfs/dbraw/zinc/71/84/57/1127718457.db2.gz GVBKUAUXQOADOJ-UHFFFAOYSA-N 1 0 276.361 3.597 20 5 CHBDRO C[C@H]1CCC[C@@H]1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000230672708 1127771128 /nfs/dbraw/zinc/77/11/28/1127771128.db2.gz QEPMIIYCXQPYFS-WDEREUQCSA-N 1 0 282.771 3.774 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CC(C)(C)C ZINC000075767255 1127874104 /nfs/dbraw/zinc/87/41/04/1127874104.db2.gz UWWZELSTTLYYFM-NSHDSACASA-N 1 0 250.342 3.634 20 5 CHBDRO C[C@@H]1CCC[N@@H+](C(C)(C)CNc2ccccc2[N+](=O)[O-])C1 ZINC000608856068 1127892197 /nfs/dbraw/zinc/89/21/97/1127892197.db2.gz BYCZOPKLGNVOEI-CYBMUJFWSA-N 1 0 291.395 3.517 20 5 CHBDRO C[C@@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000608976739 1127896417 /nfs/dbraw/zinc/89/64/17/1127896417.db2.gz MFNCBMLEDZODOL-AWEZNQCLSA-N 1 0 284.359 3.830 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1C(C)C ZINC000544603740 1127978335 /nfs/dbraw/zinc/97/83/35/1127978335.db2.gz DCGSPJJOCHFKTB-OAHLLOKOSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000544611786 1127979253 /nfs/dbraw/zinc/97/92/53/1127979253.db2.gz JQWMETQZWWHCJH-QGZVFWFLSA-N 1 0 296.370 3.893 20 5 CHBDRO CC[C@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000540917838 1128001977 /nfs/dbraw/zinc/00/19/77/1128001977.db2.gz GWLNLROWSHKZHT-FZMZJTMJSA-N 1 0 296.798 3.959 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[C@@H](C)C1 ZINC000468592630 1128013328 /nfs/dbraw/zinc/01/33/28/1128013328.db2.gz VIDHLQRGWQUVMV-LJIOFZCZSA-N 1 0 274.364 3.776 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000545457230 1128016226 /nfs/dbraw/zinc/01/62/26/1128016226.db2.gz ASBWXMJKDXZDBK-KOLCDFICSA-N 1 0 290.285 3.976 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000541772601 1128038356 /nfs/dbraw/zinc/03/83/56/1128038356.db2.gz BNUUGQBKQSXYNM-KRWDZBQOSA-N 1 0 297.358 3.635 20 5 CHBDRO C[C@@H](CCC1CC1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000469784155 1128053142 /nfs/dbraw/zinc/05/31/42/1128053142.db2.gz VJMJBBOPSHCWNW-NSHDSACASA-N 1 0 296.798 3.959 20 5 CHBDRO CCC[N@H+](CC)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470172788 1128064980 /nfs/dbraw/zinc/06/49/80/1128064980.db2.gz CEBOKEGYMGSXPH-RAXLEYEMSA-N 1 0 262.353 3.730 20 5 CHBDRO CCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000470174975 1128064988 /nfs/dbraw/zinc/06/49/88/1128064988.db2.gz XGPYYVZQGVZBDT-RAXLEYEMSA-N 1 0 274.364 3.873 20 5 CHBDRO CC[C@H]1CC[N@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470182638 1128065036 /nfs/dbraw/zinc/06/50/36/1128065036.db2.gz MHPHNKSZKIWHQU-XXYUJHKVSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCCC2(CC2)C1 ZINC000470214493 1128065855 /nfs/dbraw/zinc/06/58/55/1128065855.db2.gz PKBCBNKGJYSXND-GXDHUFHOSA-N 1 0 286.375 3.874 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@H](C)C[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492629932 1128106847 /nfs/dbraw/zinc/10/68/47/1128106847.db2.gz KZSJRYOLCYNSFO-OCCSQVGLSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1)C1(C)CC1 ZINC000761514472 1128132922 /nfs/dbraw/zinc/13/29/22/1128132922.db2.gz JVALVMPRQPFUMO-SNVBAGLBSA-N 1 0 282.771 3.869 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1C ZINC000609193665 1128170848 /nfs/dbraw/zinc/17/08/48/1128170848.db2.gz RVVAJKJLSKGIHY-ZDUSSCGKSA-N 1 0 292.379 3.756 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000927029881 1128209514 /nfs/dbraw/zinc/20/95/14/1128209514.db2.gz GFKYWKZEGRVYOG-NQBHXWOUSA-N 1 0 280.393 3.530 20 5 CHBDRO C[C@H]1CCC[N@H+](CCCCNc2ccccc2[N+](=O)[O-])C1 ZINC000301119364 1128390564 /nfs/dbraw/zinc/39/05/64/1128390564.db2.gz VTDDAXNEUALYSM-AWEZNQCLSA-N 1 0 291.395 3.519 20 5 CHBDRO C[C@@H]1CCC[N@H+](CCCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000301120288 1128406234 /nfs/dbraw/zinc/40/62/34/1128406234.db2.gz WJSDGEBMZHZPDL-CQSZACIVSA-N 1 0 291.395 3.519 20 5 CHBDRO C[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000798962435 1128422528 /nfs/dbraw/zinc/42/25/28/1128422528.db2.gz MGDDNDUWAJNSDO-ZYHUDNBSSA-N 1 0 282.771 3.774 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](c2ccncc2)C2CC2)cc1[N+](=O)[O-] ZINC000934701251 1128467307 /nfs/dbraw/zinc/46/73/07/1128467307.db2.gz NLBJJFRXINDGOF-QGZVFWFLSA-N 1 0 297.358 3.539 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCCc3sccc3C2)c1 ZINC000609322786 1128698721 /nfs/dbraw/zinc/69/87/21/1128698721.db2.gz LHIUSUJSRQYORA-UHFFFAOYSA-N 1 0 288.372 3.605 20 5 CHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609672503 1128721401 /nfs/dbraw/zinc/72/14/01/1128721401.db2.gz HLZRRCDVNYGBBU-PBHICJAKSA-N 1 0 296.370 3.973 20 5 CHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609767164 1128724502 /nfs/dbraw/zinc/72/45/02/1128724502.db2.gz SXTJCVKAIXWRDA-AWEZNQCLSA-N 1 0 280.343 3.744 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000609766729 1128725350 /nfs/dbraw/zinc/72/53/50/1128725350.db2.gz JUDJGRRCFURRHG-NSHDSACASA-N 1 0 268.382 3.668 20 5 CHBDRO Cc1cc(C)cc(CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000610137632 1128738932 /nfs/dbraw/zinc/73/89/32/1128738932.db2.gz QNBDCXAPSLMLIV-UHFFFAOYSA-N 1 0 298.386 3.852 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C(C)C)C1CCCC1 ZINC000430201861 1117859264 /nfs/dbraw/zinc/85/92/64/1117859264.db2.gz BQNRLVVCNFPPKC-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)CCC[C@@H]1C ZINC000610215385 1117882158 /nfs/dbraw/zinc/88/21/58/1117882158.db2.gz KQEVFCWLXABPRH-OLZOCXBDSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000471168027 1117910162 /nfs/dbraw/zinc/91/01/62/1117910162.db2.gz GLPCEDFCRUFKBR-KRWDZBQOSA-N 1 0 282.343 3.584 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCC(C)(C)C1 ZINC000430243851 1117914481 /nfs/dbraw/zinc/91/44/81/1117914481.db2.gz WBIBMYSKKJALLW-AWEZNQCLSA-N 1 0 292.379 3.614 20 5 CHBDRO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCCCC1 ZINC000083126991 1117948095 /nfs/dbraw/zinc/94/80/95/1117948095.db2.gz XLQGXUPPZRRAPD-UHFFFAOYSA-N 1 0 289.335 3.501 20 5 CHBDRO CCC(CC)(CC)[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000471215171 1117984419 /nfs/dbraw/zinc/98/44/19/1117984419.db2.gz IADJYQFQNHJQGF-UHFFFAOYSA-N 1 0 280.368 3.532 20 5 CHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000359298118 1117984518 /nfs/dbraw/zinc/98/45/18/1117984518.db2.gz KSKOVKBKHOPDOR-WBMJQRKESA-N 1 0 292.354 3.746 20 5 CHBDRO CC1=C[C@@H](C)C[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000430284713 1117993325 /nfs/dbraw/zinc/99/33/25/1117993325.db2.gz OVDUSJLZULTVCY-DGCLKSJQSA-N 1 0 260.337 3.554 20 5 CHBDRO Cc1ccoc1C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000610271189 1118154564 /nfs/dbraw/zinc/15/45/64/1118154564.db2.gz IKAWHIBTJPVCNW-UHFFFAOYSA-N 1 0 288.347 3.609 20 5 CHBDRO C[NH+](C)[C@H](CNc1ccsc1[N+](=O)[O-])C1CCCCC1 ZINC000610275500 1118171476 /nfs/dbraw/zinc/17/14/76/1118171476.db2.gz WEGHOLIOMFHVMA-CYBMUJFWSA-N 1 0 297.424 3.579 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000282212287 1118294953 /nfs/dbraw/zinc/29/49/53/1118294953.db2.gz OMBMHJCGDZMTEQ-BXUZGUMPSA-N 1 0 260.337 3.578 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH+]1C2CCCC1CCC2 ZINC000610369992 1118362436 /nfs/dbraw/zinc/36/24/36/1118362436.db2.gz LGIGEGQNXXGILQ-UHFFFAOYSA-N 1 0 260.337 3.502 20 5 CHBDRO CC[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000126245983 1118546766 /nfs/dbraw/zinc/54/67/66/1118546766.db2.gz LANCJIVPVBFGFJ-UHFFFAOYSA-N 1 0 294.738 3.960 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)n1 ZINC000616357120 1128787392 /nfs/dbraw/zinc/78/73/92/1128787392.db2.gz DILPHXRRRADDSM-ZDUSSCGKSA-N 1 0 299.374 3.766 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)C2CCC2)cccc1[N+](=O)[O-] ZINC000090856203 1118645660 /nfs/dbraw/zinc/64/56/60/1118645660.db2.gz SZRWMHFOBWTOAN-NEPJUHHUSA-N 1 0 262.353 3.742 20 5 CHBDRO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000230143763 1118646014 /nfs/dbraw/zinc/64/60/14/1118646014.db2.gz BEWUWZJBFLDISY-UHFFFAOYSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)s1 ZINC000090910028 1118688511 /nfs/dbraw/zinc/68/85/11/1118688511.db2.gz WGEQCKZYGFXKJF-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000308696483 1118797926 /nfs/dbraw/zinc/79/79/26/1118797926.db2.gz FNBDKCIQEADODL-IUODEOHRSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CC2)CC1 ZINC000611177414 1118809586 /nfs/dbraw/zinc/80/95/86/1118809586.db2.gz JHDZIEGCQUXYPO-GFCCVEGCSA-N 1 0 260.337 3.532 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@H](OC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000361815860 1118815462 /nfs/dbraw/zinc/81/54/62/1118815462.db2.gz VSDOHWHDAFEPEE-CVEARBPZSA-N 1 0 294.395 3.697 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H](C)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000610831189 1118897156 /nfs/dbraw/zinc/89/71/56/1118897156.db2.gz JLBPUGGAOWQIGW-SUMWQHHRSA-N 1 0 299.374 3.834 20 5 CHBDRO C[C@@H]1CC([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000084469026 1118946236 /nfs/dbraw/zinc/94/62/36/1118946236.db2.gz JFMFKNQCOWCUGN-STQMWFEESA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H]1C[C@H](C)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000033394651 1118965021 /nfs/dbraw/zinc/96/50/21/1118965021.db2.gz MLIFNSQYMKISJW-HMDMIVDLSA-N 1 0 274.364 3.586 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000071969327 1118988936 /nfs/dbraw/zinc/98/89/36/1118988936.db2.gz LIBWXZCRGVMACC-UHFFFAOYSA-N 1 0 276.380 3.792 20 5 CHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])CC1CCCCC1 ZINC000511072634 1119006718 /nfs/dbraw/zinc/00/67/18/1119006718.db2.gz GKHGEXMVEAEYJF-UHFFFAOYSA-N 1 0 276.380 3.649 20 5 CHBDRO CC[C@H]([NH2+]C1CC(CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000342689222 1119127753 /nfs/dbraw/zinc/12/77/53/1119127753.db2.gz NGZRAMCJMYTFNB-HGMXIMQMSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000402495208 1119133584 /nfs/dbraw/zinc/13/35/84/1119133584.db2.gz RESKZXFHPNQPOD-JTQLQIEISA-N 1 0 290.285 3.663 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCCCO1 ZINC000611477473 1119162732 /nfs/dbraw/zinc/16/27/32/1119162732.db2.gz QGUYONXMLLYDIE-XEZPLFJOSA-N 1 0 292.379 3.511 20 5 CHBDRO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000612144800 1119227513 /nfs/dbraw/zinc/22/75/13/1119227513.db2.gz RMOARFLNUAXRAK-LBPRGKRZSA-N 1 0 278.327 3.522 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000094325370 1128839257 /nfs/dbraw/zinc/83/92/57/1128839257.db2.gz TYQGVHDMWKUITR-HNNXBMFYSA-N 1 0 292.379 3.532 20 5 CHBDRO CS[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000219227282 1119396952 /nfs/dbraw/zinc/39/69/52/1119396952.db2.gz MPATYMUPXHUGTA-NILFDRSVSA-N 1 0 294.420 3.920 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000708503114 1119501124 /nfs/dbraw/zinc/50/11/24/1119501124.db2.gz ODFMMMACYVQLPF-GFCCVEGCSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000219697920 1119511027 /nfs/dbraw/zinc/51/10/27/1119511027.db2.gz GMUQKTQWFUGXJU-SWLSCSKDSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000250898830 1119538906 /nfs/dbraw/zinc/53/89/06/1119538906.db2.gz YBBDTZRLLSIZEG-LALPHHSUSA-N 1 0 276.380 3.818 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CC(F)(F)C1)CCCC2 ZINC000584458991 1119580708 /nfs/dbraw/zinc/58/07/08/1119580708.db2.gz MSPGWLMTQSVVKO-AWEZNQCLSA-N 1 0 296.317 3.750 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCc2ccccc2C1 ZINC000033912443 1119621418 /nfs/dbraw/zinc/62/14/18/1119621418.db2.gz USCLYCOPAFLQHY-UITAMQMPSA-N 1 0 294.354 3.666 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCOCC(C)C ZINC000163295201 1119764826 /nfs/dbraw/zinc/76/48/26/1119764826.db2.gz OXSPPWZWJYWAII-CQSZACIVSA-N 1 0 294.395 3.617 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccoc1C ZINC000615720621 1119790978 /nfs/dbraw/zinc/79/09/78/1119790978.db2.gz YKOJKEHXGUVNOY-WQLSENKSSA-N 1 0 286.331 3.689 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)c1 ZINC000694333530 1119859383 /nfs/dbraw/zinc/85/93/83/1119859383.db2.gz WLOLQWQPUGMNMF-LJWDBELGSA-N 1 0 280.755 3.526 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1C[C@@H](OC(C)C)C1 ZINC000580880291 1119889775 /nfs/dbraw/zinc/88/97/75/1119889775.db2.gz CVAILUUFJDCMBC-KCQAQPDRSA-N 1 0 292.379 3.510 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@@H]1C ZINC000414150597 1119918890 /nfs/dbraw/zinc/91/88/90/1119918890.db2.gz VTHRRZFPZWPYIX-AZHAFVHUSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000414282530 1119965939 /nfs/dbraw/zinc/96/59/39/1119965939.db2.gz HMMKWKXVSZPUHC-LERXQTSPSA-N 1 0 266.316 3.526 20 5 CHBDRO CCn1cc[nH+]c1NCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000414298808 1119971863 /nfs/dbraw/zinc/97/18/63/1119971863.db2.gz KEZOJNGNXUNLFM-UHFFFAOYSA-N 1 0 288.351 3.547 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2C[C@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000414344564 1119991183 /nfs/dbraw/zinc/99/11/83/1119991183.db2.gz RPVFMWBZJNGDON-MRVWCRGKSA-N 1 0 286.331 3.703 20 5 CHBDRO CC[C@H]([NH2+]CCCCOC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000180465394 1119994128 /nfs/dbraw/zinc/99/41/28/1119994128.db2.gz PXTXMMAARKGBIE-INIZCTEOSA-N 1 0 294.395 3.841 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCc1cccs1 ZINC000075966856 1128882864 /nfs/dbraw/zinc/88/28/64/1128882864.db2.gz YBTAJPHISUZOHT-GFCCVEGCSA-N 1 0 290.388 3.892 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccoc2)cc1[N+](=O)[O-] ZINC000181235375 1120032221 /nfs/dbraw/zinc/03/22/21/1120032221.db2.gz QVGHISXTZAMGAX-VXGBXAGGSA-N 1 0 274.320 3.908 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCCOC(C)C)cc1[N+](=O)[O-] ZINC000180454503 1120098718 /nfs/dbraw/zinc/09/87/18/1120098718.db2.gz KLRXFOGTLPMRBQ-CQSZACIVSA-N 1 0 294.395 3.759 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CS[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000414508016 1120106356 /nfs/dbraw/zinc/10/63/56/1120106356.db2.gz ZTUGVZJNJFQZAE-WCQYABFASA-N 1 0 294.420 3.702 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C/C=C\Cl ZINC000903446559 1120108157 /nfs/dbraw/zinc/10/81/57/1120108157.db2.gz YLMORZGXYMFHBG-JVBZPZKUSA-N 1 0 286.784 3.720 20 5 CHBDRO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)CC1CC1 ZINC000542697445 1120120993 /nfs/dbraw/zinc/12/09/93/1120120993.db2.gz MEYWTGONUCHIQJ-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+](CC1CC1)CC1CC1 ZINC000542703192 1120123682 /nfs/dbraw/zinc/12/36/82/1120123682.db2.gz JJPRWTSKFOSUAG-UHFFFAOYSA-N 1 0 274.364 3.525 20 5 CHBDRO CCn1ccc(C[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000616129705 1120155050 /nfs/dbraw/zinc/15/50/50/1120155050.db2.gz UYQBAQURGUWPQF-ZDUSSCGKSA-N 1 0 287.363 3.609 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccsc1 ZINC000122969387 1120357745 /nfs/dbraw/zinc/35/77/45/1120357745.db2.gz IILNRIAINBVWQH-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1 ZINC000066405266 1120390840 /nfs/dbraw/zinc/39/08/40/1120390840.db2.gz XLRFBAMRXHAZLD-ZDUSSCGKSA-N 1 0 270.332 3.788 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c(F)c1 ZINC000313853437 1120413959 /nfs/dbraw/zinc/41/39/59/1120413959.db2.gz SXSKYOGUPODDLC-BLLLJJGKSA-N 1 0 292.354 3.889 20 5 CHBDRO CS[C@H](C)C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314231 1120425920 /nfs/dbraw/zinc/42/59/20/1120425920.db2.gz YKWPVGRTVAQJTE-ABAIWWIYSA-N 1 0 294.420 3.703 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCCc2ccccc2)cc1 ZINC000131014188 1120458146 /nfs/dbraw/zinc/45/81/46/1120458146.db2.gz NZPJSIWDUDTEQV-UHFFFAOYSA-N 1 0 284.359 3.707 20 5 CHBDRO CC[C@H]1CCC[C@@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000068592702 1120478635 /nfs/dbraw/zinc/47/86/35/1120478635.db2.gz KPSYZCCMFUONGN-UONOGXRCSA-N 1 0 292.379 3.532 20 5 CHBDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000068590662 1120479428 /nfs/dbraw/zinc/47/94/28/1120479428.db2.gz UJKQIGRMTFUKSK-DZGCQCFKSA-N 1 0 276.380 3.962 20 5 CHBDRO Cc1occc1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618567135 1128919719 /nfs/dbraw/zinc/91/97/19/1128919719.db2.gz WHCVHQQBNXDHEE-MRXNPFEDSA-N 1 0 286.331 3.663 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000020095895 1120492977 /nfs/dbraw/zinc/49/29/77/1120492977.db2.gz QUSCTFJKSJDIEK-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000430034392 1120523997 /nfs/dbraw/zinc/52/39/97/1120523997.db2.gz JSXDZGPXDQXISU-FHMRSRPSSA-N 1 0 296.317 3.633 20 5 CHBDRO Cc1c(C[NH2+]Cc2cccc3[nH]ccc32)cccc1[N+](=O)[O-] ZINC000318204857 1120525853 /nfs/dbraw/zinc/52/58/53/1120525853.db2.gz XMVNXURRVIWHPC-UHFFFAOYSA-N 1 0 295.342 3.674 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC2(CCC2)C1 ZINC000123568187 1120539501 /nfs/dbraw/zinc/53/95/01/1120539501.db2.gz RAEITRLRJNBACW-LBPRGKRZSA-N 1 0 260.337 3.532 20 5 CHBDRO C[C@H]1CCCC[C@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000508993741 1120579834 /nfs/dbraw/zinc/57/98/34/1120579834.db2.gz YKMGSKBONIBLLU-LKFCYVNXSA-N 1 0 284.306 3.541 20 5 CHBDRO CC[C@H](C[C@@](C)(O)CC)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000925690756 1120599109 /nfs/dbraw/zinc/59/91/09/1120599109.db2.gz HBPLJNYLLCKQLZ-IOASZLSFSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCCS2)cc1[N+](=O)[O-] ZINC000156356105 1120623472 /nfs/dbraw/zinc/62/34/72/1120623472.db2.gz VFXGPUTXBYHDBR-JSGCOSHPSA-N 1 0 294.420 3.840 20 5 CHBDRO C[C@@H](c1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000302742633 1120656558 /nfs/dbraw/zinc/65/65/58/1120656558.db2.gz ROCITELVAIHXII-ZDUSSCGKSA-N 1 0 270.332 3.788 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000511857135 1120666819 /nfs/dbraw/zinc/66/68/19/1120666819.db2.gz BUTDIRLCKXFGOS-GJZGRUSLSA-N 1 0 274.364 3.668 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000511857139 1120667042 /nfs/dbraw/zinc/66/70/42/1120667042.db2.gz BUTDIRLCKXFGOS-LSDHHAIUSA-N 1 0 274.364 3.668 20 5 CHBDRO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC1CCCC1 ZINC000104352431 1120727250 /nfs/dbraw/zinc/72/72/50/1120727250.db2.gz ZRDJOFHBYAJOGX-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1CC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000222055428 1120966077 /nfs/dbraw/zinc/96/60/77/1120966077.db2.gz GXYGJKUMRNVODP-OCCSQVGLSA-N 1 0 262.353 3.682 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCC2CC2)c(Cl)c1 ZINC000168130317 1120991842 /nfs/dbraw/zinc/99/18/42/1120991842.db2.gz YCNVIMCDZDJZFS-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]C2CC=CC2)c2cc([N+](=O)[O-])ccc21 ZINC000618984969 1128959271 /nfs/dbraw/zinc/95/92/71/1128959271.db2.gz QQYGOMLUKWTZJK-OAHLLOKOSA-N 1 0 272.348 3.625 20 5 CHBDRO C[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000512178391 1121141887 /nfs/dbraw/zinc/14/18/87/1121141887.db2.gz ILQNTWSNVKUJGR-BMWLXYDHSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C=C/C[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001175043988 1121156931 /nfs/dbraw/zinc/15/69/31/1121156931.db2.gz AYAJJOMMZZCGOK-KZSQQDEKSA-N 1 0 288.391 3.816 20 5 CHBDRO C[C@H]1CC[C@H](C)[NH+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000707145541 1121448510 /nfs/dbraw/zinc/44/85/10/1121448510.db2.gz RRSNUCFDZSZRPH-UWVGGRQHSA-N 1 0 268.744 3.621 20 5 CHBDRO C[NH+](C)Cc1cccc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)c1 ZINC001175902045 1121493530 /nfs/dbraw/zinc/49/35/30/1121493530.db2.gz FHESHYLTYCOICU-ZHACJKMWSA-N 1 0 297.358 3.739 20 5 CHBDRO C[NH+](C)Cc1ccccc1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175902730 1121494271 /nfs/dbraw/zinc/49/42/71/1121494271.db2.gz HATAVTSRCDGPDW-VAWYXSNFSA-N 1 0 297.358 3.739 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CC2)CC1 ZINC000611177415 1121629545 /nfs/dbraw/zinc/62/95/45/1121629545.db2.gz JHDZIEGCQUXYPO-LBPRGKRZSA-N 1 0 260.337 3.532 20 5 CHBDRO CC(C)C([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000611336901 1121637756 /nfs/dbraw/zinc/63/77/56/1121637756.db2.gz DCXCGELTJUYRPP-GFCCVEGCSA-N 1 0 264.369 3.926 20 5 CHBDRO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000611408971 1121644881 /nfs/dbraw/zinc/64/48/81/1121644881.db2.gz JOVWDXYRIRHAJQ-NSHDSACASA-N 1 0 280.343 3.792 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCOC(C)(C)C)cc1[N+](=O)[O-] ZINC000611404306 1121645268 /nfs/dbraw/zinc/64/52/68/1121645268.db2.gz AGONRFBMJTXVLL-ZDUSSCGKSA-N 1 0 294.395 3.759 20 5 CHBDRO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CCc2ccccc21 ZINC000611549755 1121654983 /nfs/dbraw/zinc/65/49/83/1121654983.db2.gz RXGZPHFRTLZJGI-INIZCTEOSA-N 1 0 296.370 3.757 20 5 CHBDRO C[C@H](CC[NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000052329903 1121701052 /nfs/dbraw/zinc/70/10/52/1121701052.db2.gz RQOJPLDCJHTFNV-CQSZACIVSA-N 1 0 284.359 3.878 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCCC(F)F)C1CC1 ZINC001119540922 1121799494 /nfs/dbraw/zinc/79/94/94/1121799494.db2.gz LPSCMHXHYWEWSN-ZDUSSCGKSA-N 1 0 298.333 3.551 20 5 CHBDRO COc1cc(C[NH2+][C@H](C)c2ccsc2)ccc1[N+](=O)[O-] ZINC000619783806 1129013338 /nfs/dbraw/zinc/01/33/38/1129013338.db2.gz ZFMYYQPJRAKBHF-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO CCc1ccc(C)[nH+]c1NCc1cccc([N+](=O)[O-])c1C ZINC001179140576 1121855135 /nfs/dbraw/zinc/85/51/35/1121855135.db2.gz PRRQUBCRVGKQID-UHFFFAOYSA-N 1 0 285.347 3.781 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@]2(C)CC2(C)C)cc1[N+](=O)[O-] ZINC001179216519 1121860584 /nfs/dbraw/zinc/86/05/84/1121860584.db2.gz MNWAXSXTWIRSDP-MRXNPFEDSA-N 1 0 276.380 3.996 20 5 CHBDRO CC1(C)CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000168138594 1122003621 /nfs/dbraw/zinc/00/36/21/1122003621.db2.gz SBQPAXVDYMMLRM-NSHDSACASA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000501788002 1122008251 /nfs/dbraw/zinc/00/82/51/1122008251.db2.gz BWMXTCVJPCFJPS-UPJWGTAASA-N 1 0 262.353 3.634 20 5 CHBDRO CC[C@H](C)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000421376216 1122105617 /nfs/dbraw/zinc/10/56/17/1122105617.db2.gz IZYIQFMDCGVEBB-QWHCGFSZSA-N 1 0 264.369 3.552 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)CCc2ccco2)cc1[N+](=O)[O-] ZINC000035011156 1122147391 /nfs/dbraw/zinc/14/73/91/1122147391.db2.gz NLFLWDVGVAJKBI-CYBMUJFWSA-N 1 0 288.347 3.607 20 5 CHBDRO C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000035010716 1122148193 /nfs/dbraw/zinc/14/81/93/1122148193.db2.gz XXVDLISQOXCOFE-JTQLQIEISA-N 1 0 292.285 3.724 20 5 CHBDRO C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000035010020 1122148224 /nfs/dbraw/zinc/14/82/24/1122148224.db2.gz JUZRDWZZKOTBOU-SNVBAGLBSA-N 1 0 292.285 3.724 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc[nH]1 ZINC000774265568 1122149916 /nfs/dbraw/zinc/14/99/16/1122149916.db2.gz FTIJCYKLIRPLTK-ZBEGNZNMSA-N 1 0 285.347 3.651 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@H+](CC2CC2)CC2CCC2)cs1 ZINC000355741360 1122165765 /nfs/dbraw/zinc/16/57/65/1122165765.db2.gz ZLRVCYYWMNJVAW-UHFFFAOYSA-N 1 0 280.393 3.668 20 5 CHBDRO CC1=CC[C@@H]([NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC001184046140 1122253739 /nfs/dbraw/zinc/25/37/39/1122253739.db2.gz UTRMQJPZMHXVTB-ZIAGYGMSSA-N 1 0 274.364 3.787 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000503938125 1122279756 /nfs/dbraw/zinc/27/97/56/1122279756.db2.gz RDOOSGAUKGQOOP-DYEKYZERSA-N 1 0 292.379 3.833 20 5 CHBDRO CCC(CC)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000430123597 1122440866 /nfs/dbraw/zinc/44/08/66/1122440866.db2.gz QCSWXTHNOHIOQD-UHFFFAOYSA-N 1 0 264.369 3.856 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000515260952 1122486871 /nfs/dbraw/zinc/48/68/71/1122486871.db2.gz YPPQNCCWVACLPJ-INIZCTEOSA-N 1 0 286.375 3.668 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000515433675 1122499494 /nfs/dbraw/zinc/49/94/94/1122499494.db2.gz XLCAUIHHHJTAOA-COPLHBTASA-N 1 0 262.353 3.606 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000183521985 1129059486 /nfs/dbraw/zinc/05/94/86/1129059486.db2.gz WGQVQVWXVMBZSU-NEPJUHHUSA-N 1 0 282.409 3.695 20 5 CHBDRO CC[C@@H](C)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001190528831 1122541753 /nfs/dbraw/zinc/54/17/53/1122541753.db2.gz MQRPOJDZRJQTGP-CYBMUJFWSA-N 1 0 264.369 3.851 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2C[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC001192626060 1122655098 /nfs/dbraw/zinc/65/50/98/1122655098.db2.gz JRDZMDVNAXFECH-MAZHCROVSA-N 1 0 288.391 3.990 20 5 CHBDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000438474072 1122703582 /nfs/dbraw/zinc/70/35/82/1122703582.db2.gz GJUDVUIXTDNKHH-VIFPVBQESA-N 1 0 296.314 3.723 20 5 CHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000438474071 1122703612 /nfs/dbraw/zinc/70/36/12/1122703612.db2.gz GJUDVUIXTDNKHH-SECBINFHSA-N 1 0 296.314 3.723 20 5 CHBDRO CC[N@H+](Cc1csc([N+](=O)[O-])c1)C1CCCCC1 ZINC000054174372 1122754390 /nfs/dbraw/zinc/75/43/90/1122754390.db2.gz YMLOXTBIWQBBQS-UHFFFAOYSA-N 1 0 268.382 3.811 20 5 CHBDRO CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])CC(C)(C)C ZINC001194633187 1122787117 /nfs/dbraw/zinc/78/71/17/1122787117.db2.gz NJSQVJNNACSQJJ-UHFFFAOYSA-N 1 0 268.332 3.602 20 5 CHBDRO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCC[C@H]1C(C)(C)C ZINC001195279150 1122860275 /nfs/dbraw/zinc/86/02/75/1122860275.db2.gz NAKHHFBUDJJEIB-KGLIPLIRSA-N 1 0 291.395 3.636 20 5 CHBDRO CCC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC001195597063 1122877376 /nfs/dbraw/zinc/87/73/76/1122877376.db2.gz VWILRFCXNNQYCT-UHFFFAOYSA-N 1 0 270.760 3.869 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OCC ZINC000506993992 1122917747 /nfs/dbraw/zinc/91/77/47/1122917747.db2.gz CCWPKMYHXNZIFS-GFCCVEGCSA-N 1 0 280.368 3.614 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H]1CC=CCC1)C1CC1 ZINC000507168993 1122935757 /nfs/dbraw/zinc/93/57/57/1122935757.db2.gz GQVZZYLZHZYZKK-CQSZACIVSA-N 1 0 286.375 3.916 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000729474705 1122967390 /nfs/dbraw/zinc/96/73/90/1122967390.db2.gz MRMJSOJTGQKQKX-AWEZNQCLSA-N 1 0 280.343 3.744 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000729474706 1122967655 /nfs/dbraw/zinc/96/76/55/1122967655.db2.gz MRMJSOJTGQKQKX-CQSZACIVSA-N 1 0 280.343 3.744 20 5 CHBDRO CC(C)[C@H](Cc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC001197770426 1122968308 /nfs/dbraw/zinc/96/83/08/1122968308.db2.gz SNPOQOGJNBUNHA-SFHVURJKSA-N 1 0 298.386 3.952 20 5 CHBDRO C[C@@H](c1cccnc1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183730478 1129090789 /nfs/dbraw/zinc/09/07/89/1129090789.db2.gz KZWLLEZXCVFUJX-MRZGDXHCSA-N 1 0 297.358 3.696 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccsc1 ZINC000052926141 1123061211 /nfs/dbraw/zinc/06/12/11/1123061211.db2.gz BQPBGPQSCDJABN-SNVBAGLBSA-N 1 0 262.334 3.507 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCC23CCCC3)cc1[N+](=O)[O-] ZINC000428637806 1123071294 /nfs/dbraw/zinc/07/12/94/1123071294.db2.gz FTPSZKXPSRGQLW-HNNXBMFYSA-N 1 0 274.364 3.716 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)s1 ZINC000049158828 1123132618 /nfs/dbraw/zinc/13/26/18/1123132618.db2.gz GFQHBBVKDYQTFD-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1cc(C)c(C[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1C ZINC001201822527 1123153061 /nfs/dbraw/zinc/15/30/61/1123153061.db2.gz KTPUKZPGDUZANA-UHFFFAOYSA-N 1 0 298.386 3.852 20 5 CHBDRO C[C@H]1CCC[C@H](C[NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000507939344 1123247513 /nfs/dbraw/zinc/24/75/13/1123247513.db2.gz PRYKLNQYTQDWBX-ZFWWWQNUSA-N 1 0 276.380 3.553 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3C=CCC3)o2)c1 ZINC000850358393 1123255638 /nfs/dbraw/zinc/25/56/38/1123255638.db2.gz CHEGZEOLVVJXBC-CYBMUJFWSA-N 1 0 284.315 3.663 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1C=CCC1 ZINC000850509696 1123278252 /nfs/dbraw/zinc/27/82/52/1123278252.db2.gz PYVFRBBUMNXBOR-NUEKZKHPSA-N 1 0 286.375 3.614 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)CCC(C)C)cc1[N+](=O)[O-] ZINC000034995248 1124021549 /nfs/dbraw/zinc/02/15/49/1124021549.db2.gz OSTNRCYYBZRQMC-ZDUSSCGKSA-N 1 0 264.369 3.818 20 5 CHBDRO COc1cc(C[N@H+](C)[C@H]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000444665979 1124051344 /nfs/dbraw/zinc/05/13/44/1124051344.db2.gz QJQVGBUHZXBIHD-JSGCOSHPSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1(C2CCC2)CC1 ZINC000866384404 1124060396 /nfs/dbraw/zinc/06/03/96/1124060396.db2.gz YGKHDOMRPUXQOT-LLVKDONJSA-N 1 0 292.354 3.587 20 5 CHBDRO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000525996633 1124488507 /nfs/dbraw/zinc/48/85/07/1124488507.db2.gz QGZSUOFPXURLRH-VXGBXAGGSA-N 1 0 286.331 3.838 20 5 CHBDRO C[C@@H]([NH2+]C[C@H](C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000122769795 1124533385 /nfs/dbraw/zinc/53/33/85/1124533385.db2.gz IBRNHKAFLKKMCC-NWDGAFQWSA-N 1 0 264.369 3.928 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2ccccc2)CC1 ZINC000022965336 1124578091 /nfs/dbraw/zinc/57/80/91/1124578091.db2.gz CJXOZGBBMVXGBP-UHFFFAOYSA-N 1 0 296.370 3.974 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2ccccc21 ZINC000449068092 1124644565 /nfs/dbraw/zinc/64/45/65/1124644565.db2.gz QUWNURGXCCISER-CXAGYDPISA-N 1 0 296.370 3.803 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449100128 1124647988 /nfs/dbraw/zinc/64/79/88/1124647988.db2.gz WEVGCAFRVBIWGN-RWMBFGLXSA-N 1 0 264.369 3.550 20 5 CHBDRO C[C@H]([NH2+]CC1CCSCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872033799 1124661157 /nfs/dbraw/zinc/66/11/57/1124661157.db2.gz GDGQIXFEAJKZAS-JTQLQIEISA-N 1 0 298.383 3.528 20 5 CHBDRO CSCCCC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038478 1124663757 /nfs/dbraw/zinc/66/37/57/1124663757.db2.gz OAWNMLDJNDWDSV-JTQLQIEISA-N 1 0 286.372 3.528 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCCF ZINC000872072087 1124674155 /nfs/dbraw/zinc/67/41/55/1124674155.db2.gz DPEUQHXKIGTXKR-JTQLQIEISA-N 1 0 286.372 3.717 20 5 CHBDRO COCC(C)(C)CC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000872105393 1124683881 /nfs/dbraw/zinc/68/38/81/1124683881.db2.gz IDMVONABMDGIDH-CYBMUJFWSA-N 1 0 294.395 3.617 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC(C(F)F)CC1 ZINC000876744014 1124975565 /nfs/dbraw/zinc/97/55/65/1124975565.db2.gz PVUFICRLKFZVQG-UHFFFAOYSA-N 1 0 298.333 3.689 20 5 CHBDRO CC1([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC(F)(F)C1 ZINC000877833086 1125089388 /nfs/dbraw/zinc/08/93/88/1125089388.db2.gz DAQHARLSCMKBJD-UHFFFAOYSA-N 1 0 290.697 3.526 20 5 CHBDRO Cc1ccc(C[NH2+]CC(C)(C)CC(F)F)cc1[N+](=O)[O-] ZINC000883252631 1125385100 /nfs/dbraw/zinc/38/51/00/1125385100.db2.gz QKPQBBIHESOOTG-UHFFFAOYSA-N 1 0 286.322 3.674 20 5 CHBDRO CSCC[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000131624053 1125402054 /nfs/dbraw/zinc/40/20/54/1125402054.db2.gz RAWJQJSYCBMRJD-NEPJUHHUSA-N 1 0 282.409 3.695 20 5 CHBDRO C[C@H](C[NH2+]C1CCC(F)(F)CC1)c1ccccc1[N+](=O)[O-] ZINC000897459804 1125422398 /nfs/dbraw/zinc/42/23/98/1125422398.db2.gz BZIGMUITGMYYDX-LLVKDONJSA-N 1 0 298.333 3.866 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC12CCC2)c1ccccc1[N+](=O)[O-] ZINC000282846754 1125431108 /nfs/dbraw/zinc/43/11/08/1125431108.db2.gz TURJSPJFEPEDCD-RISCZKNCSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@@H](C[NH2+]Cc1cccs1)c1ccccc1[N+](=O)[O-] ZINC000897469127 1125432062 /nfs/dbraw/zinc/43/20/62/1125432062.db2.gz DOONTCBMLKGNNR-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCC[C@H]1CCCF ZINC000282864674 1125452727 /nfs/dbraw/zinc/45/27/27/1125452727.db2.gz YUQDVCZTDQNTFW-GXTWGEPZSA-N 1 0 280.343 3.603 20 5 CHBDRO Cc1ccccc1C[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000037777323 1129268629 /nfs/dbraw/zinc/26/86/29/1129268629.db2.gz SJJNTERHSPSCFW-CQSZACIVSA-N 1 0 284.359 3.624 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000094773557 1129451662 /nfs/dbraw/zinc/45/16/62/1129451662.db2.gz MNBZXTRAHUGYLS-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)C1CCCCC1 ZINC000094773660 1129451982 /nfs/dbraw/zinc/45/19/82/1129451982.db2.gz NTOJQCGKNDQDGE-LLVKDONJSA-N 1 0 280.343 3.792 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000741795662 1129454096 /nfs/dbraw/zinc/45/40/96/1129454096.db2.gz QKBHONMNCFYQCU-NEPJUHHUSA-N 1 0 280.343 3.744 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)C2CCC2)C1 ZINC001168977365 1129686289 /nfs/dbraw/zinc/68/62/89/1129686289.db2.gz AYRARSQEDPVENB-XYPHTWIQSA-N 1 0 288.391 3.563 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1F ZINC001168981853 1129686819 /nfs/dbraw/zinc/68/68/19/1129686819.db2.gz HPJFWGDRYHXHSB-ZENOOKHLSA-N 1 0 294.370 3.702 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H]([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168979497 1129686839 /nfs/dbraw/zinc/68/68/39/1129686839.db2.gz YRYILSXOBWFOSK-AJNGGQMLSA-N 1 0 282.428 3.626 20 5 CHBDRO CC(C)(C)c1ccc(C[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001168966497 1129687619 /nfs/dbraw/zinc/68/76/19/1129687619.db2.gz IQSOYAMVCPYXCS-GOEBONIOSA-N 1 0 290.407 3.519 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001168965135 1129687932 /nfs/dbraw/zinc/68/79/32/1129687932.db2.gz YHPJFDIDECJTJK-UKRRQHHQSA-N 1 0 280.412 3.524 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168985909 1129687965 /nfs/dbraw/zinc/68/79/65/1129687965.db2.gz VQJALAFOUIXEFT-WQVCFCJDSA-N 1 0 294.370 3.702 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(C)c1 ZINC001169000777 1129688477 /nfs/dbraw/zinc/68/84/77/1129688477.db2.gz BTBLPXINCKTMFS-DJIMGWMZSA-N 1 0 290.407 3.871 20 5 CHBDRO CC(C)(C)[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168975219 1129688720 /nfs/dbraw/zinc/68/87/20/1129688720.db2.gz UWLXBSWVEUEXDM-CWRNSKLLSA-N 1 0 290.407 3.809 20 5 CHBDRO Cc1cc(Cl)ccc1[C@@H](C)[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168990064 1129689735 /nfs/dbraw/zinc/68/97/35/1129689735.db2.gz BEPGUUHCUYPRCV-YRGRVCCFSA-N 1 0 296.798 3.744 20 5 CHBDRO CC[N@H+](Cc1ccc(C)c(C)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169050085 1129691923 /nfs/dbraw/zinc/69/19/23/1129691923.db2.gz YLRCWSAUWKJNFP-IAGOWNOFSA-N 1 0 290.407 3.571 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCCc1cc(C)ccn1 ZINC001169317870 1129716804 /nfs/dbraw/zinc/71/68/04/1129716804.db2.gz ICEPJOXRAORACK-UHFFFAOYSA-N 1 0 298.454 3.641 20 5 CHBDRO CC(C)C[C@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001169665267 1129744990 /nfs/dbraw/zinc/74/49/90/1129744990.db2.gz BGILCNVBTWHBCZ-ZDUSSCGKSA-N 1 0 264.369 3.504 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC2(CCCC2)C1 ZINC000769395140 1129908693 /nfs/dbraw/zinc/90/86/93/1129908693.db2.gz NDVCJDBGXSGDJL-ALCCZGGFSA-N 1 0 286.375 3.874 20 5 CHBDRO C[C@]1(O)CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769543388 1129917195 /nfs/dbraw/zinc/91/71/95/1129917195.db2.gz OTZOJZVFPGBVJD-FQEVSTJZSA-N 1 0 291.394 3.950 20 5 CHBDRO Cc1ccc(C[NH2+]C(C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000769928206 1129932776 /nfs/dbraw/zinc/93/27/76/1129932776.db2.gz NIXVAADULSASHX-UHFFFAOYSA-N 1 0 264.369 3.673 20 5 CHBDRO C[C@@H]1CC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000786930455 1130123855 /nfs/dbraw/zinc/12/38/55/1130123855.db2.gz IZVYEOKXKXIDIR-PRHODGIISA-N 1 0 288.269 3.502 20 5 CHBDRO CCCC[C@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001462011992 1130179453 /nfs/dbraw/zinc/17/94/53/1130179453.db2.gz HPOHPCWJARNDAJ-NSHDSACASA-N 1 0 284.787 3.959 20 5 CHBDRO CC(C)CC[C@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788498162 1130191314 /nfs/dbraw/zinc/19/13/14/1130191314.db2.gz LKYSKPIMIWMVCR-RYUDHWBXSA-N 1 0 279.384 3.652 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc[nH]1 ZINC000788593578 1130196174 /nfs/dbraw/zinc/19/61/74/1130196174.db2.gz VAINCIXLCHWPHX-ZBEGNZNMSA-N 1 0 299.374 3.996 20 5 CHBDRO CCCCCC[NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170298350 1130476770 /nfs/dbraw/zinc/47/67/70/1130476770.db2.gz JNHDJEOANISYGZ-ZDUSSCGKSA-N 1 0 294.395 3.704 20 5 CHBDRO Cc1cc(O[C@@H](C)C[N+](C)(C)C)c(Cl)cc1Cl ZINC001234059093 1130604360 /nfs/dbraw/zinc/60/43/60/1130604360.db2.gz RJQHMVKBVOTQSH-JTQLQIEISA-N 1 0 277.215 3.775 20 5 CHBDRO C[C@@H]1C[C@@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473709 1130614390 /nfs/dbraw/zinc/61/43/90/1130614390.db2.gz JERFMMXTLSTJAQ-HTQZYQBOSA-N 1 0 289.162 3.647 20 5 CHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC1CCC1 ZINC000811476610 1130614514 /nfs/dbraw/zinc/61/45/14/1130614514.db2.gz OICQFKQJLSXDIS-UHFFFAOYSA-N 1 0 289.162 3.791 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCC(F)(F)C2)cc1Cl ZINC000783649960 1130844593 /nfs/dbraw/zinc/84/45/93/1130844593.db2.gz IBYLRBSMMIPPEA-VIFPVBQESA-N 1 0 290.697 3.526 20 5 CHBDRO C[C@H]([NH2+]C[C@@H](C)C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815581012 1131002800 /nfs/dbraw/zinc/00/28/00/1131002800.db2.gz VNZZQLRFENIEHN-MNOVXSKESA-N 1 0 279.384 3.510 20 5 CHBDRO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815579457 1131002962 /nfs/dbraw/zinc/00/29/62/1131002962.db2.gz NHMVGTKILXGILC-DMTLFAOVSA-N 1 0 297.358 3.541 20 5 CHBDRO CC[C@H](C)C[C@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815595219 1131006290 /nfs/dbraw/zinc/00/62/90/1131006290.db2.gz KXKJPNQNJARBCU-SRVKXCTJSA-N 1 0 279.384 3.652 20 5 CHBDRO C[C@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815657488 1131013288 /nfs/dbraw/zinc/01/32/88/1131013288.db2.gz ZHJGBWCWHCKMEZ-NSHDSACASA-N 1 0 291.395 3.654 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001115984276 1131124675 /nfs/dbraw/zinc/12/46/75/1131124675.db2.gz NGIGNZUCSHERGD-CHWSQXEVSA-N 1 0 292.354 3.746 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C/C=C\C2CC2)cc1[N+](=O)[O-] ZINC001117712229 1131193647 /nfs/dbraw/zinc/19/36/47/1131193647.db2.gz CTMSSWUGJDYIFK-QMAVJUDZSA-N 1 0 290.363 3.610 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C/C=C/C1CC1)CCC2 ZINC001117713144 1131194068 /nfs/dbraw/zinc/19/40/68/1131194068.db2.gz NBRPOFKWFUOUIY-WOMSROEHSA-N 1 0 272.348 3.528 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000818230024 1131205093 /nfs/dbraw/zinc/20/50/93/1131205093.db2.gz MKJOTMSFINNEMC-QWHCGFSZSA-N 1 0 280.755 3.526 20 5 CHBDRO CC[C@@H](C)c1ccccc1O[C@H](C)C[N+](C)(C)C ZINC001227760429 1131738449 /nfs/dbraw/zinc/73/84/49/1131738449.db2.gz RHXBZBQIHDYSMI-ZIAGYGMSSA-N 1 0 250.406 3.674 20 5 CHBDRO C[NH+]1CCC(Oc2cccc3ccc4cccnc4c32)CC1 ZINC001227765122 1131739546 /nfs/dbraw/zinc/73/95/46/1131739546.db2.gz SXKLFVKNVFSNSN-UHFFFAOYSA-N 1 0 292.382 3.861 20 5 CHBDRO C[N@@H+]1CCC[C@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001228175679 1131824077 /nfs/dbraw/zinc/82/40/77/1131824077.db2.gz GJABSLZTRKUJDV-INIZCTEOSA-N 1 0 292.382 3.861 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H](C2CCCC2)C1 ZINC001171331663 1131853164 /nfs/dbraw/zinc/85/31/64/1131853164.db2.gz KIHFFURCNOWPDL-AWEZNQCLSA-N 1 0 274.364 3.607 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000036790523 1131974432 /nfs/dbraw/zinc/97/44/32/1131974432.db2.gz TUFXSBLEKDLRFJ-JTQLQIEISA-N 1 0 270.760 3.869 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000036993661 1131986060 /nfs/dbraw/zinc/98/60/60/1131986060.db2.gz JKPUBLQUWCANGR-WBMJQRKESA-N 1 0 288.347 3.860 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000036993413 1131986255 /nfs/dbraw/zinc/98/62/55/1131986255.db2.gz WETKAWACLRXDNV-STQMWFEESA-N 1 0 288.347 3.778 20 5 CHBDRO C[C@@H]([NH2+]CC[C@@H]1CCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000715753806 1131989751 /nfs/dbraw/zinc/98/97/51/1131989751.db2.gz KOGBIXCOERWQRQ-RISCZKNCSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H]([NH2+]CC[C@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000715755837 1131992401 /nfs/dbraw/zinc/99/24/01/1131992401.db2.gz RKUSHXHOBJKRHO-SMDDNHRTSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(O)cc1-c1ccccc1 ZINC001229972749 1132139005 /nfs/dbraw/zinc/13/90/05/1132139005.db2.gz HUAYNNQYTONTKE-CQSZACIVSA-O 1 0 286.395 3.533 20 5 CHBDRO OC[C@H]1CCC[N@@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001141722698 1132239386 /nfs/dbraw/zinc/23/93/86/1132239386.db2.gz FJSIXFKFLYAQQT-QGZVFWFLSA-N 1 0 291.394 3.950 20 5 CHBDRO C[C@@H]1C[C@H](O)C[N@@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001141722785 1132239998 /nfs/dbraw/zinc/23/99/98/1132239998.db2.gz JDAZJQMXIJBSJY-PBHICJAKSA-N 1 0 291.394 3.948 20 5 CHBDRO C[N@H+](C1CCCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916348 1132360857 /nfs/dbraw/zinc/36/08/57/1132360857.db2.gz RGJARIRCNMCYIG-INIZCTEOSA-N 1 0 288.391 3.717 20 5 CHBDRO CCCC[N@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909400 1132371577 /nfs/dbraw/zinc/37/15/77/1132371577.db2.gz RNCKRZSHACGUKS-OAHLLOKOSA-N 1 0 276.380 3.574 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1C[C@H]1c1ccccc1 ZINC001173219238 1132411386 /nfs/dbraw/zinc/41/13/86/1132411386.db2.gz ZSWQWTNTKWSNAQ-BVGQSLNGSA-N 1 0 296.370 3.672 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1[C@H](C)CC[C@H]1C ZINC001173218486 1132411568 /nfs/dbraw/zinc/41/15/68/1132411568.db2.gz BFUIXJHBNQXWRH-JHJVBQTASA-N 1 0 276.380 3.550 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC001173222506 1132411738 /nfs/dbraw/zinc/41/17/38/1132411738.db2.gz SMLROWCUTQZBTF-KBMXLJTQSA-N 1 0 288.391 3.648 20 5 CHBDRO Cc1cccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173217280 1132411882 /nfs/dbraw/zinc/41/18/82/1132411882.db2.gz RKXVEXRZKJLXNQ-CQSZACIVSA-N 1 0 284.359 3.624 20 5 CHBDRO CC[C@H](C)C[C@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173218572 1132411909 /nfs/dbraw/zinc/41/19/09/1132411909.db2.gz QQFZUYPQJRSTRN-MELADBBJSA-N 1 0 278.396 3.940 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001173223103 1132412371 /nfs/dbraw/zinc/41/23/71/1132412371.db2.gz XRQXYDQSGOXQRC-KBMXLJTQSA-N 1 0 288.391 3.648 20 5 CHBDRO Cc1cccc2c1C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173224390 1132412390 /nfs/dbraw/zinc/41/23/90/1132412390.db2.gz FHZPESFTUUNTKV-AWEZNQCLSA-N 1 0 296.370 3.850 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCC(C)(C)C1 ZINC001173226184 1132412538 /nfs/dbraw/zinc/41/25/38/1132412538.db2.gz VWVWAZNRNNIANX-UKRRQHHQSA-N 1 0 290.407 3.942 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC1CC(F)(F)C1 ZINC001173235020 1132414013 /nfs/dbraw/zinc/41/40/13/1132414013.db2.gz VSUYXOSJUUQLQQ-NSHDSACASA-N 1 0 298.333 3.503 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)nc1 ZINC001173235259 1132414073 /nfs/dbraw/zinc/41/40/73/1132414073.db2.gz RYSQDDUREJVSHP-KBPBESRZSA-N 1 0 299.374 3.580 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC001173233064 1132414398 /nfs/dbraw/zinc/41/43/98/1132414398.db2.gz GVIMSCXHIPLRFB-SUMWQHHRSA-N 1 0 299.374 3.662 20 5 CHBDRO CCc1ccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173214787 1132416349 /nfs/dbraw/zinc/41/63/49/1132416349.db2.gz QDQAJIZSDKEZHQ-AWEZNQCLSA-N 1 0 298.386 3.878 20 5 CHBDRO [NH3+][C@@H]1CCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC000843045907 1132494627 /nfs/dbraw/zinc/49/46/27/1132494627.db2.gz ZAIDSNYVCMUPDX-MRXNPFEDSA-N 1 0 276.383 3.526 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2cccc(C[NH+]3CCCC3)c2)cc1 ZINC001174477971 1132882074 /nfs/dbraw/zinc/88/20/74/1132882074.db2.gz GISPDNSMFYQBBN-UHFFFAOYSA-N 1 0 297.358 3.934 20 5 CHBDRO Cc1ccc(Nc2ccc([C@H]3CC[NH2+]C3)cc2)cc1[N+](=O)[O-] ZINC001159776288 1132908009 /nfs/dbraw/zinc/90/80/09/1132908009.db2.gz DETNWQFKRZFYBQ-AWEZNQCLSA-N 1 0 297.358 3.724 20 5 CHBDRO O=[N+]([O-])c1cccc(Nc2ccccc2C2=CC[NH2+]CC2)c1 ZINC001160023420 1132936275 /nfs/dbraw/zinc/93/62/75/1132936275.db2.gz OLGDNJMUUNMDOC-UHFFFAOYSA-N 1 0 295.342 3.715 20 5 CHBDRO CC1(C)C[NH2+]Cc2cc(Nc3ccccc3[N+](=O)[O-])ccc21 ZINC001160286393 1132958530 /nfs/dbraw/zinc/95/85/30/1132958530.db2.gz JSTQZJPXPSVYTC-UHFFFAOYSA-N 1 0 297.358 3.719 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCc1ccc(NC)cc1 ZINC001164154054 1133201780 /nfs/dbraw/zinc/20/17/80/1133201780.db2.gz MBANPGVFIVXNJS-UHFFFAOYSA-N 1 0 298.454 3.937 20 5 CHBDRO CCC(CC)C[N@H+](CC)CCOc1cccc([N+](=O)[O-])c1 ZINC001166998262 1133297599 /nfs/dbraw/zinc/29/75/99/1133297599.db2.gz YIGRXXKUYQHHIA-UHFFFAOYSA-N 1 0 294.395 3.732 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCc1ccc(C(C)(C)C)cc1 ZINC001204680986 1133475546 /nfs/dbraw/zinc/47/55/46/1133475546.db2.gz PDLQBXRWRSSOJC-AWEZNQCLSA-N 1 0 264.433 3.595 20 5 CHBDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001205489673 1133582534 /nfs/dbraw/zinc/58/25/34/1133582534.db2.gz WVLZQHRUDVDPMW-WFASDCNBSA-N 1 0 276.380 3.832 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1Nc1cc[nH+]c(C2CC2)c1 ZINC001210956113 1134339351 /nfs/dbraw/zinc/33/93/51/1134339351.db2.gz PSVHHWFNNHXXQH-UHFFFAOYSA-N 1 0 273.267 3.750 20 5 CHBDRO C[NH+](C)Cc1ccc(Nc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC001210955879 1134339515 /nfs/dbraw/zinc/33/95/15/1134339515.db2.gz NWCOZACSNKOOGO-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO Cc1cc(Nc2c(Cl)ccc([N+](=O)[O-])c2Cl)cc[nH+]1 ZINC001215581486 1134647751 /nfs/dbraw/zinc/64/77/51/1134647751.db2.gz OAFVNELSYJDCMJ-UHFFFAOYSA-N 1 0 298.129 3.771 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000403327881 1134757022 /nfs/dbraw/zinc/75/70/22/1134757022.db2.gz AZNOHYCEYCPMQS-MYZSUADSSA-N 1 0 274.364 3.682 20 5 CHBDRO C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000308717871 1134979002 /nfs/dbraw/zinc/97/90/02/1134979002.db2.gz YHJNOFPGDSLTKO-SWLSCSKDSA-N 1 0 262.353 3.653 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2CN1CCC12C[NH2+]C2 ZINC001222303851 1135220396 /nfs/dbraw/zinc/22/03/96/1135220396.db2.gz VEEYLYNENKHGAY-UHFFFAOYSA-N 1 0 288.394 3.541 20 5 CHBDRO C[C@H](C[N+](C)(C)C)O[C@H](C)c1ccc(Cl)cc1 ZINC001223961554 1135403174 /nfs/dbraw/zinc/40/31/74/1135403174.db2.gz BIJJGBHZVAMMOA-VXGBXAGGSA-N 1 0 256.797 3.512 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCc1cccc2ccsc21 ZINC001224030337 1135412972 /nfs/dbraw/zinc/41/29/72/1135412972.db2.gz OXSJIYUJXKZUJN-GFCCVEGCSA-N 1 0 264.414 3.513 20 5 CHBDRO CCOc1ccc2ccc(O[C@@H](C)C[N+](C)(C)C)cc2c1 ZINC001226842785 1135748524 /nfs/dbraw/zinc/74/85/24/1135748524.db2.gz ZXDCXYIGXWMZHI-AWEZNQCLSA-N 1 0 288.411 3.712 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1c(N=O)ccc2ccccc21 ZINC001227494281 1135840527 /nfs/dbraw/zinc/84/05/27/1135840527.db2.gz VXEJEHQRVNMDNN-LBPRGKRZSA-N 1 0 273.356 3.711 20 5 CHBDRO CCc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000352755601 529654128 /nfs/dbraw/zinc/65/41/28/529654128.db2.gz MRNUVXMNTWDNQP-ZDUSSCGKSA-N 1 0 299.374 3.711 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCC(C)(C)C1 ZINC000344471406 529995298 /nfs/dbraw/zinc/99/52/98/529995298.db2.gz XNTBRYIJFFJLBQ-CQSZACIVSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1 ZINC000020558005 262250877 /nfs/dbraw/zinc/25/08/77/262250877.db2.gz VMPOBFRCDBZGPZ-CYBMUJFWSA-N 1 0 279.384 3.517 20 5 CHBDRO Cc1sccc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000311913057 262344339 /nfs/dbraw/zinc/34/43/39/262344339.db2.gz CTLLJNCLNPSHCM-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000037010579 260062079 /nfs/dbraw/zinc/06/20/79/260062079.db2.gz ZMYDVDYNVDPEEB-MRXNPFEDSA-N 1 0 288.322 3.975 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000020148560 171036565 /nfs/dbraw/zinc/03/65/65/171036565.db2.gz QQBWXDTZJFJFNA-SNVBAGLBSA-N 1 0 262.334 3.507 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000020148565 171037077 /nfs/dbraw/zinc/03/70/77/171037077.db2.gz GDPMMVKZMSIAPN-JTQLQIEISA-N 1 0 262.334 3.507 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1 ZINC000020205127 171070755 /nfs/dbraw/zinc/07/07/55/171070755.db2.gz IIPGWCOFQNSIDB-IAQYHMDHSA-N 1 0 286.331 3.916 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000020526191 171239526 /nfs/dbraw/zinc/23/95/26/171239526.db2.gz FGYWSWCBXUQDGC-BLLLJJGKSA-N 1 0 282.343 3.933 20 5 CHBDRO CCC[C@H]([NH2+][C@H](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000035732861 172383893 /nfs/dbraw/zinc/38/38/93/172383893.db2.gz QJOBKCIXKCLJFN-ABAIWWIYSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCC(C)C)cc1[N+](=O)[O-] ZINC000038093520 174107294 /nfs/dbraw/zinc/10/72/94/174107294.db2.gz HXZHCMNZBOSOKS-ZDUSSCGKSA-N 1 0 264.369 3.990 20 5 CHBDRO CC(C)CCC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000038093572 174107730 /nfs/dbraw/zinc/10/77/30/174107730.db2.gz TYGNQQSMPVJXPZ-GFCCVEGCSA-N 1 0 250.342 3.682 20 5 CHBDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000042857650 174892362 /nfs/dbraw/zinc/89/23/62/174892362.db2.gz JVHYJTFUOJQSRF-GXTWGEPZSA-N 1 0 262.353 3.511 20 5 CHBDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000042857639 174892384 /nfs/dbraw/zinc/89/23/84/174892384.db2.gz DZQJTRZRYCNHQM-GXTWGEPZSA-N 1 0 262.353 3.511 20 5 CHBDRO C[C@H]([NH2+]CCc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000037176959 260072777 /nfs/dbraw/zinc/07/27/77/260072777.db2.gz LRSPYMRJGPDNOF-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@H](C)C2 ZINC000180825146 260133422 /nfs/dbraw/zinc/13/34/22/260133422.db2.gz OOCLOETVRDQBOL-FZKQIMNGSA-N 1 0 296.370 3.926 20 5 CHBDRO CCC1(C[NH2+]Cc2csc([N+](=O)[O-])c2)CCCC1 ZINC000230200108 260156169 /nfs/dbraw/zinc/15/61/69/260156169.db2.gz UAQOCEYHIHUEAS-UHFFFAOYSA-N 1 0 268.382 3.716 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000449096899 260212421 /nfs/dbraw/zinc/21/24/21/260212421.db2.gz KHDUGZGYHPUOKJ-OCCSQVGLSA-N 1 0 264.369 3.550 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000132457140 260499611 /nfs/dbraw/zinc/49/96/11/260499611.db2.gz QHSWJXQQUZSBAO-ZFWWWQNUSA-N 1 0 294.420 3.921 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1ccccn1 ZINC000152366720 261063239 /nfs/dbraw/zinc/06/32/39/261063239.db2.gz GPIOEYGOWKVQQX-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCC12CCC2 ZINC000444784687 261178908 /nfs/dbraw/zinc/17/89/08/261178908.db2.gz OMVYBSPBWXRNMK-UHFFFAOYSA-N 1 0 280.755 3.767 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000318867633 262087556 /nfs/dbraw/zinc/08/75/56/262087556.db2.gz DCFFIHOFBMXKGN-SFHVURJKSA-N 1 0 296.370 3.723 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC(C)(C)C1 ZINC000497363430 262147026 /nfs/dbraw/zinc/14/70/26/262147026.db2.gz JHLHSUJBDIVVKZ-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1F ZINC000020474760 262251636 /nfs/dbraw/zinc/25/16/36/262251636.db2.gz LUBOLJQRGGFNLN-GFCCVEGCSA-N 1 0 297.374 3.656 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nccs1 ZINC000186733428 262321391 /nfs/dbraw/zinc/32/13/91/262321391.db2.gz OEXDRXCKDQIDRI-MNOVXSKESA-N 1 0 291.376 3.506 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccccc2)cc1[N+](=O)[O-] ZINC000021510169 262389382 /nfs/dbraw/zinc/38/93/82/262389382.db2.gz GYOGOLFHPNTTIJ-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000414208942 262824981 /nfs/dbraw/zinc/82/49/81/262824981.db2.gz MANZMERTQLFBRT-CAPXZKIUSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1F ZINC000414296596 262838358 /nfs/dbraw/zinc/83/83/58/262838358.db2.gz YDIKUISNJKJZAT-BPLDGKMQSA-N 1 0 294.370 3.786 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@H+](CC1CC1)C1CCC1 ZINC000475673481 264335294 /nfs/dbraw/zinc/33/52/94/264335294.db2.gz NYTAEKXKAVRTNZ-GQCTYLIASA-N 1 0 286.375 3.873 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000094279063 265232468 /nfs/dbraw/zinc/23/24/68/265232468.db2.gz FGFIFCRGVIHMAJ-HNNXBMFYSA-N 1 0 276.380 3.696 20 5 CHBDRO CC1(C)CCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000094324581 265236706 /nfs/dbraw/zinc/23/67/06/265236706.db2.gz ZTSQDBSFSNYVKF-CYBMUJFWSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000356686567 266159250 /nfs/dbraw/zinc/15/92/50/266159250.db2.gz VHDHLTLWCQTTKJ-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO COC1CCC([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000583552246 328608931 /nfs/dbraw/zinc/60/89/31/328608931.db2.gz FCAXUOJNZQTECX-DNOWBOINSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCOc2ccccc21 ZINC000171129330 327752071 /nfs/dbraw/zinc/75/20/71/327752071.db2.gz OABVEQAWBVUOBU-HNNXBMFYSA-N 1 0 298.342 3.598 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000040675877 328015529 /nfs/dbraw/zinc/01/55/29/328015529.db2.gz BGJAPNGWVHOZKF-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000040675885 328015543 /nfs/dbraw/zinc/01/55/43/328015543.db2.gz KXTUHUGFGDHYCF-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000040675878 328015546 /nfs/dbraw/zinc/01/55/46/328015546.db2.gz BGJAPNGWVHOZKF-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO COC1([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CCC1 ZINC000414307094 328154318 /nfs/dbraw/zinc/15/43/18/328154318.db2.gz OSBARWHAJOYEIE-OLZOCXBDSA-N 1 0 292.379 3.511 20 5 CHBDRO CCCC[C@@H](COC)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000531969185 328356256 /nfs/dbraw/zinc/35/62/56/328356256.db2.gz RNXSVWLPUKXDIB-ZFWWWQNUSA-N 1 0 294.395 3.759 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(C1CC1)C1CC1 ZINC000531988023 328381513 /nfs/dbraw/zinc/38/15/13/328381513.db2.gz CGEJKABIVHEYTQ-GFCCVEGCSA-N 1 0 288.391 3.990 20 5 CHBDRO CC(C)[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC1CC1 ZINC000535073354 328384248 /nfs/dbraw/zinc/38/42/48/328384248.db2.gz GDRIYHQHFDXRPD-ALCCZGGFSA-N 1 0 274.364 3.728 20 5 CHBDRO C[C@H](c1ccccc1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000532038679 328396883 /nfs/dbraw/zinc/39/68/83/328396883.db2.gz VOCWATCMFAIICM-CYBMUJFWSA-N 1 0 282.343 3.714 20 5 CHBDRO CC1(C)CCC[C@H]1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000388834392 328530419 /nfs/dbraw/zinc/53/04/19/328530419.db2.gz GQECIODJRHZYLB-ZDUSSCGKSA-N 1 0 262.353 3.511 20 5 CHBDRO CCC[C@@H]([NH2+]CCCSC)c1cccc([N+](=O)[O-])c1 ZINC000069434229 326902223 /nfs/dbraw/zinc/90/22/23/326902223.db2.gz SAYRGKRTYAWGEF-CQSZACIVSA-N 1 0 282.409 3.779 20 5 CHBDRO CC[C@@H]1CC[C@H]1[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000558252329 327081681 /nfs/dbraw/zinc/08/16/81/327081681.db2.gz JYGWSZUIPLDABY-OUCADQQQSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC1(C)C ZINC000558256934 327083509 /nfs/dbraw/zinc/08/35/09/327083509.db2.gz LFGULXCJMCNPIN-FZMZJTMJSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@]1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000559324241 327160149 /nfs/dbraw/zinc/16/01/49/327160149.db2.gz WXEVEPYLTOUQKH-ROUUACIJSA-N 1 0 296.370 3.878 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000559418266 327244413 /nfs/dbraw/zinc/24/44/13/327244413.db2.gz PQXHUHAVCRLIRI-GXTWGEPZSA-N 1 0 274.364 3.778 20 5 CHBDRO CC[C@H](C)[C@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)OC ZINC000560348531 327301647 /nfs/dbraw/zinc/30/16/47/327301647.db2.gz OECVJIAIGODADN-RBOXIYTFSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCC(C)C)cccc1[N+](=O)[O-] ZINC000151772890 327504060 /nfs/dbraw/zinc/50/40/60/327504060.db2.gz GNFKEAHQFASVTB-LBPRGKRZSA-N 1 0 250.342 3.600 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000582187697 328620777 /nfs/dbraw/zinc/62/07/77/328620777.db2.gz KZHQOHVOFUCMKU-UONOGXRCSA-N 1 0 294.782 3.569 20 5 CHBDRO CCSCC[C@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000174026240 329157221 /nfs/dbraw/zinc/15/72/21/329157221.db2.gz XMNOANIIGUFVBQ-LBPRGKRZSA-N 1 0 282.409 3.558 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@@H](F)C1)CCC2 ZINC000582785846 329195245 /nfs/dbraw/zinc/19/52/45/329195245.db2.gz RCDJLCGESUEKLR-DVOMOZLQSA-N 1 0 292.354 3.843 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)CCC2 ZINC000582785849 329195336 /nfs/dbraw/zinc/19/53/36/329195336.db2.gz RCDJLCGESUEKLR-XJKCOSOUSA-N 1 0 292.354 3.843 20 5 CHBDRO Cc1occc1C[N@@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182687827 329244095 /nfs/dbraw/zinc/24/40/95/329244095.db2.gz RSCGLWDQLQLRFV-LBPRGKRZSA-N 1 0 288.347 3.998 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)n1 ZINC000187443758 329357836 /nfs/dbraw/zinc/35/78/36/329357836.db2.gz PCSAPUZACUBYAP-CYBMUJFWSA-N 1 0 299.374 3.766 20 5 CHBDRO CC1C[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000571932727 329930374 /nfs/dbraw/zinc/93/03/74/329930374.db2.gz GTGDBUNGOXRMNE-UHFFFAOYSA-N 1 0 288.372 3.775 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@@H]2c2cccn2C)cccc1[N+](=O)[O-] ZINC000079865244 330062998 /nfs/dbraw/zinc/06/29/98/330062998.db2.gz PHNHNFYMWZIGQZ-QGZVFWFLSA-N 1 0 299.374 3.579 20 5 CHBDRO CC[C@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000421874291 330100952 /nfs/dbraw/zinc/10/09/52/330100952.db2.gz ICYXIGZOBZLPFH-CMPLNLGQSA-N 1 0 250.342 3.600 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000035648788 330248375 /nfs/dbraw/zinc/24/83/75/330248375.db2.gz JVVZYLUBRLUWMI-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000035648752 330248489 /nfs/dbraw/zinc/24/84/89/330248489.db2.gz NRFPQAOGBAHQBP-RISCZKNCSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@H]([NH2+][C@H]1C[C@H]1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000536879204 330314562 /nfs/dbraw/zinc/31/45/62/330314562.db2.gz UCEIQTZOQXDJLO-XCRHUMRWSA-N 1 0 296.370 3.877 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCOCCC(C)C)cc1[N+](=O)[O-] ZINC000045093984 330338364 /nfs/dbraw/zinc/33/83/64/330338364.db2.gz VYUBMQGOXUSWRY-AWEZNQCLSA-N 1 0 294.395 3.617 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000045628957 330347259 /nfs/dbraw/zinc/34/72/59/330347259.db2.gz UHJFSPXINQJODJ-UONOGXRCSA-N 1 0 274.364 3.910 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2(CC)CC2)cc1[N+](=O)[O-] ZINC000536909191 330364770 /nfs/dbraw/zinc/36/47/70/330364770.db2.gz IPZROSUSVSOPKP-GFCCVEGCSA-N 1 0 292.379 3.834 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000120184214 330386158 /nfs/dbraw/zinc/38/61/58/330386158.db2.gz QQBKLTGQXJPXMP-OAHLLOKOSA-N 1 0 282.343 3.584 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@]1(C)CCCS1 ZINC000120443077 330387896 /nfs/dbraw/zinc/38/78/96/330387896.db2.gz QAYBZCAKNUKLSQ-IUODEOHRSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@]1(C)CCCS1 ZINC000120442802 330387925 /nfs/dbraw/zinc/38/79/25/330387925.db2.gz QAYBZCAKNUKLSQ-DOMZBBRYSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000437046233 330691821 /nfs/dbraw/zinc/69/18/21/330691821.db2.gz MNNOSFZGSPDCKJ-WXHSDQCUSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])cc1)[C@H](c1ccccc1)[NH+](C)C ZINC000439129602 330734236 /nfs/dbraw/zinc/73/42/36/330734236.db2.gz QYDYVZDAMCEEDZ-CXAGYDPISA-N 1 0 299.374 3.698 20 5 CHBDRO CCCC[C@H](CC)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446839621 330856214 /nfs/dbraw/zinc/85/62/14/330856214.db2.gz UJJXBBVRESCVIZ-NSHDSACASA-N 1 0 290.367 3.530 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCc1ccccc1)CCC2 ZINC000447518383 330867602 /nfs/dbraw/zinc/86/76/02/330867602.db2.gz VTRATKDFWDJTRE-SFHVURJKSA-N 1 0 296.370 3.805 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000449090475 330898415 /nfs/dbraw/zinc/89/84/15/330898415.db2.gz NDOPLGWIDLVKOL-NSHDSACASA-N 1 0 290.388 3.686 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000449189124 330904993 /nfs/dbraw/zinc/90/49/93/330904993.db2.gz OXDLRBDTLATWEU-WCQYABFASA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC12CCCC2 ZINC000449288190 330912172 /nfs/dbraw/zinc/91/21/72/330912172.db2.gz YBVCCXXWOHHFDV-XJKSGUPXSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCC(C)(F)F ZINC000449353451 330917939 /nfs/dbraw/zinc/91/79/39/330917939.db2.gz BQRBFWXWMOIFBK-LLVKDONJSA-N 1 0 286.322 3.551 20 5 CHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCC(F)(F)C1 ZINC000450977319 331009692 /nfs/dbraw/zinc/00/96/92/331009692.db2.gz VIIIRLLDMAPMOB-GFCCVEGCSA-N 1 0 298.333 3.505 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H]1CCC12CCCC2 ZINC000451459133 331030351 /nfs/dbraw/zinc/03/03/51/331030351.db2.gz PVDATOGXEJDLAB-CQSZACIVSA-N 1 0 278.327 3.546 20 5 CHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CCCCF)C2)cc1 ZINC000451543726 331033503 /nfs/dbraw/zinc/03/35/03/331033503.db2.gz CIUABEJMJCVGOR-AWEZNQCLSA-N 1 0 280.343 3.524 20 5 CHBDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000452031846 331051054 /nfs/dbraw/zinc/05/10/54/331051054.db2.gz BJYIBIDUGZSQGR-JGGQBBKZSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H](C)[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)OC ZINC000453267047 331109235 /nfs/dbraw/zinc/10/92/35/331109235.db2.gz LOLADXKATPCOGW-RBOXIYTFSA-N 1 0 294.395 3.615 20 5 CHBDRO CCC1([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000453288821 331111543 /nfs/dbraw/zinc/11/15/43/331111543.db2.gz LTUZEUCJBMHTSW-CQSZACIVSA-N 1 0 260.337 3.504 20 5 CHBDRO CC(C)[C@@H]1C[C@H]1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000453339577 331118873 /nfs/dbraw/zinc/11/88/73/331118873.db2.gz HCBOWLYDOHDVIO-ZLDLUXBVSA-N 1 0 262.353 3.538 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](c2ccccc2)C2CC2)cc1 ZINC000195601165 331178229 /nfs/dbraw/zinc/17/82/29/331178229.db2.gz LIZYDAKTBYILRK-GOSISDBHSA-N 1 0 296.370 3.878 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2Cc3ccccc32)cc1[N+](=O)[O-] ZINC000195651196 331179480 /nfs/dbraw/zinc/17/94/80/331179480.db2.gz KPXASUYBFSHBSV-BBRMVZONSA-N 1 0 296.370 3.894 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@H]2CCCF)c1 ZINC000510661046 332910060 /nfs/dbraw/zinc/91/00/60/332910060.db2.gz FPOPVHOBCYEISU-GOEBONIOSA-N 1 0 294.370 3.645 20 5 CHBDRO C[C@]1([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CC=CCC1 ZINC000459753287 331298369 /nfs/dbraw/zinc/29/83/69/331298369.db2.gz LXSLCQGRPOPVFL-DYLHUKMJSA-N 1 0 272.348 3.696 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)c(Cl)c1 ZINC000459753165 331298481 /nfs/dbraw/zinc/29/84/81/331298481.db2.gz IUHSJERABASPOV-LJWDBELGSA-N 1 0 280.755 3.526 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464777031 331367523 /nfs/dbraw/zinc/36/75/23/331367523.db2.gz LTYFZNCYVXIPRS-INIZCTEOSA-N 1 0 276.380 3.649 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@@H](C)CC[C@H]2C)cccc1[N+](=O)[O-] ZINC000464815900 331369296 /nfs/dbraw/zinc/36/92/96/331369296.db2.gz VIWAXFUZDCPGQG-NWDGAFQWSA-N 1 0 262.353 3.524 20 5 CHBDRO CCC[C@@]1(C)CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000464843143 331370770 /nfs/dbraw/zinc/37/07/70/331370770.db2.gz QNCHEPQXVXSTIN-INIZCTEOSA-N 1 0 276.380 3.997 20 5 CHBDRO C[C@@H]1CCC[C@@H]1C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000466421675 331396262 /nfs/dbraw/zinc/39/62/62/331396262.db2.gz NOVHKMMSOOFAOL-IVZDOJFNSA-N 1 0 274.364 3.634 20 5 CHBDRO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000467985160 331426303 /nfs/dbraw/zinc/42/63/03/331426303.db2.gz RCYXJBNSPCDPSG-FZKQIMNGSA-N 1 0 296.370 3.660 20 5 CHBDRO Cc1c(C[NH2+][C@H]2c3ccccc3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000478499222 331707486 /nfs/dbraw/zinc/70/74/86/331707486.db2.gz DMQHIDBADAGMJP-KPZWWZAWSA-N 1 0 296.370 3.926 20 5 CHBDRO CC1(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000479441394 331729939 /nfs/dbraw/zinc/72/99/39/331729939.db2.gz VPOCCGYKJCRTOW-OAHLLOKOSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@H]([NH2+]C1CCC2(CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000488417792 332005717 /nfs/dbraw/zinc/00/57/17/332005717.db2.gz MMXUZDXLFDTLSU-LBPRGKRZSA-N 1 0 274.364 3.968 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C2CC(C(C)C)C2)cc1[N+](=O)[O-] ZINC000488446075 332009709 /nfs/dbraw/zinc/00/97/09/332009709.db2.gz STUMKWUDSLTETD-LRVUVFPRSA-N 1 0 276.380 3.988 20 5 CHBDRO CCC[N@H+](CC)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489108286 332041826 /nfs/dbraw/zinc/04/18/26/332041826.db2.gz VGUHDPVIDOVSDA-GFCCVEGCSA-N 1 0 250.342 3.696 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCc1ccccc1 ZINC000489122272 332041988 /nfs/dbraw/zinc/04/19/88/332041988.db2.gz JOXOSAVULMCUPV-CQSZACIVSA-N 1 0 284.359 3.830 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](C2CC2)[C@H]2C=CCCC2)cc1 ZINC000490838907 332119102 /nfs/dbraw/zinc/11/91/02/332119102.db2.gz BITDPEGDICMFHI-AWEZNQCLSA-N 1 0 272.348 3.668 20 5 CHBDRO CCC(CC)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494474633 332474744 /nfs/dbraw/zinc/47/47/44/332474744.db2.gz KVZUJHKFDQUPOX-UHFFFAOYSA-N 1 0 290.285 3.892 20 5 CHBDRO CCC[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494506447 332476492 /nfs/dbraw/zinc/47/64/92/332476492.db2.gz KYPZQKQMEXMXDA-SECBINFHSA-N 1 0 290.285 3.892 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CCC3)s2)cc1 ZINC000501350997 332630629 /nfs/dbraw/zinc/63/06/29/332630629.db2.gz YUCXWSUPRSBMHF-UHFFFAOYSA-N 1 0 288.372 3.965 20 5 CHBDRO C[C@@H]1CC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000513057050 333001850 /nfs/dbraw/zinc/00/18/50/333001850.db2.gz MHDTZXGVNGMCEQ-BXUZGUMPSA-N 1 0 286.331 3.743 20 5 CHBDRO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000513689858 333032526 /nfs/dbraw/zinc/03/25/26/333032526.db2.gz GAICOPGQLGMNAJ-CYBMUJFWSA-N 1 0 282.343 3.714 20 5 CHBDRO CC[C@H](C)C[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000088295554 333087919 /nfs/dbraw/zinc/08/79/19/333087919.db2.gz XXVPFXLBBSQMQH-RYUDHWBXSA-N 1 0 250.342 3.509 20 5 CHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]C[C@H]3CC=CCC3)c2c1 ZINC000575831937 335120648 /nfs/dbraw/zinc/12/06/48/335120648.db2.gz LAQQIFJXAZTOMU-ZDUSSCGKSA-N 1 0 299.374 3.565 20 5 CHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]C[C@@H]3CC=CCC3)c2c1 ZINC000575831936 335120661 /nfs/dbraw/zinc/12/06/61/335120661.db2.gz LAQQIFJXAZTOMU-CYBMUJFWSA-N 1 0 299.374 3.565 20 5 CHBDRO CCC[C@H]([NH2+]CC(C)(C)COC)c1cccc([N+](=O)[O-])c1 ZINC000336848683 335121147 /nfs/dbraw/zinc/12/11/47/335121147.db2.gz MDHFIHXCPNYIRT-HNNXBMFYSA-N 1 0 294.395 3.698 20 5 CHBDRO COC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CCCCC1 ZINC000186510607 333162030 /nfs/dbraw/zinc/16/20/30/333162030.db2.gz ONUHTDGLEHIQKQ-ZDUSSCGKSA-N 1 0 292.379 3.595 20 5 CHBDRO CCC1(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000222202221 333176881 /nfs/dbraw/zinc/17/68/81/333176881.db2.gz OWYLVCRQNVMYTG-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC2CCCC2)cc1[N+](=O)[O-] ZINC000521819119 333190089 /nfs/dbraw/zinc/19/00/89/333190089.db2.gz RYGDMBGLQPCHAI-UHFFFAOYSA-N 1 0 276.380 3.998 20 5 CHBDRO CCOC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C(C)C ZINC000189360300 333190831 /nfs/dbraw/zinc/19/08/31/333190831.db2.gz DMDGBNPBCQNELJ-ZFWWWQNUSA-N 1 0 294.395 3.615 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@](C)(O)CCC)c1cccc([N+](=O)[O-])c1 ZINC000223508234 333208871 /nfs/dbraw/zinc/20/88/71/333208871.db2.gz RJXKLOKIEUIVBP-HZPDHXFCSA-N 1 0 294.395 3.577 20 5 CHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000522418962 333286743 /nfs/dbraw/zinc/28/67/43/333286743.db2.gz VZDSXMYEIIKKTH-RHSMWYFYSA-N 1 0 296.370 3.973 20 5 CHBDRO CCC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000227758315 333288001 /nfs/dbraw/zinc/28/80/01/333288001.db2.gz IJUDNSGACMVDEP-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO CCC1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000230200114 333315560 /nfs/dbraw/zinc/31/55/60/333315560.db2.gz YDFSWBCNGIMGLQ-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@H](OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000231692796 333328439 /nfs/dbraw/zinc/32/84/39/333328439.db2.gz FPAVGILOVANMNA-IMJJTQAJSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)cc1 ZINC000303538199 333343564 /nfs/dbraw/zinc/34/35/64/333343564.db2.gz HJBADPFFVPEUBD-KRWDZBQOSA-N 1 0 286.375 3.917 20 5 CHBDRO CC1=C[C@H](C)C[C@H](C[NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000235383599 333368578 /nfs/dbraw/zinc/36/85/78/333368578.db2.gz SWRYJQAQEYPDIY-JSGCOSHPSA-N 1 0 274.364 3.677 20 5 CHBDRO CC1=C[C@@H](C)C[C@@H](C[NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000235704779 333371877 /nfs/dbraw/zinc/37/18/77/333371877.db2.gz SWRYJQAQEYPDIY-TZMCWYRMSA-N 1 0 274.364 3.677 20 5 CHBDRO C[C@H](CCc1ccccc1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000237510340 333379787 /nfs/dbraw/zinc/37/97/87/333379787.db2.gz ZVJIGRKKZPSINF-OAHLLOKOSA-N 1 0 298.386 3.748 20 5 CHBDRO Cc1ccsc1CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000538116105 333574918 /nfs/dbraw/zinc/57/49/18/333574918.db2.gz IRSJQYXBNYFJRM-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO C/C(=C\c1ccccc1)C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000540592753 333736422 /nfs/dbraw/zinc/73/64/22/333736422.db2.gz SCRFVVFTYFNREQ-SDNWHVSQSA-N 1 0 282.343 3.788 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)C2CCCC2)cc1[N+](=O)[O-] ZINC000070306183 333806612 /nfs/dbraw/zinc/80/66/12/333806612.db2.gz UNESOPUKVCLMQC-LBPRGKRZSA-N 1 0 262.353 3.572 20 5 CHBDRO CC(C)=CCC[C@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000547739563 334113649 /nfs/dbraw/zinc/11/36/49/334113649.db2.gz APPSDNQDVIHKOJ-AWEZNQCLSA-N 1 0 276.380 3.862 20 5 CHBDRO CC(C)([NH2+]Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000080347154 334170702 /nfs/dbraw/zinc/17/07/02/334170702.db2.gz MCIXAKGDVMDALT-UHFFFAOYSA-N 1 0 270.332 3.620 20 5 CHBDRO CC(C)[C@@H](C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000081045311 334177316 /nfs/dbraw/zinc/17/73/16/334177316.db2.gz HJAGBRYJAQUXJA-NWDGAFQWSA-N 1 0 250.342 3.538 20 5 CHBDRO C[C@@H](F)CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000551258124 334243042 /nfs/dbraw/zinc/24/30/42/334243042.db2.gz DJAHWFPINQOEBL-QMTHXVAHSA-N 1 0 280.343 3.655 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000249384300 334332886 /nfs/dbraw/zinc/33/28/86/334332886.db2.gz WYUJSULLGRCRIC-SDDRHHMPSA-N 1 0 250.342 3.680 20 5 CHBDRO C[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000553102595 334361653 /nfs/dbraw/zinc/36/16/53/334361653.db2.gz VZSVDTWNSYFGIY-CYBMUJFWSA-N 1 0 292.379 3.532 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000252182362 334376134 /nfs/dbraw/zinc/37/61/34/334376134.db2.gz QGCNTFVRDXBIQD-XUJVJEKNSA-N 1 0 262.353 3.509 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000252216931 334377453 /nfs/dbraw/zinc/37/74/53/334377453.db2.gz ZKWBSJFECVZKRK-IMRBUKKESA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC(F)(F)F ZINC000577928032 335422046 /nfs/dbraw/zinc/42/20/46/335422046.db2.gz ZGSZHVZPWCWKNO-JTQLQIEISA-N 1 0 290.285 3.896 20 5 CHBDRO Cc1csc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000380849606 336037113 /nfs/dbraw/zinc/03/71/13/336037113.db2.gz BKJPMZIVVQXNPK-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO COc1ccc(C[NH2+][C@@H](C)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000384454894 336124550 /nfs/dbraw/zinc/12/45/50/336124550.db2.gz KPKLWOBCQUZEGM-NSHDSACASA-N 1 0 280.368 3.518 20 5 CHBDRO CCCC[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000050888094 521148446 /nfs/dbraw/zinc/14/84/46/521148446.db2.gz QZYDAGJZPQUNIU-JTQLQIEISA-N 1 0 270.760 3.917 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]Cc2cccnc2)c2cc([N+](=O)[O-])ccc21 ZINC000279185189 520524119 /nfs/dbraw/zinc/52/41/19/520524119.db2.gz VVVBIYKTTOKMPX-MRXNPFEDSA-N 1 0 297.358 3.502 20 5 CHBDRO COC1(C[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000277104425 522639147 /nfs/dbraw/zinc/63/91/47/522639147.db2.gz LXDUAHXAFLMXEK-OLZOCXBDSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000051627907 522641908 /nfs/dbraw/zinc/64/19/08/522641908.db2.gz HZVKRFIWXKHBPE-HNNXBMFYSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000050015538 522655451 /nfs/dbraw/zinc/65/54/51/522655451.db2.gz YHBMIKAPBHYWLH-HNNXBMFYSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000037010519 522699762 /nfs/dbraw/zinc/69/97/62/522699762.db2.gz SZQFSBDJBGAIMO-LRDDRELGSA-N 1 0 285.347 3.792 20 5 CHBDRO CC[C@@H](c1ccncc1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000130244762 523118427 /nfs/dbraw/zinc/11/84/27/523118427.db2.gz PATVBNBOSAEXMD-KRWDZBQOSA-N 1 0 299.374 3.615 20 5 CHBDRO Cc1ccc(C)c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000048327241 524104834 /nfs/dbraw/zinc/10/48/34/524104834.db2.gz ADHWLTUVXSIRSQ-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000339919920 524201445 /nfs/dbraw/zinc/20/14/45/524201445.db2.gz DSCAZKPFLONZNO-JQWIXIFHSA-N 1 0 268.382 3.667 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000054080633 525613528 /nfs/dbraw/zinc/61/35/28/525613528.db2.gz QVLCLRNKQWUJDU-NEPJUHHUSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccn1 ZINC000192594113 525614334 /nfs/dbraw/zinc/61/43/34/525614334.db2.gz VXCJEOLWIJNQSR-SJCJKPOMSA-N 1 0 297.358 3.718 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000038097736 525928075 /nfs/dbraw/zinc/92/80/75/525928075.db2.gz DOWAQQBVBHTKCP-LBPRGKRZSA-N 1 0 274.320 3.655 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000020473285 525928321 /nfs/dbraw/zinc/92/83/21/525928321.db2.gz GNAAYNYHLWEKFL-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000293579575 525935810 /nfs/dbraw/zinc/93/58/10/525935810.db2.gz DVCFOTSYLWRQNX-STQMWFEESA-N 1 0 299.374 3.897 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1 ZINC000061757124 526085193 /nfs/dbraw/zinc/08/51/93/526085193.db2.gz XLRFBAMRXHAZLD-CYBMUJFWSA-N 1 0 270.332 3.788 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@H]2CC[C@H](F)C2)c2cc([N+](=O)[O-])ccc21 ZINC000331636481 527748038 /nfs/dbraw/zinc/74/80/38/527748038.db2.gz SJCHWJGXQIMIDY-PGUXBMHVSA-N 1 0 292.354 3.797 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000353589531 528092124 /nfs/dbraw/zinc/09/21/24/528092124.db2.gz QFMDYFNDDLYXNH-LBPRGKRZSA-N 1 0 262.353 3.703 20 5 CHBDRO CCOCC[N@H+](CC)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000352833581 528723432 /nfs/dbraw/zinc/72/34/32/528723432.db2.gz SIHXFHQTWJSJSJ-UHFFFAOYSA-N 1 0 294.395 3.577 20 5 CHBDRO CC1(C)CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000353672320 528938488 /nfs/dbraw/zinc/93/84/88/528938488.db2.gz QCXQZSIIPVPULI-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO C[C@H](CCc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000013726126 567894079 /nfs/dbraw/zinc/89/40/79/567894079.db2.gz OGOPVSDEBSMRQR-CQSZACIVSA-N 1 0 284.359 3.706 20 5 CHBDRO CC(C)SCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000348300297 1125499080 /nfs/dbraw/zinc/49/90/80/1125499080.db2.gz IUZFOZJRTKLDLO-OAHLLOKOSA-N 1 0 294.420 3.703 20 5 CHBDRO CC(C)[NH+](CCCNc1sccc1[N+](=O)[O-])C(C)C ZINC000611412674 1121646147 /nfs/dbraw/zinc/64/61/47/1121646147.db2.gz CPUPLTBQEGQQLP-UHFFFAOYSA-N 1 0 285.413 3.577 20 5 CHBDRO Cc1ccc(C(C)(C)C)c(O[C@H](C)C[N+](C)(C)C)c1 ZINC001228193221 1131827844 /nfs/dbraw/zinc/82/78/44/1131827844.db2.gz RIMXYWUJFUXZEV-CQSZACIVSA-N 1 0 264.433 3.766 20 5 CHBDRO C[C@@H]([NH2+]CCC1(F)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000348315802 1125537853 /nfs/dbraw/zinc/53/78/53/1125537853.db2.gz CUITYDWCILWHAG-LLVKDONJSA-N 1 0 266.316 3.528 20 5 CHBDRO CC(C)[C@H](c1ccccc1)[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886008616 1125635704 /nfs/dbraw/zinc/63/57/04/1125635704.db2.gz QZSQJUJOQFLRMJ-MRXNPFEDSA-N 1 0 299.374 3.819 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2cccnc2[N+](=O)[O-])c(C)s1 ZINC000886107485 1125650518 /nfs/dbraw/zinc/65/05/18/1125650518.db2.gz SIRBBJGPLHBQEA-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1(C2CC2)CCC1 ZINC000886392076 1125676450 /nfs/dbraw/zinc/67/64/50/1125676450.db2.gz SKQPJCKSIFSIBP-UTCJRWHESA-N 1 0 272.348 3.530 20 5 CHBDRO OC[C@@H]1CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000092763981 1125761458 /nfs/dbraw/zinc/76/14/58/1125761458.db2.gz NDRRVGQNPJMSPF-OAHLLOKOSA-N 1 0 291.394 3.807 20 5 CHBDRO CC(C)C[NH+](Cc1ccc([N+](=O)[O-])c(F)c1)CC(C)C ZINC000094774393 1129451653 /nfs/dbraw/zinc/45/16/53/1129451653.db2.gz WIGAKBDICASAIV-UHFFFAOYSA-N 1 0 282.359 3.848 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccs1 ZINC001168968185 1129687457 /nfs/dbraw/zinc/68/74/57/1129687457.db2.gz XHCZKHUQSFWXLX-AGIUHOORSA-N 1 0 282.409 3.624 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC1=CCCC1 ZINC000338219604 1126724293 /nfs/dbraw/zinc/72/42/93/1126724293.db2.gz XCYGCNMZPDJNPX-UHFFFAOYSA-N 1 0 290.363 3.584 20 5 CHBDRO Cc1c(C[NH2+]C[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000159363087 1126737388 /nfs/dbraw/zinc/73/73/88/1126737388.db2.gz FGZWAJAGQNNCFY-CYBMUJFWSA-N 1 0 284.359 3.797 20 5 CHBDRO CC1=C(C)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000482458723 1126757745 /nfs/dbraw/zinc/75/77/45/1126757745.db2.gz MMCFREWQODZHPC-ALCCZGGFSA-N 1 0 272.348 3.650 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCC(C)=C(C)C2)ccc1[N+](=O)[O-] ZINC000483364405 1126783740 /nfs/dbraw/zinc/78/37/40/1126783740.db2.gz ALVAVLGJAIYLSI-UHFFFAOYSA-N 1 0 290.363 3.536 20 5 CHBDRO C[C@H](Cc1cccs1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000036992576 1126848810 /nfs/dbraw/zinc/84/88/10/1126848810.db2.gz PVZSVWOQLVOOQO-NEPJUHHUSA-N 1 0 290.388 3.938 20 5 CHBDRO CC[C@H](C[C@](C)(O)CC)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000924798369 1126852485 /nfs/dbraw/zinc/85/24/85/1126852485.db2.gz NIGKRIXGJQJSPH-JGGQBBKZSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1ccc(CNc2ccc(C(C)(C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000904471987 1126853666 /nfs/dbraw/zinc/85/36/66/1126853666.db2.gz KKQLSPPYXBNAPH-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000183258312 1126883568 /nfs/dbraw/zinc/88/35/68/1126883568.db2.gz ZHAVKCQADGAHAX-LBPRGKRZSA-N 1 0 274.320 3.689 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCCc2occc21 ZINC000183432190 1126886913 /nfs/dbraw/zinc/88/69/13/1126886913.db2.gz LATKGUITJPTRBD-OAHLLOKOSA-N 1 0 286.331 3.663 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cccs1)CCC2 ZINC000192605930 1126962355 /nfs/dbraw/zinc/96/23/55/1126962355.db2.gz ZFXIPUQCSBSTGJ-HNNXBMFYSA-N 1 0 288.372 3.824 20 5 CHBDRO CCCC[C@H](OCC[N+](C)(C)C)C1CCCCC1 ZINC001224776012 1126993781 /nfs/dbraw/zinc/99/37/81/1126993781.db2.gz RGBNKVDFPFWXIZ-INIZCTEOSA-N 1 0 256.454 3.848 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C/C=C\c2ccncc2)cc1[N+](=O)[O-] ZINC000487279387 1127028947 /nfs/dbraw/zinc/02/89/47/1127028947.db2.gz VSVUIMQWWFOJTM-NQHOJNORSA-N 1 0 297.358 3.662 20 5 CHBDRO CC[C@@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000042553232 1127054594 /nfs/dbraw/zinc/05/45/94/1127054594.db2.gz NACPUXICQAZXPI-WOPDTQHZSA-N 1 0 250.342 3.680 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccnc1 ZINC000270623886 1127058879 /nfs/dbraw/zinc/05/88/79/1127058879.db2.gz DVDUEKRRFSXHGT-ZDUSSCGKSA-N 1 0 285.347 3.573 20 5 CHBDRO CCN(Cc1ccccn1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000270707219 1127060780 /nfs/dbraw/zinc/06/07/80/1127060780.db2.gz GXZHAPXIRHBGSL-CYBMUJFWSA-N 1 0 285.347 3.573 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1C=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000698194860 1127189406 /nfs/dbraw/zinc/18/94/06/1127189406.db2.gz HJSRWVVVRPQWRQ-UKRRQHHQSA-N 1 0 260.337 3.744 20 5 CHBDRO C[C@@H](CF)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000588930772 1127207752 /nfs/dbraw/zinc/20/77/52/1127207752.db2.gz RPTZOMMSAUOTMR-JTQLQIEISA-N 1 0 294.351 3.771 20 5 CHBDRO CC(C)[N@H+](CC[C@@H](C)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000351843771 1127211316 /nfs/dbraw/zinc/21/13/16/1127211316.db2.gz HQFQTUAUNKCUES-GFCCVEGCSA-N 1 0 268.332 3.553 20 5 CHBDRO Cc1c(C[NH+]2CCC(C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000590008064 1127242687 /nfs/dbraw/zinc/24/26/87/1127242687.db2.gz BQKONVYBACFIEA-UHFFFAOYSA-N 1 0 274.364 3.525 20 5 CHBDRO CC(C)[N@H+](CCCCF)Cc1ccc([N+](=O)[O-])cc1 ZINC000285959808 1127248513 /nfs/dbraw/zinc/24/85/13/1127248513.db2.gz KMSRRLBUYZRUIQ-UHFFFAOYSA-N 1 0 268.332 3.555 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@H]2CC=CCC2)c1 ZINC000045629018 1127261001 /nfs/dbraw/zinc/26/10/01/1127261001.db2.gz CFEYSULUOQQTRD-NSHDSACASA-N 1 0 280.755 3.694 20 5 CHBDRO Cc1ccc(CN(C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)nc1 ZINC000590754359 1127270813 /nfs/dbraw/zinc/27/08/13/1127270813.db2.gz AIUGGGDACFPFSV-AWEZNQCLSA-N 1 0 299.374 3.800 20 5 CHBDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573046308 1127281463 /nfs/dbraw/zinc/28/14/63/1127281463.db2.gz XFKRKANPCKCJCA-JSGCOSHPSA-N 1 0 262.353 3.666 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccs2)C2CC2)cc1 ZINC000045751361 1127292971 /nfs/dbraw/zinc/29/29/71/1127292971.db2.gz CKAQZQNJJYAJEG-UHFFFAOYSA-N 1 0 288.372 3.821 20 5 CHBDRO C[C@H]([NH2+][C@H]1C[C@@H](OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000592396123 1127373074 /nfs/dbraw/zinc/37/30/74/1127373074.db2.gz HMVHYEVGZCUNDB-CORIIIEPSA-N 1 0 292.379 3.592 20 5 CHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000358195184 1127407663 /nfs/dbraw/zinc/40/76/63/1127407663.db2.gz CIIMSMGKBAKUKR-CQSZACIVSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000358351837 1127416692 /nfs/dbraw/zinc/41/66/92/1127416692.db2.gz LLTPHQRRRHOFBO-SJKOYZFVSA-N 1 0 297.358 3.792 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000358391638 1127419400 /nfs/dbraw/zinc/41/94/00/1127419400.db2.gz FEHVGBPRKHXJJV-VNHYZAJKSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594515837 1127420212 /nfs/dbraw/zinc/42/02/12/1127420212.db2.gz SUUHSGWAZSPBJV-KGLIPLIRSA-N 1 0 299.374 3.580 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594515836 1127420292 /nfs/dbraw/zinc/42/02/92/1127420292.db2.gz SUUHSGWAZSPBJV-KBPBESRZSA-N 1 0 299.374 3.580 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000594516962 1127421057 /nfs/dbraw/zinc/42/10/57/1127421057.db2.gz ZRRMQHANBHGQGQ-SUMWQHHRSA-N 1 0 299.374 3.662 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)Cc1ccccn1 ZINC000594516572 1127421224 /nfs/dbraw/zinc/42/12/24/1127421224.db2.gz XKXXRBGNKWVBAI-ZIAGYGMSSA-N 1 0 299.374 3.580 20 5 CHBDRO CSCC1(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000594714367 1127429188 /nfs/dbraw/zinc/42/91/88/1127429188.db2.gz YEYLYTMHYOYELZ-GFCCVEGCSA-N 1 0 294.420 3.779 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC2(C(F)F)CC2)cc1[N+](=O)[O-] ZINC000359001986 1127443811 /nfs/dbraw/zinc/44/38/11/1127443811.db2.gz NNYHZQKMDVGEKL-JTQLQIEISA-N 1 0 284.306 3.599 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000595049829 1127451132 /nfs/dbraw/zinc/45/11/32/1127451132.db2.gz PHDRIJIBWVIFFE-CZUORRHYSA-N 1 0 299.374 3.834 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C(C)C)C1CC1 ZINC000595097951 1127452506 /nfs/dbraw/zinc/45/25/06/1127452506.db2.gz AGAIQMHABXIKSG-MEDUHNTESA-N 1 0 292.379 3.689 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CC)C2CC2)cc1[N+](=O)[O-] ZINC000595082292 1127453374 /nfs/dbraw/zinc/45/33/74/1127453374.db2.gz XZXYZXXEFMESKQ-SMDDNHRTSA-N 1 0 292.379 3.833 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000595079227 1127453549 /nfs/dbraw/zinc/45/35/49/1127453549.db2.gz ISFOJQMTXBDOAW-ZWNOBZJWSA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@]1(C)CC1(F)F ZINC000595081289 1127453619 /nfs/dbraw/zinc/45/36/19/1127453619.db2.gz QYOIWGQQQMFTBH-GXFFZTMASA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2=CCCC2)cccc1[N+](=O)[O-] ZINC000595096357 1127455573 /nfs/dbraw/zinc/45/55/73/1127455573.db2.gz JXHWICUCUWNFOR-LBPRGKRZSA-N 1 0 260.337 3.664 20 5 CHBDRO Cc1noc(C[N@H+]2CCCC[C@H]2CCC(C)C)c1[N+](=O)[O-] ZINC000595385402 1127461522 /nfs/dbraw/zinc/46/15/22/1127461522.db2.gz VGSDTMUKGGVWGO-ZDUSSCGKSA-N 1 0 295.383 3.682 20 5 CHBDRO Cc1noc(C[NH2+][C@H]2CCC[C@@H]2CCC(C)C)c1[N+](=O)[O-] ZINC000595452165 1127463596 /nfs/dbraw/zinc/46/35/96/1127463596.db2.gz ZEPUOOZWYQZWQA-OLZOCXBDSA-N 1 0 295.383 3.586 20 5 CHBDRO C[C@@H]1CC[C@@H](C)[NH+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000360028751 1127486939 /nfs/dbraw/zinc/48/69/39/1127486939.db2.gz XJNHDQXMVKAZBX-NXEZZACHSA-N 1 0 268.744 3.621 20 5 CHBDRO CC(C)C1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000227832754 1127507824 /nfs/dbraw/zinc/50/78/24/1127507824.db2.gz TVGJDAUCGRKTTF-UHFFFAOYSA-N 1 0 282.771 3.774 20 5 CHBDRO Cc1ccoc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000293700964 1127513507 /nfs/dbraw/zinc/51/35/07/1127513507.db2.gz OKQOWVOAPKAUIZ-LBPRGKRZSA-N 1 0 274.320 3.655 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000294363861 1127568367 /nfs/dbraw/zinc/56/83/67/1127568367.db2.gz AVFYTAVXXBXPLK-COMQUAJESA-N 1 0 292.379 3.510 20 5 CHBDRO COC[C@H](CC(C)(C)C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000593585342 1127629917 /nfs/dbraw/zinc/62/99/17/1127629917.db2.gz GGFHHVCZWFWPLZ-OCCSQVGLSA-N 1 0 294.395 3.697 20 5 CHBDRO CC(C)C[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C ZINC000603438461 1127650187 /nfs/dbraw/zinc/65/01/87/1127650187.db2.gz XTZLOYUVADDZGP-GFCCVEGCSA-N 1 0 299.802 3.636 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1C[C@H](C)C(F)(F)[C@@H](C)C1 ZINC000599059223 1127653835 /nfs/dbraw/zinc/65/38/35/1127653835.db2.gz PXEAYSYBZQJZGI-SDDRHHMPSA-N 1 0 298.333 3.879 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCCC12CC2)c1ccc([N+](=O)[O-])cc1 ZINC000599089804 1127656584 /nfs/dbraw/zinc/65/65/84/1127656584.db2.gz ASZRUPLAYPYRRH-JSGCOSHPSA-N 1 0 274.364 3.826 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCC1=CCCC1 ZINC000229201420 1127660114 /nfs/dbraw/zinc/66/01/14/1127660114.db2.gz VBDPMXKSPFWMFD-UHFFFAOYSA-N 1 0 280.755 3.838 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1(C2CCC2)CC1 ZINC000593718503 1127665158 /nfs/dbraw/zinc/66/51/58/1127665158.db2.gz JEPPEZQNEUEYHR-CYBMUJFWSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@@H]([N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000604012213 1127689500 /nfs/dbraw/zinc/68/95/00/1127689500.db2.gz MBPUWGTVMJGFDV-CYBMUJFWSA-N 1 0 294.395 3.730 20 5 CHBDRO CC1CCC([N@H+](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000061799088 1127718264 /nfs/dbraw/zinc/71/82/64/1127718264.db2.gz LDGQKYDELGYAPC-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1NCC(C)(C)C[NH+](C)C ZINC001168767640 1127917996 /nfs/dbraw/zinc/91/79/96/1127917996.db2.gz HBENUCMVQHXFKA-UHFFFAOYSA-N 1 0 293.411 3.520 20 5 CHBDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000076067347 1127931830 /nfs/dbraw/zinc/93/18/30/1127931830.db2.gz BUOSZHWXDDITOR-GJZGRUSLSA-N 1 0 294.420 3.701 20 5 CHBDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000076068572 1127933478 /nfs/dbraw/zinc/93/34/78/1127933478.db2.gz GTAYCWJYTPOKQW-UKRRQHHQSA-N 1 0 294.420 3.701 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CC2(CCC2)C1 ZINC000595045779 1127940353 /nfs/dbraw/zinc/94/03/53/1127940353.db2.gz HAXFQABLUQJGTM-LLVKDONJSA-N 1 0 290.363 3.587 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCC[C@@H](C)O1 ZINC000595081090 1127950711 /nfs/dbraw/zinc/95/07/11/1127950711.db2.gz QBYARPARHYXNDQ-IPYPFGDCSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@]2(C)CC2(F)F)cccc1[N+](=O)[O-] ZINC000595080038 1127950946 /nfs/dbraw/zinc/95/09/46/1127950946.db2.gz NLMMJTWTNLOLFY-ZWNOBZJWSA-N 1 0 284.306 3.599 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@H]1CC=CCC1 ZINC000544116849 1127959550 /nfs/dbraw/zinc/95/95/50/1127959550.db2.gz KKGCFDFTKBKRJQ-ZIAGYGMSSA-N 1 0 274.364 3.944 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CC=CCC1 ZINC000540172291 1127965785 /nfs/dbraw/zinc/96/57/85/1127965785.db2.gz YDMOGPHCKUBPDF-CHWSQXEVSA-N 1 0 260.337 3.663 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccc(F)cc1 ZINC000544610885 1127978380 /nfs/dbraw/zinc/97/83/80/1127978380.db2.gz CZFDEXBFLGFWHE-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO CC[C@@]1(C)CC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000468136757 1127994749 /nfs/dbraw/zinc/99/47/49/1127994749.db2.gz AMWIOQOJAWDAGU-WFASDCNBSA-N 1 0 262.353 3.778 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CCCC1 ZINC000468634434 1128014162 /nfs/dbraw/zinc/01/41/62/1128014162.db2.gz DNMPOZSHUKZCJQ-UKTHLTGXSA-N 1 0 274.364 3.778 20 5 CHBDRO CCC[NH2+][C@@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000541548037 1128025641 /nfs/dbraw/zinc/02/56/41/1128025641.db2.gz DJESBHUOJXDFPJ-MRXNPFEDSA-N 1 0 288.347 3.839 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C1CC1)C1CCCC1 ZINC000541772434 1128038661 /nfs/dbraw/zinc/03/86/61/1128038661.db2.gz ZHWINQMERABUPV-UHFFFAOYSA-N 1 0 274.364 3.810 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000541772201 1128038727 /nfs/dbraw/zinc/03/87/27/1128038727.db2.gz VXNUWEYDFPACET-KRWDZBQOSA-N 1 0 282.343 3.850 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542001323 1128046643 /nfs/dbraw/zinc/04/66/43/1128046643.db2.gz IIRASHYJFVSQOG-SNVBAGLBSA-N 1 0 270.760 3.726 20 5 CHBDRO Cc1ccc([C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000542315455 1128062937 /nfs/dbraw/zinc/06/29/37/1128062937.db2.gz HTLJJXOBEHAVDP-KRWDZBQOSA-N 1 0 296.370 3.893 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000470178431 1128065261 /nfs/dbraw/zinc/06/52/61/1128065261.db2.gz YKNZYUDJEYOEDW-GERKINCISA-N 1 0 286.375 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccco1 ZINC000470175316 1128065303 /nfs/dbraw/zinc/06/53/03/1128065303.db2.gz PWJROLPYXWBNJE-UKTHLTGXSA-N 1 0 286.331 3.723 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC=C(F)C1 ZINC000470203430 1128066063 /nfs/dbraw/zinc/06/60/63/1128066063.db2.gz PZXRHEZBRUMHHZ-XYOKQWHBSA-N 1 0 276.311 3.557 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C3CC=CC3)o2)c1 ZINC000151973789 1128088177 /nfs/dbraw/zinc/08/81/77/1128088177.db2.gz QIDBYOGGFWXCBL-UHFFFAOYSA-N 1 0 284.315 3.663 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492558015 1128103640 /nfs/dbraw/zinc/10/36/40/1128103640.db2.gz KCGUJSNWXBZEKV-GFCCVEGCSA-N 1 0 280.368 3.614 20 5 CHBDRO CC(C)CC[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761506875 1128131887 /nfs/dbraw/zinc/13/18/87/1128131887.db2.gz OLFDQMIMQNTTAZ-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761523763 1128132587 /nfs/dbraw/zinc/13/25/87/1128132587.db2.gz XHQNPDGIKIZIOW-JQWIXIFHSA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761521066 1128132926 /nfs/dbraw/zinc/13/29/26/1128132926.db2.gz IUEUJEYMVVOZEM-GXFFZTMASA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761521074 1128133087 /nfs/dbraw/zinc/13/30/87/1128133087.db2.gz IUEUJEYMVVOZEM-ZWNOBZJWSA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)nc1 ZINC000930208264 1128307648 /nfs/dbraw/zinc/30/76/48/1128307648.db2.gz LJLNXYHFSLZNSD-WDEREUQCSA-N 1 0 289.310 3.541 20 5 CHBDRO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC1CCCCC1 ZINC000916980359 1128467227 /nfs/dbraw/zinc/46/72/27/1128467227.db2.gz KZUJCFRCEGXPAX-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000917040472 1128468409 /nfs/dbraw/zinc/46/84/09/1128468409.db2.gz QXOTVEXMRDZIHK-AWEZNQCLSA-N 1 0 296.370 3.757 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000917096887 1128481169 /nfs/dbraw/zinc/48/11/69/1128481169.db2.gz HKIPXWYTNBDCGR-IUODEOHRSA-N 1 0 276.380 3.914 20 5 CHBDRO Cc1c(C[NH2+]CC2(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000917136159 1128487358 /nfs/dbraw/zinc/48/73/58/1128487358.db2.gz KCQIGWGCDUQQQC-UHFFFAOYSA-N 1 0 296.370 3.725 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC[C@H](F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000569724132 1128608485 /nfs/dbraw/zinc/60/84/85/1128608485.db2.gz UMLXXXCMMLTEQA-DRZSPHRISA-N 1 0 266.316 3.526 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)C1CCCC1 ZINC000047965392 1128676455 /nfs/dbraw/zinc/67/64/55/1128676455.db2.gz ODEUGXOXJIMWEF-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO Cc1ccc(-c2cccc([C@@H]3CC[NH2+]C3)c2)cc1[N+](=O)[O-] ZINC000600790280 1128681942 /nfs/dbraw/zinc/68/19/42/1128681942.db2.gz IUSYPYANHMCMNK-MRXNPFEDSA-N 1 0 282.343 3.647 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2cccc(C3CC[NH2+]CC3)c2)cc1 ZINC000600790102 1128682019 /nfs/dbraw/zinc/68/20/19/1128682019.db2.gz YVSWFNZKZULQSN-UHFFFAOYSA-N 1 0 282.343 3.729 20 5 CHBDRO Cc1c(CNc2cccc(C[NH+](C)C)c2)cccc1[N+](=O)[O-] ZINC000600847275 1128683917 /nfs/dbraw/zinc/68/39/17/1128683917.db2.gz BJTOEGYDOTVBAX-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO CC(C)[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705295 1128722705 /nfs/dbraw/zinc/72/27/05/1128722705.db2.gz RUCVNQXHBJLFSO-CYBMUJFWSA-N 1 0 282.771 3.869 20 5 CHBDRO CC(C)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000609741620 1128723463 /nfs/dbraw/zinc/72/34/63/1128723463.db2.gz YTFBDQJURDZSJX-UHFFFAOYSA-N 1 0 276.361 3.681 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609766788 1128724541 /nfs/dbraw/zinc/72/45/41/1128724541.db2.gz QOJZRKRBEKCKEL-ZDUSSCGKSA-N 1 0 262.353 3.607 20 5 CHBDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610001922 1128734529 /nfs/dbraw/zinc/73/45/29/1128734529.db2.gz LZHPQYKFSHOUEW-ZFWWWQNUSA-N 1 0 276.380 3.995 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610080167 1128737731 /nfs/dbraw/zinc/73/77/31/1128737731.db2.gz LDHCNPBHPNEJJF-AWEZNQCLSA-N 1 0 292.379 3.628 20 5 CHBDRO Cc1c(C[N@H+]2Cc3ccccc3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000610216314 1117883462 /nfs/dbraw/zinc/88/34/62/1117883462.db2.gz LJMFGEIPDJZBLL-CYBMUJFWSA-N 1 0 296.370 3.850 20 5 CHBDRO COc1ccc(C[N@@H+]2CCCC(C)(C)CC2)cc1[N+](=O)[O-] ZINC000610216327 1117883809 /nfs/dbraw/zinc/88/38/09/1117883809.db2.gz NHWFQEOWGBIIPM-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO C[C@@H]1C[C@H](c2cccnc2)[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000359877455 1118007902 /nfs/dbraw/zinc/00/79/02/1118007902.db2.gz PWTGDFWOYHFRJA-CXAGYDPISA-N 1 0 297.358 3.573 20 5 CHBDRO Cc1ccccc1C1CC([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000237700042 1128752704 /nfs/dbraw/zinc/75/27/04/1128752704.db2.gz DKBKJNGSEKYPBL-UHFFFAOYSA-N 1 0 296.370 3.939 20 5 CHBDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000112676023 1118085454 /nfs/dbraw/zinc/08/54/54/1118085454.db2.gz ZRAJQXNVDKEQSQ-CVEARBPZSA-N 1 0 276.380 3.899 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)Cc2ccco2)cccc1[N+](=O)[O-] ZINC000764773447 1118112050 /nfs/dbraw/zinc/11/20/50/1118112050.db2.gz IRGBOCFARJPDAQ-AAEUAGOBSA-N 1 0 288.347 3.778 20 5 CHBDRO Cc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)CO2 ZINC000130747190 1118195025 /nfs/dbraw/zinc/19/50/25/1118195025.db2.gz QENKVXICCJCTAM-BLLLJJGKSA-N 1 0 298.342 3.688 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610080163 1118359807 /nfs/dbraw/zinc/35/98/07/1118359807.db2.gz KKNUKHAMTTWGGS-AWEZNQCLSA-N 1 0 262.353 3.749 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(C3CCCC3)CC2)cc1 ZINC000610370789 1118363148 /nfs/dbraw/zinc/36/31/48/1118363148.db2.gz IWDRVIATACXOJP-UHFFFAOYSA-N 1 0 288.391 3.997 20 5 CHBDRO CC(C)C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000307837790 1118471773 /nfs/dbraw/zinc/47/17/73/1118471773.db2.gz RRJRIHVZLSOXTN-CYBMUJFWSA-N 1 0 280.343 3.602 20 5 CHBDRO CCC[C@H](CC)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000050401461 1118490654 /nfs/dbraw/zinc/49/06/54/1118490654.db2.gz HACGQBQBGAYTHQ-NSHDSACASA-N 1 0 270.760 3.917 20 5 CHBDRO C[NH+](C)[C@@H](CNc1ccsc1[N+](=O)[O-])C1CCCCC1 ZINC000610275501 1118573269 /nfs/dbraw/zinc/57/32/69/1118573269.db2.gz WEGHOLIOMFHVMA-ZDUSSCGKSA-N 1 0 297.424 3.579 20 5 CHBDRO Cc1nc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000090888698 1118673571 /nfs/dbraw/zinc/67/35/71/1118673571.db2.gz KUAWAJKOHKENPE-VIFPVBQESA-N 1 0 291.376 3.519 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000286950730 1118678722 /nfs/dbraw/zinc/67/87/22/1118678722.db2.gz HJOMUKOSYOLTTE-DOMZBBRYSA-N 1 0 294.420 3.779 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)C[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000090918459 1118691286 /nfs/dbraw/zinc/69/12/86/1118691286.db2.gz GRTMLPHWZDPCTE-RCBQFDQVSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000178317027 1118758482 /nfs/dbraw/zinc/75/84/82/1118758482.db2.gz GLUFAYXRGBHPLQ-IAQYHMDHSA-N 1 0 274.320 3.990 20 5 CHBDRO CCC[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000610796088 1118872470 /nfs/dbraw/zinc/87/24/70/1118872470.db2.gz GSVLYKUBARXWBY-CMPLNLGQSA-N 1 0 250.342 3.742 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCCCS1)c1cccc([N+](=O)[O-])c1 ZINC000158086393 1118979529 /nfs/dbraw/zinc/97/95/29/1118979529.db2.gz SGCIIPIZCOGTIL-FZMZJTMJSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1nc([C@H](C)NCc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000050015556 1119091621 /nfs/dbraw/zinc/09/16/21/1119091621.db2.gz UMIPFUBJAAKJHL-VIFPVBQESA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1ccc([O-])cc1C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000339075744 1119092163 /nfs/dbraw/zinc/09/21/63/1119092163.db2.gz SXBQSLSVWBAAAA-KRWDZBQOSA-N 1 0 298.342 3.541 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000050343584 1119115709 /nfs/dbraw/zinc/11/57/09/1119115709.db2.gz CCLMRBXEGULJML-JTQLQIEISA-N 1 0 262.334 3.507 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 ZINC000166516133 1119259670 /nfs/dbraw/zinc/25/96/70/1119259670.db2.gz UMRPBEDQSHJEAG-MRXNPFEDSA-N 1 0 288.322 3.975 20 5 CHBDRO CC(C)[N@H+](Cc1ccco1)Cc1cccc([N+](=O)[O-])c1 ZINC000349819193 1119280685 /nfs/dbraw/zinc/28/06/85/1119280685.db2.gz OGKOSLFBVVSIQH-UHFFFAOYSA-N 1 0 274.320 3.598 20 5 CHBDRO COC1CCC([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000583552247 1119375775 /nfs/dbraw/zinc/37/57/75/1119375775.db2.gz FCAXUOJNZQTECX-OPFPJEHXSA-N 1 0 292.379 3.511 20 5 CHBDRO C[N@H+](CCCc1ccccc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000536082952 1119382241 /nfs/dbraw/zinc/38/22/41/1119382241.db2.gz AEBJTBNMUKQBDG-UHFFFAOYSA-N 1 0 298.386 3.702 20 5 CHBDRO C=C/C=C\CC[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC001207372941 1119419170 /nfs/dbraw/zinc/41/91/70/1119419170.db2.gz WMIAAJJNCBXLEN-WSNITJDQSA-N 1 0 274.364 3.638 20 5 CHBDRO C=C/C=C\CC[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC001207372942 1119419437 /nfs/dbraw/zinc/41/94/37/1119419437.db2.gz WMIAAJJNCBXLEN-ZRUQZJFASA-N 1 0 274.364 3.638 20 5 CHBDRO CS[C@@H]1CCCC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000349958252 1119435907 /nfs/dbraw/zinc/43/59/07/1119435907.db2.gz ARDJFBYENJDQQY-OAHLLOKOSA-N 1 0 294.420 3.621 20 5 CHBDRO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000179136753 1119597394 /nfs/dbraw/zinc/59/73/94/1119597394.db2.gz MGKXVVGQVSFTGD-UWVGGRQHSA-N 1 0 291.376 3.772 20 5 CHBDRO C[N@H+](CCOc1ccccc1[N+](=O)[O-])C1CCCCCC1 ZINC000603838461 1119615980 /nfs/dbraw/zinc/61/59/80/1119615980.db2.gz NSTDTXDGTBVNJB-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000310617965 1119780067 /nfs/dbraw/zinc/78/00/67/1119780067.db2.gz ASBGCCZEPDYKDL-GFCCVEGCSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CC(C)(C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000235579275 1119782064 /nfs/dbraw/zinc/78/20/64/1119782064.db2.gz SMEFNHYMGOOMAG-SMDDNHRTSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1C[C@@H](OC(C)C)C1 ZINC000580880292 1119889486 /nfs/dbraw/zinc/88/94/86/1119889486.db2.gz CVAILUUFJDCMBC-NFAWXSAZSA-N 1 0 292.379 3.510 20 5 CHBDRO C[C@H](CC1CCC1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000613515308 1119963733 /nfs/dbraw/zinc/96/37/33/1119963733.db2.gz TXNVCAXDDCSIQO-SNVBAGLBSA-N 1 0 282.771 3.917 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000310848240 1119980933 /nfs/dbraw/zinc/98/09/33/1119980933.db2.gz CQOHPZZIEPGDLQ-LBPRGKRZSA-N 1 0 268.744 3.526 20 5 CHBDRO COC1([C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000414325756 1119984657 /nfs/dbraw/zinc/98/46/57/1119984657.db2.gz XORIDAMZKSQKNS-OLZOCXBDSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCCC[C@@H]2C)c1 ZINC000094659345 1120053779 /nfs/dbraw/zinc/05/37/79/1120053779.db2.gz JOBBTRYWDNDKMB-AWEZNQCLSA-N 1 0 291.395 3.580 20 5 CHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000062726295 1120204477 /nfs/dbraw/zinc/20/44/77/1120204477.db2.gz IHJURCNXVWKUFB-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1ccc(C)cn1 ZINC000468631810 1120228295 /nfs/dbraw/zinc/22/82/95/1120228295.db2.gz MVVLNVBWIGEZJY-MDWZMJQESA-N 1 0 283.331 3.814 20 5 CHBDRO CCCCOCCC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000132025559 1120340683 /nfs/dbraw/zinc/34/06/83/1120340683.db2.gz ODKJEDMQFFIVSG-AWEZNQCLSA-N 1 0 294.395 3.761 20 5 CHBDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000313860253 1120414258 /nfs/dbraw/zinc/41/42/58/1120414258.db2.gz VVJWJCZDIMKBQO-PXAZEXFGSA-N 1 0 282.343 3.933 20 5 CHBDRO CO[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)CC(C)C ZINC000417357716 1120435748 /nfs/dbraw/zinc/43/57/48/1120435748.db2.gz HDPOLWKYINQZKW-ZIAGYGMSSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000070305651 1120530196 /nfs/dbraw/zinc/53/01/96/1120530196.db2.gz OIPPLYXMWAXAJR-NEPJUHHUSA-N 1 0 262.353 3.824 20 5 CHBDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000154931416 1120565169 /nfs/dbraw/zinc/56/51/69/1120565169.db2.gz TZWWLMOHCJUFGH-WFASDCNBSA-N 1 0 294.395 3.615 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H](OC)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000154967772 1120565798 /nfs/dbraw/zinc/56/57/98/1120565798.db2.gz KSCWBPAKGLAJJP-HUUCEWRRSA-N 1 0 294.395 3.697 20 5 CHBDRO CC(C)CCC[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000019999467 1120579355 /nfs/dbraw/zinc/57/93/55/1120579355.db2.gz BFRXECCLACEDPU-ZDUSSCGKSA-N 1 0 264.369 3.899 20 5 CHBDRO CC[C@@H]([NH2+]CC1CCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000131182167 1120650823 /nfs/dbraw/zinc/65/08/23/1120650823.db2.gz FGGQCWMNWUJIKO-OAHLLOKOSA-N 1 0 294.420 3.779 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000511857134 1120667052 /nfs/dbraw/zinc/66/70/52/1120667052.db2.gz BUTDIRLCKXFGOS-CABCVRRESA-N 1 0 274.364 3.668 20 5 CHBDRO C[C@H]1CCCCCN1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509141972 1120671773 /nfs/dbraw/zinc/67/17/73/1120671773.db2.gz VTCQGTGPXQRXTK-JTQLQIEISA-N 1 0 284.306 3.638 20 5 CHBDRO CC[C@H]([NH2+]CCNc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000303461318 1120672919 /nfs/dbraw/zinc/67/29/19/1120672919.db2.gz FYBPYDYSSHHKNM-HNNXBMFYSA-N 1 0 299.374 3.748 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NC(C1CC1)C1CC1 ZINC001168743901 1120682354 /nfs/dbraw/zinc/68/23/54/1120682354.db2.gz HTZHCBCOFRSMHV-UHFFFAOYSA-N 1 0 273.444 3.883 20 5 CHBDRO CCCC[N@H+](CC)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000216453264 1120682475 /nfs/dbraw/zinc/68/24/75/1120682475.db2.gz RQGVYZABRMWNIC-GFCCVEGCSA-N 1 0 250.342 3.778 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000227152025 1120687355 /nfs/dbraw/zinc/68/73/55/1120687355.db2.gz DCRBHKBIAOVQFO-LALPHHSUSA-N 1 0 276.380 3.818 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cs1 ZINC000111397931 1120797738 /nfs/dbraw/zinc/79/77/38/1120797738.db2.gz CNLPYIXZEVMALS-KBPBESRZSA-N 1 0 288.372 3.550 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000511911042 1120844186 /nfs/dbraw/zinc/84/41/86/1120844186.db2.gz ODMHXBHJYORKLP-GFCCVEGCSA-N 1 0 286.331 3.697 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000222029287 1120961504 /nfs/dbraw/zinc/96/15/04/1120961504.db2.gz WBFTXMDZMYINBD-AAEUAGOBSA-N 1 0 262.353 3.600 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000094325165 1121000981 /nfs/dbraw/zinc/00/09/81/1121000981.db2.gz WPAYWBQSQWNUPS-CQSZACIVSA-N 1 0 280.343 3.792 20 5 CHBDRO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CC1(C)C ZINC001174907156 1121086244 /nfs/dbraw/zinc/08/62/44/1121086244.db2.gz GTKLRMOLVZQQFD-LLVKDONJSA-N 1 0 282.771 3.726 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1)CCC2 ZINC000168924759 1121136525 /nfs/dbraw/zinc/13/65/25/1121136525.db2.gz ZTSWPHPCHVWUFW-KRWDZBQOSA-N 1 0 282.343 3.762 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000042859088 1121317947 /nfs/dbraw/zinc/31/79/47/1121317947.db2.gz QUGUZSQRSDJNOX-WFASDCNBSA-N 1 0 276.380 3.819 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1(C)CC1 ZINC000706905965 1121444938 /nfs/dbraw/zinc/44/49/38/1121444938.db2.gz RIGMMSYZFBVPTJ-SECBINFHSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000706956658 1121445950 /nfs/dbraw/zinc/44/59/50/1121445950.db2.gz MIMCLHNNHGXGKK-NWDGAFQWSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]1CC[C@H](C)[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000707145537 1121449154 /nfs/dbraw/zinc/44/91/54/1121449154.db2.gz RRSNUCFDZSZRPH-AOOOYVTPSA-N 1 0 268.744 3.621 20 5 CHBDRO CCC1(CC)CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC001175898441 1121478488 /nfs/dbraw/zinc/47/84/88/1121478488.db2.gz PGQOLTDJSUHCAQ-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO C[C@H]1CC2(CCC2)C[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000433020754 1121520275 /nfs/dbraw/zinc/52/02/75/1121520275.db2.gz DIVYSIPSQKBRST-ZBKLQPJUSA-N 1 0 286.375 3.873 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@H]1CC=CCC1 ZINC000543621600 1121529040 /nfs/dbraw/zinc/52/90/40/1121529040.db2.gz VYKDXKKYXWAPDI-AWEZNQCLSA-N 1 0 274.364 3.691 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC=CCC2)o1 ZINC000611521269 1121653955 /nfs/dbraw/zinc/65/39/55/1121653955.db2.gz ZXRDGUDTZGEADA-UHFFFAOYSA-N 1 0 284.315 3.617 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCC(C)C ZINC000611515311 1121654215 /nfs/dbraw/zinc/65/42/15/1121654215.db2.gz FVASCICPBDVYAG-CYBMUJFWSA-N 1 0 264.369 3.942 20 5 CHBDRO CC(C)=CCC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000397744839 1121694952 /nfs/dbraw/zinc/69/49/52/1121694952.db2.gz BUFBZSHVVBBXQR-CYBMUJFWSA-N 1 0 262.353 3.910 20 5 CHBDRO CCC[N@H+](CC)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000727821380 1121749599 /nfs/dbraw/zinc/74/95/99/1121749599.db2.gz YUNURILKNCNJEJ-UHFFFAOYSA-N 1 0 295.364 3.561 20 5 CHBDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000068593329 1121840543 /nfs/dbraw/zinc/84/05/43/1121840543.db2.gz SRYQQAGPSAWVSI-TZMCWYRMSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000149809469 1121843528 /nfs/dbraw/zinc/84/35/28/1121843528.db2.gz GHOMDPCLYJMDSB-CQSZACIVSA-N 1 0 276.380 3.962 20 5 CHBDRO CON(C)CC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC001179165073 1121855955 /nfs/dbraw/zinc/85/59/55/1121855955.db2.gz IIVFVXAZWWVQPT-UHFFFAOYSA-N 1 0 294.398 3.576 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCC2(c3ccccc3)CC2)c1 ZINC001179620642 1121895828 /nfs/dbraw/zinc/89/58/28/1121895828.db2.gz AOYMIQDXTZNUDO-UHFFFAOYSA-N 1 0 296.370 3.806 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000034994312 1122135922 /nfs/dbraw/zinc/13/59/22/1122135922.db2.gz JRUBGHCJUKBWMC-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO CSCC[C@@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774198452 1122139012 /nfs/dbraw/zinc/13/90/12/1122139012.db2.gz BDMRZZUVNDABCK-ABAIWWIYSA-N 1 0 294.420 3.703 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1cccn1C ZINC000183238338 1129034902 /nfs/dbraw/zinc/03/49/02/1129034902.db2.gz LTOZBYPRNYSQMG-QGZVFWFLSA-N 1 0 299.374 3.579 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]C[C@@H]1C[C@@H]1c1ccccc1 ZINC000503036161 1122163279 /nfs/dbraw/zinc/16/32/79/1122163279.db2.gz QGZDHAMZWDPDOD-DLBZAZTESA-N 1 0 296.370 3.531 20 5 CHBDRO CC(C)[C@H]1CC[C@@H]1[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC001183652523 1122232979 /nfs/dbraw/zinc/23/29/79/1122232979.db2.gz RTDHVHWBAIQMOM-BZPMIXESSA-N 1 0 262.353 3.680 20 5 CHBDRO Cc1c(OC2CC[NH+](C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC001225689864 1122276565 /nfs/dbraw/zinc/27/65/65/1122276565.db2.gz PYEABTPNQSMGFI-UHFFFAOYSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000434774855 1122410755 /nfs/dbraw/zinc/41/07/55/1122410755.db2.gz IOMXWKHOYRRFJN-SWLSCSKDSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc(C[N@H+](C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000505565880 1122419510 /nfs/dbraw/zinc/41/95/10/1122419510.db2.gz YKYDJDXMVLQXFD-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505629601 1122443152 /nfs/dbraw/zinc/44/31/52/1122443152.db2.gz BGZQURSKWCLZKL-RISCZKNCSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000437041319 1122606821 /nfs/dbraw/zinc/60/68/21/1122606821.db2.gz AGONLUBLMUHACH-UHOFOFEASA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000516558727 1122611364 /nfs/dbraw/zinc/61/13/64/1122611364.db2.gz DGGZWXNVNYJHMI-NWDGAFQWSA-N 1 0 298.333 3.941 20 5 CHBDRO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000601298376 1122623631 /nfs/dbraw/zinc/62/36/31/1122623631.db2.gz NONYPILWYBUWQD-VHSXEESVSA-N 1 0 291.376 3.772 20 5 CHBDRO CC[C@@H](C)c1ccc([C@@H]([NH2+]CC[N+](=O)[O-])C(C)C)cc1 ZINC001191961623 1122624949 /nfs/dbraw/zinc/62/49/49/1122624949.db2.gz YYFAPZZCWYCSRF-CJNGLKHVSA-N 1 0 278.396 3.764 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC=C(C)C1 ZINC000437351111 1122629554 /nfs/dbraw/zinc/62/95/54/1122629554.db2.gz YQOJDGUGSWURLR-NTEUORMPSA-N 1 0 272.348 3.650 20 5 CHBDRO Cc1ccc(C[N@H+]2C[C@@H](C)CC(C)(C)C2)cc1[N+](=O)[O-] ZINC001192502686 1122648655 /nfs/dbraw/zinc/64/86/55/1122648655.db2.gz XWTYIRFFQMSOHH-LBPRGKRZSA-N 1 0 276.380 3.771 20 5 CHBDRO CC1(C)CCCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000438350887 1122692411 /nfs/dbraw/zinc/69/24/11/1122692411.db2.gz BJGVCRILQVQUBY-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]1Cc1ccccc1 ZINC000437820740 1122705072 /nfs/dbraw/zinc/70/50/72/1122705072.db2.gz HRNAVBZAWFDAPI-ZBFHGGJFSA-N 1 0 296.370 3.973 20 5 CHBDRO CC[C@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000518581226 1122768640 /nfs/dbraw/zinc/76/86/40/1122768640.db2.gz BDGWZHZWFQKUQV-OLZOCXBDSA-N 1 0 262.353 3.778 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000518774340 1122789388 /nfs/dbraw/zinc/78/93/88/1122789388.db2.gz AMNGHMMOLBTDMI-WFASDCNBSA-N 1 0 276.380 3.996 20 5 CHBDRO CCN(Cc1occc1C)Cc1cccc([N+](=O)[O-])c1 ZINC000507132343 1122928331 /nfs/dbraw/zinc/92/83/31/1122928331.db2.gz RFCVUROAGXBQPA-UHFFFAOYSA-N 1 0 274.320 3.518 20 5 CHBDRO COc1ccc(C[N@@H+]2CCC[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000507136014 1122930515 /nfs/dbraw/zinc/93/05/15/1122930515.db2.gz WREPNHMKLZBENA-AWEZNQCLSA-N 1 0 292.379 3.614 20 5 CHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000507166140 1122932921 /nfs/dbraw/zinc/93/29/21/1122932921.db2.gz CYEXJMQMZOSDSO-CQSZACIVSA-N 1 0 262.353 3.605 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2C=CCC2)cc1[N+](=O)[O-] ZINC000850358097 1123255375 /nfs/dbraw/zinc/25/53/75/1123255375.db2.gz GTXZKMYFYFBGRD-CYBMUJFWSA-N 1 0 260.337 3.526 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H]3C=CCC3)o2)c1 ZINC000850358394 1123255903 /nfs/dbraw/zinc/25/59/03/1123255903.db2.gz CHEGZEOLVVJXBC-ZDUSSCGKSA-N 1 0 284.315 3.663 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1C=CCC1)CCCC2 ZINC000850505967 1123275985 /nfs/dbraw/zinc/27/59/85/1123275985.db2.gz ACTSBSMRVVIJKT-CZUORRHYSA-N 1 0 272.348 3.671 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC12CCCC2)c1ccccc1[N+](=O)[O-] ZINC000474042290 1123366351 /nfs/dbraw/zinc/36/63/51/1123366351.db2.gz DKINFOVNNLEIEP-DOMZBBRYSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H]1C1CC1 ZINC000858169938 1123636128 /nfs/dbraw/zinc/63/61/28/1123636128.db2.gz FNNMTQMMPOKLBV-OJXGSEEGSA-N 1 0 274.364 3.680 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)c2ccns2)cccc1[N+](=O)[O-] ZINC000858577112 1123664723 /nfs/dbraw/zinc/66/47/23/1123664723.db2.gz PCNFXMZOTXPZFV-WDEREUQCSA-N 1 0 291.376 3.772 20 5 CHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000542631652 1129139035 /nfs/dbraw/zinc/13/90/35/1129139035.db2.gz HRMJHSREPIRWOJ-CQSZACIVSA-N 1 0 262.353 3.749 20 5 CHBDRO CCC[C@H]([NH2+]CCOC1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000777117573 1123706749 /nfs/dbraw/zinc/70/67/49/1123706749.db2.gz NDDDNFNYQPOKTR-INIZCTEOSA-N 1 0 292.379 3.595 20 5 CHBDRO C/C=C\C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000862530176 1123817221 /nfs/dbraw/zinc/81/72/21/1123817221.db2.gz JWWHZLUVWOWJOB-IHWYPQMZSA-N 1 0 275.135 3.567 20 5 CHBDRO C[C@H]([NH2+]CCCCOC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000475312390 1123838198 /nfs/dbraw/zinc/83/81/98/1123838198.db2.gz XUHRRRBTEHGGCU-ZDUSSCGKSA-N 1 0 294.395 3.841 20 5 CHBDRO COc1cc(C[N@H+](C)[C@H]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000444665980 1124051414 /nfs/dbraw/zinc/05/14/14/1124051414.db2.gz QJQVGBUHZXBIHD-OCCSQVGLSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H](CCc1cccnc1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000866316120 1124052384 /nfs/dbraw/zinc/05/23/84/1124052384.db2.gz WTXWCATTYGVNIF-KGLIPLIRSA-N 1 0 299.374 3.662 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@H]1CCSC1 ZINC000866403839 1124063415 /nfs/dbraw/zinc/06/34/15/1124063415.db2.gz WTXPEEFXBQKAIK-STQMWFEESA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCCC12CC2 ZINC000866411403 1124064875 /nfs/dbraw/zinc/06/48/75/1124064875.db2.gz LCTPGOSJNGGUJH-IAQYHMDHSA-N 1 0 292.354 3.587 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000866448511 1124066169 /nfs/dbraw/zinc/06/61/69/1124066169.db2.gz HMMKWKXVSZPUHC-DDTOSNHZSA-N 1 0 266.316 3.526 20 5 CHBDRO C[C@H](CC(C)(C)C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000384792879 1124075863 /nfs/dbraw/zinc/07/58/63/1124075863.db2.gz RJRUKAQDNVEADL-LLVKDONJSA-N 1 0 250.342 3.509 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000037668334 1129165359 /nfs/dbraw/zinc/16/53/59/1129165359.db2.gz VTPCBILCUFZVRN-ZDUSSCGKSA-N 1 0 276.361 3.897 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000037668254 1129165553 /nfs/dbraw/zinc/16/55/53/1129165553.db2.gz OCHQUTRCQQTUFN-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@@H](c1cccs1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000121648858 1124111322 /nfs/dbraw/zinc/11/13/22/1124111322.db2.gz FEVBBOBANLQCBI-LBPRGKRZSA-N 1 0 290.388 3.892 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCc1cccs1 ZINC000525266917 1124120380 /nfs/dbraw/zinc/12/03/80/1124120380.db2.gz ZTDVSTMVLVSAPO-LBPRGKRZSA-N 1 0 290.388 3.892 20 5 CHBDRO CCCCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447517668 1124480003 /nfs/dbraw/zinc/48/00/03/1124480003.db2.gz LUOOOZJQFHENIX-HNNXBMFYSA-N 1 0 262.353 3.752 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447597379 1124495735 /nfs/dbraw/zinc/49/57/35/1124495735.db2.gz FGHLPYCLBCPKIJ-PVXIVEMSSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000122769295 1124533901 /nfs/dbraw/zinc/53/39/01/1124533901.db2.gz IBRNHKAFLKKMCC-RYUDHWBXSA-N 1 0 264.369 3.928 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000449165656 1124662920 /nfs/dbraw/zinc/66/29/20/1124662920.db2.gz WVORAADRIUPJCY-XJKSGUPXSA-N 1 0 299.374 3.662 20 5 CHBDRO CSCC[C@@H](C)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038754 1124663212 /nfs/dbraw/zinc/66/32/12/1124663212.db2.gz PUZDBZRNZHSLHW-ZJUUUORDSA-N 1 0 286.372 3.526 20 5 CHBDRO CSCC[C@H](C)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038753 1124663551 /nfs/dbraw/zinc/66/35/51/1124663551.db2.gz PUZDBZRNZHSLHW-VHSXEESVSA-N 1 0 286.372 3.526 20 5 CHBDRO C[C@H]([NH2+]C[C@]1(C)CCCS1)c1c(F)cccc1[N+](=O)[O-] ZINC000872042904 1124664639 /nfs/dbraw/zinc/66/46/39/1124664639.db2.gz FHJCUDDFQKDAES-HZMBPMFUSA-N 1 0 298.383 3.670 20 5 CHBDRO CSC(C)(C)C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042209 1124664649 /nfs/dbraw/zinc/66/46/49/1124664649.db2.gz ZNCUYOVTAAVRGX-SECBINFHSA-N 1 0 286.372 3.526 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCC1 ZINC000872047037 1124665039 /nfs/dbraw/zinc/66/50/39/1124665039.db2.gz OSLRPBCENIEDLH-SECBINFHSA-N 1 0 266.366 3.520 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C1CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872051799 1124666953 /nfs/dbraw/zinc/66/69/53/1124666953.db2.gz NKOMDNBLZNYDSN-NXEZZACHSA-N 1 0 266.316 3.573 20 5 CHBDRO c1cnc2c(c1)cc(C1=CCC[NH2+]CC1)c1cccnc12 ZINC001238947310 1131276001 /nfs/dbraw/zinc/27/60/01/1131276001.db2.gz NLIANNDEBLOMPQ-UHFFFAOYSA-N 1 0 275.355 3.550 20 5 CHBDRO CCSCCC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872069155 1124673615 /nfs/dbraw/zinc/67/36/15/1124673615.db2.gz LPGKAXQANCMHOG-JTQLQIEISA-N 1 0 286.372 3.528 20 5 CHBDRO C[C@@H]([NH2+]CCC1(F)CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872071320 1124674498 /nfs/dbraw/zinc/67/44/98/1124674498.db2.gz NLZXWRVWRNOITF-SNVBAGLBSA-N 1 0 284.306 3.667 20 5 CHBDRO CC(C)C1CC([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000449347452 1124695630 /nfs/dbraw/zinc/69/56/30/1124695630.db2.gz HLHVVLGOYXMCRQ-XGNXJENSSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CC2(F)F)CC1 ZINC000593078040 1124823687 /nfs/dbraw/zinc/82/36/87/1124823687.db2.gz WBYBSJXTPCQQAA-NSHDSACASA-N 1 0 296.317 3.777 20 5 CHBDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000531441448 1125219432 /nfs/dbraw/zinc/21/94/32/1125219432.db2.gz GBYIDNQVIQDRSZ-RHSMWYFYSA-N 1 0 296.370 3.973 20 5 CHBDRO Cc1cncc([C@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000879748645 1125230154 /nfs/dbraw/zinc/23/01/54/1125230154.db2.gz MLKAYRKCSURCDS-QGZVFWFLSA-N 1 0 297.358 3.635 20 5 CHBDRO CC(C)=CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000532275083 1125246793 /nfs/dbraw/zinc/24/67/93/1125246793.db2.gz DLYJTUYWQUXINE-UHFFFAOYSA-N 1 0 260.337 3.525 20 5 CHBDRO CC(C)(C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])CC(F)F ZINC000883259906 1125387022 /nfs/dbraw/zinc/38/70/22/1125387022.db2.gz DJTSKVIFDSBIPV-LBPRGKRZSA-N 1 0 298.333 3.853 20 5 CHBDRO C=C/C=C\CC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000883269149 1125389506 /nfs/dbraw/zinc/38/95/06/1125389506.db2.gz AFHQUVNLDVVSDX-WYGGZMRJSA-N 1 0 264.300 3.517 20 5 CHBDRO Cc1cc(N2CCC[C@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302187003 1125408338 /nfs/dbraw/zinc/40/83/38/1125408338.db2.gz PUSHETATCDCRQM-NSHDSACASA-N 1 0 285.347 3.688 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(C3CC3)cc2)cs1 ZINC000191680590 1125416677 /nfs/dbraw/zinc/41/66/77/1125416677.db2.gz ZLYIGCRVYHUWSA-UHFFFAOYSA-N 1 0 288.372 3.824 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC2(CCC2)C1 ZINC000123568421 1125431044 /nfs/dbraw/zinc/43/10/44/1125431044.db2.gz RAEITRLRJNBACW-GFCCVEGCSA-N 1 0 260.337 3.532 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)C(C)(C)C ZINC001646380534 1129196156 /nfs/dbraw/zinc/19/61/56/1129196156.db2.gz MPGHKELIECDKLL-UHFFFAOYSA-N 1 0 280.368 3.612 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000089551603 1129238868 /nfs/dbraw/zinc/23/88/68/1129238868.db2.gz DHORFPWWKZENPN-VHRBIJSZSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037913720 1129290803 /nfs/dbraw/zinc/29/08/03/1129290803.db2.gz RQZDQYVKSIVADF-LLVKDONJSA-N 1 0 268.744 3.623 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000735311477 1129340604 /nfs/dbraw/zinc/34/06/04/1129340604.db2.gz QRPQBFYANHBHJQ-LBPRGKRZSA-N 1 0 280.343 3.746 20 5 CHBDRO Cc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000094774410 1129451611 /nfs/dbraw/zinc/45/16/11/1129451611.db2.gz FDMSMEHLAOSOCM-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094773489 1129451760 /nfs/dbraw/zinc/45/17/60/1129451760.db2.gz LGWZARFXRGKZAC-GXTWGEPZSA-N 1 0 280.343 3.792 20 5 CHBDRO C[N@H+](CCSC(C)(C)C)CCc1ccccc1[N+](=O)[O-] ZINC000796111409 1129467400 /nfs/dbraw/zinc/46/74/00/1129467400.db2.gz FBCGGHXBCOUJSJ-UHFFFAOYSA-N 1 0 296.436 3.601 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccncc1 ZINC000742372946 1129475118 /nfs/dbraw/zinc/47/51/18/1129475118.db2.gz YVYHDSIHUKUDBB-HNNXBMFYSA-N 1 0 285.347 3.539 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]1C ZINC000252207410 1129557103 /nfs/dbraw/zinc/55/71/03/1129557103.db2.gz VJZVKMFTMJWIEU-SUNKGSAMSA-N 1 0 280.343 3.648 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168965641 1129687691 /nfs/dbraw/zinc/68/76/91/1129687691.db2.gz BODDXPOGGWBKOQ-CQDKDKBSSA-N 1 0 296.798 3.826 20 5 CHBDRO CC(C)(C)C1CCC([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168968396 1129687727 /nfs/dbraw/zinc/68/77/27/1129687727.db2.gz YRYILSXOBWFOSK-XSCHDIRWSA-N 1 0 282.428 3.626 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(Cl)c1 ZINC001168986104 1129687765 /nfs/dbraw/zinc/68/77/65/1129687765.db2.gz VWHAZHXHGDTPCC-NILFDRSVSA-N 1 0 296.798 3.826 20 5 CHBDRO CC(C)c1ccc([C@@H](C)[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001168993304 1129688297 /nfs/dbraw/zinc/68/82/97/1129688297.db2.gz MIZBOHCLZBICQW-CKEIUWERSA-N 1 0 290.407 3.906 20 5 CHBDRO CC(C)(C)[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168975221 1129688683 /nfs/dbraw/zinc/68/86/83/1129688683.db2.gz UWLXBSWVEUEXDM-NUEKZKHPSA-N 1 0 290.407 3.809 20 5 CHBDRO Cc1cccc([C@H]([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)C(C)C)c1 ZINC001169004118 1129689251 /nfs/dbraw/zinc/68/92/51/1129689251.db2.gz PZHXUIMFJWEOSV-BHYGNILZSA-N 1 0 290.407 3.727 20 5 CHBDRO CSc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169004499 1129689400 /nfs/dbraw/zinc/68/94/00/1129689400.db2.gz RCLZMMVXBUPWOT-OBJOEFQTSA-N 1 0 294.420 3.505 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C)c(C)c1 ZINC001168988572 1129690186 /nfs/dbraw/zinc/69/01/86/1129690186.db2.gz SNPJGAULMRQIEZ-HYVNUMGLSA-N 1 0 290.407 3.790 20 5 CHBDRO CC[C@@H]1CCC[C@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC001169271690 1129713661 /nfs/dbraw/zinc/71/36/61/1129713661.db2.gz OIADYTQTFQSVRA-CZUORRHYSA-N 1 0 292.379 3.532 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001169724940 1129751186 /nfs/dbraw/zinc/75/11/86/1129751186.db2.gz ZPKBHEDQNWUOMG-ZDUSSCGKSA-N 1 0 294.370 3.992 20 5 CHBDRO CNc1ccc(C)cc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000902460307 1130013409 /nfs/dbraw/zinc/01/34/09/1130013409.db2.gz GPAWPAVJYVAJNQ-ZDUSSCGKSA-N 1 0 299.374 3.796 20 5 CHBDRO CNc1ccc(C)cc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000902634392 1130033002 /nfs/dbraw/zinc/03/30/02/1130033002.db2.gz HNQRKEGNPDPLJK-UHFFFAOYSA-N 1 0 299.374 3.543 20 5 CHBDRO CSC(C)(C)C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000786814535 1130118888 /nfs/dbraw/zinc/11/88/88/1130118888.db2.gz ILVIAWRSRXRKOE-XYOKQWHBSA-N 1 0 294.420 3.729 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1cscn1)c1ccccc1[N+](=O)[O-] ZINC000903246866 1130136036 /nfs/dbraw/zinc/13/60/36/1130136036.db2.gz XWXCYUWSYNWMAO-WDEREUQCSA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccoc1 ZINC000903247099 1130136398 /nfs/dbraw/zinc/13/63/98/1130136398.db2.gz YPGMXIPHHMYRSM-VXGBXAGGSA-N 1 0 274.320 3.642 20 5 CHBDRO CCO[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000903286582 1130146933 /nfs/dbraw/zinc/14/69/33/1130146933.db2.gz BLSLTKNGWPRANH-XNRPHZJLSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC[C@H](C)SC1)c1ccc([N+](=O)[O-])cc1 ZINC000903288594 1130146972 /nfs/dbraw/zinc/14/69/72/1130146972.db2.gz ZYBHVGFZJPDFSV-LOWVWBTDSA-N 1 0 280.393 3.530 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000748819383 1130248047 /nfs/dbraw/zinc/24/80/47/1130248047.db2.gz GWGWKKYYXNZXQZ-LBPRGKRZSA-N 1 0 276.380 3.996 20 5 CHBDRO c1ccc2c(c1)nc(C1=CC[NH2+]CC1)c1ccccc21 ZINC001240465406 1130320766 /nfs/dbraw/zinc/32/07/66/1130320766.db2.gz XUXGAWHEPHKRAF-UHFFFAOYSA-N 1 0 260.340 3.765 20 5 CHBDRO CC(C)([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000103483262 1130460034 /nfs/dbraw/zinc/46/00/34/1130460034.db2.gz BHQOPBNDQVRCSV-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)C(C)(C)C)c([N+](=O)[O-])c1 ZINC001170297372 1130476289 /nfs/dbraw/zinc/47/62/89/1130476289.db2.gz NGMBGCGDLNGOEJ-NEPJUHHUSA-N 1 0 294.395 3.559 20 5 CHBDRO CCCCC[N@H+](C)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329378 1130482965 /nfs/dbraw/zinc/48/29/65/1130482965.db2.gz PTONHCVJVONXCM-CYBMUJFWSA-N 1 0 294.395 3.656 20 5 CHBDRO C(c1cnc2c(ccc3cccnc32)c1)=C1CC[NH2+]CC1 ZINC001240877946 1130499513 /nfs/dbraw/zinc/49/95/13/1130499513.db2.gz ARPYONNWMAZVSH-UHFFFAOYSA-N 1 0 275.355 3.550 20 5 CHBDRO Cc1ccc(Cl)c(O[C@H](C)C[N+](C)(C)C)c1Cl ZINC001234302733 1130633788 /nfs/dbraw/zinc/63/37/88/1130633788.db2.gz LUAZWVGZPWZYLO-SNVBAGLBSA-N 1 0 277.215 3.775 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000694469816 1130787576 /nfs/dbraw/zinc/78/75/76/1130787576.db2.gz REKYYNHICJYGLS-ZDUSSCGKSA-N 1 0 280.343 3.602 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(C3CC3)CC2)cc1Cl ZINC000814172543 1130833392 /nfs/dbraw/zinc/83/33/92/1130833392.db2.gz RRIRKWJILVOOLQ-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO CC[C@H](C)C[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783534586 1130835051 /nfs/dbraw/zinc/83/50/51/1130835051.db2.gz XDNFDMPENFPNFA-JTQLQIEISA-N 1 0 270.760 3.726 20 5 CHBDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783527034 1130835483 /nfs/dbraw/zinc/83/54/83/1130835483.db2.gz UNTQRXNKDRFKIO-ZDUSSCGKSA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783710660 1130851361 /nfs/dbraw/zinc/85/13/61/1130851361.db2.gz SFLOSLNAQRBXTR-ONGXEEELSA-N 1 0 268.744 3.526 20 5 CHBDRO CC1(C)CC(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783716461 1130851488 /nfs/dbraw/zinc/85/14/88/1130851488.db2.gz ADPCPFAADAIPLA-UHFFFAOYSA-N 1 0 282.771 3.774 20 5 CHBDRO CC(C)(C)[C@H]1CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000784515367 1130907589 /nfs/dbraw/zinc/90/75/89/1130907589.db2.gz IXYWBDZUENTPON-LBPRGKRZSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@@H]1C[C@H](C(C)(C)C)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001170785343 1130990156 /nfs/dbraw/zinc/99/01/56/1130990156.db2.gz ZVTRRTXLPCCJTE-TZMCWYRMSA-N 1 0 291.395 3.636 20 5 CHBDRO C[C@@H]([NH2+]C1CCCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815553403 1130998431 /nfs/dbraw/zinc/99/84/31/1130998431.db2.gz ZCUHOTIXZVQKRV-LLVKDONJSA-N 1 0 277.368 3.550 20 5 CHBDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000815591031 1131004647 /nfs/dbraw/zinc/00/46/47/1131004647.db2.gz SXZDNTXFXWDREZ-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000816646317 1131117726 /nfs/dbraw/zinc/11/77/26/1131117726.db2.gz BTWORNNSSHVNIU-NEPJUHHUSA-N 1 0 286.331 3.695 20 5 CHBDRO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000816648857 1131120819 /nfs/dbraw/zinc/12/08/19/1131120819.db2.gz QCEQSVUZROAMKV-NWDGAFQWSA-N 1 0 286.331 3.695 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000816648858 1131121034 /nfs/dbraw/zinc/12/10/34/1131121034.db2.gz QCEQSVUZROAMKV-RYUDHWBXSA-N 1 0 286.331 3.695 20 5 CHBDRO CCC[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C1CCC1 ZINC001171037237 1131448863 /nfs/dbraw/zinc/44/88/63/1131448863.db2.gz XXXSYVQVPHNKRY-AWEZNQCLSA-N 1 0 292.379 3.532 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000824462634 1131471159 /nfs/dbraw/zinc/47/11/59/1131471159.db2.gz HYGWSOSUOXUPCS-BLLLJJGKSA-N 1 0 297.358 3.718 20 5 CHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C/C=C/Cl)C2)cc1 ZINC000831534529 1131489746 /nfs/dbraw/zinc/48/97/46/1131489746.db2.gz PCRWKCZFSMNRGS-IADWALHJSA-N 1 0 280.755 3.527 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437064 1131563374 /nfs/dbraw/zinc/56/33/74/1131563374.db2.gz SCJROEOKMWIUEV-BXUZGUMPSA-N 1 0 296.317 3.777 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844436103 1131563875 /nfs/dbraw/zinc/56/38/75/1131563875.db2.gz GQIKIGALNHFCQW-RISCZKNCSA-N 1 0 296.317 3.777 20 5 CHBDRO Cc1ccc(C(C)C)c(O[C@H](C)C[N+](C)(C)C)c1 ZINC001227944698 1131773512 /nfs/dbraw/zinc/77/35/12/1131773512.db2.gz FTKFWEPXIVIART-CQSZACIVSA-N 1 0 250.406 3.592 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc2ccccc2c1Cl ZINC001228254975 1131840820 /nfs/dbraw/zinc/84/08/20/1131840820.db2.gz CJLCAURKYDBAOS-LBPRGKRZSA-N 1 0 278.803 3.967 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CCC2CCC2)cc1[N+](=O)[O-] ZINC000773037404 1131925547 /nfs/dbraw/zinc/92/55/47/1131925547.db2.gz UYLQHBQLYYINFT-GFCCVEGCSA-N 1 0 292.379 3.834 20 5 CHBDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000773123163 1131952305 /nfs/dbraw/zinc/95/23/05/1131952305.db2.gz ZUCCJQZDRVTQPG-SFHVURJKSA-N 1 0 296.370 3.723 20 5 CHBDRO CCCCCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000037177115 1132006840 /nfs/dbraw/zinc/00/68/40/1132006840.db2.gz PMOPUULWSIOMML-LBPRGKRZSA-N 1 0 250.342 3.826 20 5 CHBDRO Cc1ccc(OC2CC[NH+](C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC001230145872 1132156650 /nfs/dbraw/zinc/15/66/50/1132156650.db2.gz JEBRQWZPOMHUIK-UHFFFAOYSA-N 1 0 292.379 3.545 20 5 CHBDRO CCC(CC)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899443 1132347579 /nfs/dbraw/zinc/34/75/79/1132347579.db2.gz XYQZVGKPQUSAJE-OAHLLOKOSA-N 1 0 276.380 3.620 20 5 CHBDRO CC[N@H+](C(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907667 1132350844 /nfs/dbraw/zinc/35/08/44/1132350844.db2.gz HJYJRKQRVLEAOK-HNNXBMFYSA-N 1 0 276.380 3.573 20 5 CHBDRO CCCCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895478 1132359535 /nfs/dbraw/zinc/35/95/35/1132359535.db2.gz FEILTAWXKLGJMS-HNNXBMFYSA-N 1 0 276.380 3.622 20 5 CHBDRO C[N@H+](C1CCCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916350 1132359721 /nfs/dbraw/zinc/35/97/21/1132359721.db2.gz RGJARIRCNMCYIG-MRXNPFEDSA-N 1 0 288.391 3.717 20 5 CHBDRO Cc1ccc(CC[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173216794 1132411369 /nfs/dbraw/zinc/41/13/69/1132411369.db2.gz MZOCMNNVUWNEPG-OAHLLOKOSA-N 1 0 298.386 3.667 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC[C@@H]1C ZINC001173227367 1132412801 /nfs/dbraw/zinc/41/28/01/1132412801.db2.gz QGMDUPPVNQFLSF-KBPBESRZSA-N 1 0 276.380 3.790 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1cccs1 ZINC001173225912 1132412821 /nfs/dbraw/zinc/41/28/21/1132412821.db2.gz GRHPBRPBTCKDCS-GFCCVEGCSA-N 1 0 290.388 3.719 20 5 CHBDRO CCC(CC)[N@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233997 1132414065 /nfs/dbraw/zinc/41/40/65/1132414065.db2.gz NTHYSCWDRDCIIV-LBPRGKRZSA-N 1 0 264.369 3.646 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173235411 1132415657 /nfs/dbraw/zinc/41/56/57/1132415657.db2.gz WSAJJNBAMKFIAF-UKRRQHHQSA-N 1 0 276.380 3.790 20 5 CHBDRO Cc1ccc(C)c(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173214156 1132416185 /nfs/dbraw/zinc/41/61/85/1132416185.db2.gz MLALRDIWZIIIJG-OAHLLOKOSA-N 1 0 298.386 3.932 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1CCCCC1 ZINC001173213068 1132416409 /nfs/dbraw/zinc/41/64/09/1132416409.db2.gz DKOOAJAYBGEMNX-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC001173211340 1132416470 /nfs/dbraw/zinc/41/64/70/1132416470.db2.gz ROIFNQRHROMOBZ-OAHLLOKOSA-N 1 0 298.386 3.932 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCCC[C@H]1C ZINC001173211114 1132416601 /nfs/dbraw/zinc/41/66/01/1132416601.db2.gz PKPULPWHKKWTQA-IIAWOOMASA-N 1 0 290.407 3.942 20 5 CHBDRO Nc1c2ccccc2c2ccccc2c1NC1=CCC[NH2+]C1 ZINC001159756018 1132903637 /nfs/dbraw/zinc/90/36/37/1132903637.db2.gz VWUONVNNVJKVQW-UHFFFAOYSA-N 1 0 289.382 3.864 20 5 CHBDRO CC(C)(C)c1ccc(N[C@@H]2CCC[C@@H]([NH3+])C2)c([N+](=O)[O-])c1 ZINC001162400300 1133075532 /nfs/dbraw/zinc/07/55/32/1133075532.db2.gz GVLAYHNEEKUXQS-CHWSQXEVSA-N 1 0 291.395 3.574 20 5 CHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1NC(=[NH2+])C(C)(C)C ZINC001162661241 1133102078 /nfs/dbraw/zinc/10/20/78/1133102078.db2.gz SCJZYMSSKJFACQ-UHFFFAOYSA-N 1 0 263.341 3.955 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCc1ccncc1C ZINC001162721974 1133105888 /nfs/dbraw/zinc/10/58/88/1133105888.db2.gz MHEKLTWPWYMYMK-UHFFFAOYSA-N 1 0 284.427 3.598 20 5 CHBDRO CC(C)[NH+]1CCC(CCNc2ccsc2[N+](=O)[O-])CC1 ZINC001163830983 1133178176 /nfs/dbraw/zinc/17/81/76/1133178176.db2.gz GOAXQVFMOZBGSW-UHFFFAOYSA-N 1 0 297.424 3.579 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCCCc1ccncc1 ZINC001165534152 1133244015 /nfs/dbraw/zinc/24/40/15/1133244015.db2.gz HAONVLBJAYWVRK-UHFFFAOYSA-N 1 0 298.454 3.723 20 5 CHBDRO Nc1ccc2cc3ccc(Nc4cnoc4)cc3[nH+]c2c1 ZINC001203242694 1133307805 /nfs/dbraw/zinc/30/78/05/1133307805.db2.gz XOXBJNGDUJXOAZ-UHFFFAOYSA-N 1 0 276.299 3.702 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCC2CCC(F)(F)CC2)c1 ZINC001204002239 1133397315 /nfs/dbraw/zinc/39/73/15/1133397315.db2.gz JSYOLZOBHLVHNP-UHFFFAOYSA-N 1 0 298.333 3.900 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC001204929789 1133502350 /nfs/dbraw/zinc/50/23/50/1133502350.db2.gz CUTAACUAORGMKN-QGZVFWFLSA-N 1 0 299.374 3.877 20 5 CHBDRO CC1CCC(C)(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001205642661 1133598501 /nfs/dbraw/zinc/59/85/01/1133598501.db2.gz MKJMTANDGRVXBR-UHFFFAOYSA-N 1 0 290.407 3.943 20 5 CHBDRO CC1(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001205883427 1133627434 /nfs/dbraw/zinc/62/74/34/1133627434.db2.gz VASOJOXWFJTFRE-CQSZACIVSA-N 1 0 274.364 3.574 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC001206248152 1133675741 /nfs/dbraw/zinc/67/57/41/1133675741.db2.gz RTONEEKDSLYHOS-CVEARBPZSA-N 1 0 290.407 3.942 20 5 CHBDRO C[NH+](C)Cc1cccc(Nc2ccc(F)cc2[N+](=O)[O-])c1 ZINC001210955909 1134339417 /nfs/dbraw/zinc/33/94/17/1134339417.db2.gz OPUJLBKMVPCLFF-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO Cc1ccc(Nc2cccc(C[NH+](C)C)c2)c([N+](=O)[O-])c1 ZINC001214172059 1134516425 /nfs/dbraw/zinc/51/64/25/1134516425.db2.gz QYJPBFBIENJXFM-UHFFFAOYSA-N 1 0 285.347 3.708 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)c(Cl)c1 ZINC000403393126 1134770828 /nfs/dbraw/zinc/77/08/28/1134770828.db2.gz SKOQYINNWAPDQJ-NTZNESFSSA-N 1 0 294.782 3.774 20 5 CHBDRO O=[N+]([O-])c1cc(F)cc(Nc2cc[nH+]c(C3CC3)c2)c1 ZINC001216481741 1134904457 /nfs/dbraw/zinc/90/44/57/1134904457.db2.gz AQQFHRWBUWZKGQ-UHFFFAOYSA-N 1 0 273.267 3.750 20 5 CHBDRO C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000308696478 1134977602 /nfs/dbraw/zinc/97/76/02/1134977602.db2.gz FNBDKCIQEADODL-DOMZBBRYSA-N 1 0 262.353 3.653 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@H]3CCC[NH2+]CC3)cc2c1 ZINC001217995659 1135039214 /nfs/dbraw/zinc/03/92/14/1135039214.db2.gz RGDLEILIQCNNMD-INIZCTEOSA-N 1 0 292.382 3.909 20 5 CHBDRO Cc1cc(C)c2ccc3cccc(O[C@@H]4CC[NH2+]C4)c3c2n1 ZINC001218035785 1135047910 /nfs/dbraw/zinc/04/79/10/1135047910.db2.gz GSLCTPCDLGRICL-OAHLLOKOSA-N 1 0 292.382 3.746 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@@H]1C[C@H]2C[C@@H]1C[NH2+]2 ZINC001218113045 1135060367 /nfs/dbraw/zinc/06/03/67/1135060367.db2.gz YOOMRGFIRNZBIA-HBUWYVDXSA-N 1 0 290.366 3.517 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@H]3CCC[NH2+]C3)c12 ZINC001218282759 1135078693 /nfs/dbraw/zinc/07/86/93/1135078693.db2.gz BSAVFJZOWYSWLH-HNNXBMFYSA-N 1 0 278.355 3.519 20 5 CHBDRO Oc1c2ccccc2c(O[C@@H]2C=CC[NH2+]C2)c2ccccc12 ZINC001218334979 1135089585 /nfs/dbraw/zinc/08/95/85/1135089585.db2.gz SGEYBRYANWBWGN-CYBMUJFWSA-N 1 0 291.350 3.605 20 5 CHBDRO C[C@H]1CC[C@@H](Oc2nccc3c4ccccc4ccc32)C[NH2+]1 ZINC001218404035 1135100035 /nfs/dbraw/zinc/10/00/35/1135100035.db2.gz YYTLOUYFSPIQTR-DZGCQCFKSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@@H]1C[NH2+]CC[C@H]1Oc1nc2ccccc2c2ccccc21 ZINC001218419253 1135102251 /nfs/dbraw/zinc/10/22/51/1135102251.db2.gz LNTUTKQIDWYWGJ-FZKQIMNGSA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@@H]1C[NH2+]CC[C@@H]1Oc1nccc2c3ccccc3ccc21 ZINC001218426417 1135103292 /nfs/dbraw/zinc/10/32/92/1135103292.db2.gz WVXHKJMJDRWARB-ACJLOTCBSA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@H]1C[NH2+]CC[C@H]1Oc1nccc2c3ccccc3ccc21 ZINC001218426421 1135103442 /nfs/dbraw/zinc/10/34/42/1135103442.db2.gz WVXHKJMJDRWARB-SCLBCKFNSA-N 1 0 292.382 3.765 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@@H]3[C@@H]4CC[C@H]3[NH2+]C4)cc2c1 ZINC001218443810 1135106606 /nfs/dbraw/zinc/10/66/06/1135106606.db2.gz DVVWGRNYTQOYRD-IDHHARJASA-N 1 0 290.366 3.517 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@@H]1[C@@H]2CC[C@H]1[NH2+]C2 ZINC001218443946 1135107260 /nfs/dbraw/zinc/10/72/60/1135107260.db2.gz CZPGYIKVYCAEMZ-FSPWUOQZSA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCc1ccccc1Cc1ccccc1 ZINC001223165775 1135312271 /nfs/dbraw/zinc/31/22/71/1135312271.db2.gz VWYCFLRVWKWMOK-KRWDZBQOSA-N 1 0 298.450 3.889 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H](OCCC[N+](C)(C)C)CC1 ZINC001224622531 1135462749 /nfs/dbraw/zinc/46/27/49/1135462749.db2.gz HVBIZGQYWCQRBZ-GASCZTMLSA-N 1 0 256.454 3.704 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCCCCC1CCCCC1 ZINC001224766172 1135479623 /nfs/dbraw/zinc/47/96/23/1135479623.db2.gz DLVRDJNYUPJZRW-OAHLLOKOSA-N 1 0 256.454 3.848 20 5 CHBDRO CCC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000322342675 1135674714 /nfs/dbraw/zinc/67/47/14/1135674714.db2.gz COHSFUNJTRVHJZ-HNNXBMFYSA-N 1 0 276.380 3.962 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc(Cc2ccccc2)c1 ZINC001226873672 1135753024 /nfs/dbraw/zinc/75/30/24/1135753024.db2.gz ONRROGMNEVBUON-INIZCTEOSA-N 1 0 284.423 3.751 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc(CCc2ccccc2)c1 ZINC001226930355 1135762877 /nfs/dbraw/zinc/76/28/77/1135762877.db2.gz SUEBIOHUHHJZDR-QGZVFWFLSA-N 1 0 298.450 3.945 20 5 CHBDRO CCCCc1ccc(O[C@@H](C)C[N+](C)(C)C)cc1 ZINC001227621883 1135851581 /nfs/dbraw/zinc/85/15/81/1135851581.db2.gz GOTYJHALTAEQAL-AWEZNQCLSA-N 1 0 250.406 3.503 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000020123924 171005408 /nfs/dbraw/zinc/00/54/08/171005408.db2.gz YBTGRIZLUOSPLI-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000020522588 171235723 /nfs/dbraw/zinc/23/57/23/171235723.db2.gz JGLKRVQAMWBLOI-NWDGAFQWSA-N 1 0 250.342 3.598 20 5 CHBDRO CCCCC[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000035135652 172002760 /nfs/dbraw/zinc/00/27/60/172002760.db2.gz RAVYYVPKWGRJQC-LBPRGKRZSA-N 1 0 250.342 3.653 20 5 CHBDRO C[C@@H]([NH2+]CCC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000037739568 173660108 /nfs/dbraw/zinc/66/01/08/173660108.db2.gz FFTUNRZKVLIUIY-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000042553164 174791496 /nfs/dbraw/zinc/79/14/96/174791496.db2.gz ZLBDWOJQOKPNKC-SRVKXCTJSA-N 1 0 250.342 3.680 20 5 CHBDRO Cc1c(C[NH2+][C@H](c2cccnc2)C2CC2)cccc1[N+](=O)[O-] ZINC000347356211 226149807 /nfs/dbraw/zinc/14/98/07/226149807.db2.gz IFVSDPWBKYAQGH-KRWDZBQOSA-N 1 0 297.358 3.539 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC=CCC1)CCC2 ZINC000193001806 227419674 /nfs/dbraw/zinc/41/96/74/227419674.db2.gz QTMGCCBTYAMDRH-CJNGLKHVSA-N 1 0 272.348 3.671 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C[C@H]3CC34CC4)o2)c1 ZINC000418101869 228042738 /nfs/dbraw/zinc/04/27/38/228042738.db2.gz UCSDZXOVGZXMKT-CYBMUJFWSA-N 1 0 298.342 3.745 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000037177083 260072594 /nfs/dbraw/zinc/07/25/94/260072594.db2.gz XILDLRVBJSVJET-SJCJKPOMSA-N 1 0 282.343 3.933 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)CC2CC2)cc1[N+](=O)[O-] ZINC000070101182 260152162 /nfs/dbraw/zinc/15/21/62/260152162.db2.gz UKNMPRLXFFRCMP-VXGBXAGGSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000426766152 260213756 /nfs/dbraw/zinc/21/37/56/260213756.db2.gz XGDXLKBVGJBSCW-BPLDGKMQSA-N 1 0 274.364 3.778 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426766154 260213764 /nfs/dbraw/zinc/21/37/64/260213764.db2.gz XGDXLKBVGJBSCW-YUELXQCFSA-N 1 0 274.364 3.778 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC2CCC1CC2)c1ccccc1[N+](=O)[O-] ZINC000312896523 260219666 /nfs/dbraw/zinc/21/96/66/260219666.db2.gz XRPHIOVZYSILBD-LFUGVXIPSA-N 1 0 274.364 3.824 20 5 CHBDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C1 ZINC000085064656 260370423 /nfs/dbraw/zinc/37/04/23/260370423.db2.gz KJUKOJUBVQURJW-CMPLNLGQSA-N 1 0 268.382 3.715 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000132456949 260499850 /nfs/dbraw/zinc/49/98/50/260499850.db2.gz QHSWJXQQUZSBAO-UKRRQHHQSA-N 1 0 294.420 3.921 20 5 CHBDRO CC(C)([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000179564189 261796960 /nfs/dbraw/zinc/79/69/60/261796960.db2.gz TWAPVRULFZOSHR-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCC2(F)F)cc1[N+](=O)[O-] ZINC000390592730 262224958 /nfs/dbraw/zinc/22/49/58/262224958.db2.gz SHAOQLGKSXTBGS-AAEUAGOBSA-N 1 0 298.333 3.989 20 5 CHBDRO C[C@H](CCc1ccccc1)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000020138549 262231248 /nfs/dbraw/zinc/23/12/48/262231248.db2.gz ADAWFOIBVUPAQE-CQSZACIVSA-N 1 0 284.359 3.706 20 5 CHBDRO Cc1ccoc1CNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000319779332 262361812 /nfs/dbraw/zinc/36/18/12/262361812.db2.gz ZPVTWCVZRUVVCP-UHFFFAOYSA-N 1 0 297.314 3.965 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1CNc1ccc([C@H](C)[NH3+])cc1 ZINC000414816820 263054245 /nfs/dbraw/zinc/05/42/45/263054245.db2.gz YBDAUUHJDJIGER-LBPRGKRZSA-N 1 0 285.347 3.535 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000514095298 263273812 /nfs/dbraw/zinc/27/38/12/263273812.db2.gz QNKRIMVWEPTIOA-AWEZNQCLSA-N 1 0 262.353 3.605 20 5 CHBDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC(C)C ZINC000417358517 263800151 /nfs/dbraw/zinc/80/01/51/263800151.db2.gz HZHZXVWWNNAWOE-HIFRSBDPSA-N 1 0 294.395 3.615 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000054467629 264338871 /nfs/dbraw/zinc/33/88/71/264338871.db2.gz CRSRAHNNLCUZPG-PWSUYJOCSA-N 1 0 250.342 3.600 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000054467633 264338928 /nfs/dbraw/zinc/33/89/28/264338928.db2.gz CRSRAHNNLCUZPG-ZYHUDNBSSA-N 1 0 250.342 3.600 20 5 CHBDRO C[NH+](C)[C@@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000301519119 265982182 /nfs/dbraw/zinc/98/21/82/265982182.db2.gz HEDNKWHLYPBCCO-GHMZBOCLSA-N 1 0 297.786 3.533 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000361922466 266904441 /nfs/dbraw/zinc/90/44/41/266904441.db2.gz IXTUJTIYGDQQOK-WBMJQRKESA-N 1 0 288.347 3.860 20 5 CHBDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000483720192 267300528 /nfs/dbraw/zinc/30/05/28/267300528.db2.gz FMTDOJASACFNIR-UHOFOFEASA-N 1 0 292.379 3.511 20 5 CHBDRO CSCCCNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000228485309 327921037 /nfs/dbraw/zinc/92/10/37/327921037.db2.gz QRNZXSUYYCYDAM-UHFFFAOYSA-N 1 0 291.376 3.616 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCCC23CCC3)cccc1[N+](=O)[O-] ZINC000394811386 328011169 /nfs/dbraw/zinc/01/11/69/328011169.db2.gz KPMONIPADYBAAE-HNNXBMFYSA-N 1 0 274.364 3.716 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC(C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000531732277 328030597 /nfs/dbraw/zinc/03/05/97/328030597.db2.gz XZKAKWPOZVNQQU-LBPRGKRZSA-N 1 0 288.391 3.990 20 5 CHBDRO C[C@@H]([N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000534349903 328047592 /nfs/dbraw/zinc/04/75/92/328047592.db2.gz AWADKSQPNUSLEK-AORWBKJGSA-N 1 0 276.380 3.974 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccncc1 ZINC000563419479 328063581 /nfs/dbraw/zinc/06/35/81/328063581.db2.gz WRAZVCBAYIDEKZ-HOTGVXAUSA-N 1 0 297.358 3.718 20 5 CHBDRO CC1=CC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000571153279 328088749 /nfs/dbraw/zinc/08/87/49/328088749.db2.gz APMAJNRZDAQJKL-GXTWGEPZSA-N 1 0 260.337 3.744 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCOCCC(C)C ZINC000531963043 328348414 /nfs/dbraw/zinc/34/84/14/328348414.db2.gz XUTQSGDWOMAZML-AWEZNQCLSA-N 1 0 294.395 3.617 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2cccs2)C2CC2)cc1 ZINC000049956672 328379682 /nfs/dbraw/zinc/37/96/82/328379682.db2.gz SMYFIJDWOGFGSJ-OAHLLOKOSA-N 1 0 288.372 3.897 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(C1CC1)C1CC1 ZINC000531988024 328381633 /nfs/dbraw/zinc/38/16/33/328381633.db2.gz CGEJKABIVHEYTQ-LBPRGKRZSA-N 1 0 288.391 3.990 20 5 CHBDRO CC(C)[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC1CC1 ZINC000535073355 328384449 /nfs/dbraw/zinc/38/44/49/328384449.db2.gz GDRIYHQHFDXRPD-FNORWQNLSA-N 1 0 274.364 3.728 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000222134276 328401853 /nfs/dbraw/zinc/40/18/53/328401853.db2.gz ABDJWBOIZOIYLX-JSGCOSHPSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000050443201 328439822 /nfs/dbraw/zinc/43/98/22/328439822.db2.gz KFVSEKAVZDWXKS-GXFFZTMASA-N 1 0 282.771 3.917 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000035257015 326815624 /nfs/dbraw/zinc/81/56/24/326815624.db2.gz UZULXCZYUDWGHN-HIFRSBDPSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000037775522 326861491 /nfs/dbraw/zinc/86/14/91/326861491.db2.gz FDSYAVUDGYMTSE-JTQLQIEISA-N 1 0 292.285 3.724 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC2CCC1CC2)c1cccc([N+](=O)[O-])c1 ZINC000312781646 326968456 /nfs/dbraw/zinc/96/84/56/326968456.db2.gz HTGWHZFUCRAMKF-NEQJSVFRSA-N 1 0 274.364 3.824 20 5 CHBDRO CCC[NH+](CCC)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000557036264 326990356 /nfs/dbraw/zinc/99/03/56/326990356.db2.gz JWGJHZGLZNOHJK-GFCCVEGCSA-N 1 0 250.342 3.778 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000255733288 327011116 /nfs/dbraw/zinc/01/11/16/327011116.db2.gz OIFHKGFXDZASNC-XQRVVYSFSA-N 1 0 286.375 3.728 20 5 CHBDRO C[C@H]1CCC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000088195116 327130312 /nfs/dbraw/zinc/13/03/12/327130312.db2.gz LTJLEDDJBLEDTJ-GXTWGEPZSA-N 1 0 262.353 3.511 20 5 CHBDRO C[C@@H]1C[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000583432954 327361694 /nfs/dbraw/zinc/36/16/94/327361694.db2.gz IXBYXEJCCDWZRB-ACJLOTCBSA-N 1 0 296.370 3.975 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1OCCC[NH+]1CCCCC1 ZINC000561716712 327412832 /nfs/dbraw/zinc/41/28/32/327412832.db2.gz SJJYJKLOWZWGGT-UHFFFAOYSA-N 1 0 298.770 3.503 20 5 CHBDRO CC1(C)C[C@@H]([NH2+][C@H]2C[C@@H]2C(F)F)c2cc([N+](=O)[O-])ccc21 ZINC000562056565 327444926 /nfs/dbraw/zinc/44/49/26/327444926.db2.gz AGOXUZMOTXOUNN-WCFLWFBJSA-N 1 0 296.317 3.560 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1F ZINC000562735914 327510493 /nfs/dbraw/zinc/51/04/93/327510493.db2.gz SKDURVODLYQDLR-NILFDRSVSA-N 1 0 280.343 3.835 20 5 CHBDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000570041911 327565104 /nfs/dbraw/zinc/56/51/04/327565104.db2.gz PECVSYVWXHTLOJ-LLVKDONJSA-N 1 0 280.368 3.518 20 5 CHBDRO COc1ccc(C[NH2+]C(C)(C)CC(C)(C)C)cc1[N+](=O)[O-] ZINC000042254748 328763277 /nfs/dbraw/zinc/76/32/77/328763277.db2.gz RIQFVNSTTAEHJL-UHFFFAOYSA-N 1 0 294.395 3.908 20 5 CHBDRO C[C@H]1CCCC[C@@H]1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000042861623 328771558 /nfs/dbraw/zinc/77/15/58/328771558.db2.gz JEMHWUYXRLTGOL-DZGCQCFKSA-N 1 0 276.380 3.553 20 5 CHBDRO CC1(C)CC[C@@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000507789553 332823585 /nfs/dbraw/zinc/82/35/85/332823585.db2.gz UFALBXRDVDLUMR-BRLPQQTGSA-N 1 0 274.364 3.776 20 5 CHBDRO CC[C@@H](C)C[N@H+](CC)Cc1csc([N+](=O)[O-])c1 ZINC000177858147 329193185 /nfs/dbraw/zinc/19/31/85/329193185.db2.gz PGLNEPSJQFKWAE-SNVBAGLBSA-N 1 0 256.371 3.524 20 5 CHBDRO CC[C@@H]([NH2+][C@H](CC)[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000181743277 329236231 /nfs/dbraw/zinc/23/62/31/329236231.db2.gz JSHPTOIXFZQDJX-OAGGEKHMSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000227309578 329272036 /nfs/dbraw/zinc/27/20/36/329272036.db2.gz OOEQGYJVOSITPQ-PWSUYJOCSA-N 1 0 268.382 3.715 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCSCC(C)C)cc1[N+](=O)[O-] ZINC000397344109 329350830 /nfs/dbraw/zinc/35/08/30/329350830.db2.gz XDJRRHQMDCHLCT-ZDUSSCGKSA-N 1 0 296.436 3.943 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000222134168 329943111 /nfs/dbraw/zinc/94/31/11/329943111.db2.gz ABDJWBOIZOIYLX-OCCSQVGLSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC1(F)CCC1 ZINC000580480009 330146847 /nfs/dbraw/zinc/14/68/47/330146847.db2.gz NNTOHZABVADLAU-CYBMUJFWSA-N 1 0 294.370 3.788 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000396960220 330232186 /nfs/dbraw/zinc/23/21/86/330232186.db2.gz ZBFRCUJBSYEVJV-VHSXEESVSA-N 1 0 290.285 3.834 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(C(C)C)CC1 ZINC000536838409 330232988 /nfs/dbraw/zinc/23/29/88/330232988.db2.gz IHBVCKRWUUZWKF-ZDUSSCGKSA-N 1 0 276.380 3.990 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CC1(C)C ZINC000536866043 330251524 /nfs/dbraw/zinc/25/15/24/330251524.db2.gz XLVAVVAGRBKPRM-OCCSQVGLSA-N 1 0 276.380 3.552 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCCC1CC1)C1CC1 ZINC000536857124 330252328 /nfs/dbraw/zinc/25/23/28/330252328.db2.gz KCHIQEQSQSRGHV-MRXNPFEDSA-N 1 0 288.391 3.696 20 5 CHBDRO CC1(C)C[C@H]1C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000536865789 330253815 /nfs/dbraw/zinc/25/38/15/330253815.db2.gz WUPLNNZSQQFHGF-GJZGRUSLSA-N 1 0 288.391 3.552 20 5 CHBDRO CC(C)=CCC[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000536878156 330314104 /nfs/dbraw/zinc/31/41/04/330314104.db2.gz UJNDRKNBRQCXDS-CYBMUJFWSA-N 1 0 262.353 3.819 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH+](CC1CC1)CC1CC1 ZINC000533060100 330325491 /nfs/dbraw/zinc/32/54/91/330325491.db2.gz CSNYZOOUKYFAAH-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000424329367 330341769 /nfs/dbraw/zinc/34/17/69/330341769.db2.gz RMPZDDSZRXPRIF-ZIAGYGMSSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424335463 330343238 /nfs/dbraw/zinc/34/32/38/330343238.db2.gz WQGJCGWKJSXHPD-VBNZEHGJSA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000045628956 330347271 /nfs/dbraw/zinc/34/72/71/330347271.db2.gz UHJFSPXINQJODJ-ZIAGYGMSSA-N 1 0 274.364 3.910 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000580491070 330348532 /nfs/dbraw/zinc/34/85/32/330348532.db2.gz CUQHYJQNFRHHSC-OAHLLOKOSA-N 1 0 274.364 3.524 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000437046229 330691822 /nfs/dbraw/zinc/69/18/22/330691822.db2.gz MNNOSFZGSPDCKJ-KGYLQXTDSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])cc1)[C@@H](c1ccccc1)[NH+](C)C ZINC000439129603 330734266 /nfs/dbraw/zinc/73/42/66/330734266.db2.gz QYDYVZDAMCEEDZ-DYVFJYSZSA-N 1 0 299.374 3.698 20 5 CHBDRO CCC(CC)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447519415 330867581 /nfs/dbraw/zinc/86/75/81/330867581.db2.gz YKNSVMVPEZMBTB-OAHLLOKOSA-N 1 0 262.353 3.750 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000449177118 330903825 /nfs/dbraw/zinc/90/38/25/330903825.db2.gz UUVNEPUDMXHTOA-BMFZPTHFSA-N 1 0 292.379 3.593 20 5 CHBDRO CC(F)(F)CCC[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000449349785 330917256 /nfs/dbraw/zinc/91/72/56/330917256.db2.gz HWBZUEHYUHPCNM-DAXSKMNVSA-N 1 0 284.306 3.633 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449445080 330926057 /nfs/dbraw/zinc/92/60/57/330926057.db2.gz GAIUJONMXKHLJR-NSHDSACASA-N 1 0 286.331 3.743 20 5 CHBDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000163405062 331034691 /nfs/dbraw/zinc/03/46/91/331034691.db2.gz XEYKPBRRUYZCBM-JTQLQIEISA-N 1 0 290.285 3.806 20 5 CHBDRO CC[C@@H](N[C@@H](CC)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000453242961 331106398 /nfs/dbraw/zinc/10/63/98/331106398.db2.gz IRHHIWFCRJWPGM-NEPJUHHUSA-N 1 0 272.295 3.679 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2C[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC000453379222 331125314 /nfs/dbraw/zinc/12/53/14/331125314.db2.gz WWHMJIXDOZYFCB-WHOFXGATSA-N 1 0 274.364 3.600 20 5 CHBDRO Cc1cc(C)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cn1 ZINC000453379462 331125596 /nfs/dbraw/zinc/12/55/96/331125596.db2.gz WISRYOJHIOXXIF-CQSZACIVSA-N 1 0 299.374 3.766 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC1CC(F)(F)C1 ZINC000453438985 331131755 /nfs/dbraw/zinc/13/17/55/331131755.db2.gz VPDKAOHQQKSQDB-NSHDSACASA-N 1 0 298.333 3.551 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H](C1CC1)C1CCC1 ZINC000453627167 331137250 /nfs/dbraw/zinc/13/72/50/331137250.db2.gz UUNYJKIIGDQWHR-LYLYKKCESA-N 1 0 286.375 3.776 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc32)cc1[N+](=O)[O-] ZINC000195651195 331179400 /nfs/dbraw/zinc/17/94/00/331179400.db2.gz KPXASUYBFSHBSV-CJNGLKHVSA-N 1 0 296.370 3.894 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CCC2)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000459779861 331300682 /nfs/dbraw/zinc/30/06/82/331300682.db2.gz VBNZXTJBTNTYNV-GFCCVEGCSA-N 1 0 274.364 3.968 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@H](C)CC[C@H]2C)cccc1[N+](=O)[O-] ZINC000464815904 331369450 /nfs/dbraw/zinc/36/94/50/331369450.db2.gz VIWAXFUZDCPGQG-VXGBXAGGSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]1CCC[C@@H]1C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000466421678 331396290 /nfs/dbraw/zinc/39/62/90/331396290.db2.gz NOVHKMMSOOFAOL-UDDXRPRYSA-N 1 0 274.364 3.634 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CCCC1 ZINC000468634433 331437930 /nfs/dbraw/zinc/43/79/30/331437930.db2.gz DNMPOZSHUKZCJQ-LCYFTJDESA-N 1 0 274.364 3.778 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1 ZINC000468643022 331438107 /nfs/dbraw/zinc/43/81/07/331438107.db2.gz VTFVWRKGEIOAOY-GXDHUFHOSA-N 1 0 282.343 3.788 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]2CCCF)cc1 ZINC000510696561 332912235 /nfs/dbraw/zinc/91/22/35/332912235.db2.gz RESFNKGNUXZNKJ-UKRRQHHQSA-N 1 0 280.343 3.603 20 5 CHBDRO CC(C)=CCC[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000479292203 331723778 /nfs/dbraw/zinc/72/37/78/331723778.db2.gz ADJRROMFGKHBBB-CQSZACIVSA-N 1 0 276.380 3.862 20 5 CHBDRO CCCCC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479868732 331749722 /nfs/dbraw/zinc/74/97/22/331749722.db2.gz UAJPHGUVRAMXID-OAHLLOKOSA-N 1 0 276.380 3.696 20 5 CHBDRO COc1cc(C[NH2+][C@@H]2CCCCC2(C)C)ccc1[N+](=O)[O-] ZINC000481172940 331799756 /nfs/dbraw/zinc/79/97/56/331799756.db2.gz GKMZQXAQUTXWHS-OAHLLOKOSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000481231808 331801518 /nfs/dbraw/zinc/80/15/18/331801518.db2.gz IILSKUSAPIABIR-ZIAGYGMSSA-N 1 0 274.364 3.910 20 5 CHBDRO Cc1c(C[NH2+]C[C@H](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000483637496 331880257 /nfs/dbraw/zinc/88/02/57/331880257.db2.gz LPUBCXFVITVYQO-CQSZACIVSA-N 1 0 298.386 3.872 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CC1CCC1 ZINC000489233484 332044114 /nfs/dbraw/zinc/04/41/14/332044114.db2.gz PZJPUJJDFUVNPF-GFCCVEGCSA-N 1 0 262.353 3.696 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490056124 332078967 /nfs/dbraw/zinc/07/89/67/332078967.db2.gz DVDHVURQDAGVGC-AWEZNQCLSA-N 1 0 292.379 3.758 20 5 CHBDRO CC[C@H]1C[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CCS1 ZINC000490088539 332080776 /nfs/dbraw/zinc/08/07/76/332080776.db2.gz OWZRDLMMELKVNA-OCCSQVGLSA-N 1 0 294.420 3.792 20 5 CHBDRO CCOc1cc(C[NH2+][C@H](C)[C@@H](C)CC)ccc1[N+](=O)[O-] ZINC000491599339 332242289 /nfs/dbraw/zinc/24/22/89/332242289.db2.gz QJBNMHFZGVVYFM-NWDGAFQWSA-N 1 0 280.368 3.518 20 5 CHBDRO CC(C)([NH2+]C/C=C\c1ccncc1)c1ccccc1[N+](=O)[O-] ZINC000492151105 332384640 /nfs/dbraw/zinc/38/46/40/332384640.db2.gz LOBBDRXREIGDEK-WAYWQWQTSA-N 1 0 297.358 3.528 20 5 CHBDRO CCOc1cc(C[NH2+][C@H](CC)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000492610939 332405693 /nfs/dbraw/zinc/40/56/93/332405693.db2.gz YGSXYLLCWVQCTB-OAHLLOKOSA-N 1 0 294.395 3.908 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000495439667 332519134 /nfs/dbraw/zinc/51/91/34/332519134.db2.gz MTWJONHAQAEYDZ-JTQLQIEISA-N 1 0 284.787 3.815 20 5 CHBDRO CC(C)C[C@@H](C)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000499610454 332590106 /nfs/dbraw/zinc/59/01/06/332590106.db2.gz JXNUACPSWGUKEQ-CHWSQXEVSA-N 1 0 264.369 3.928 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC[C@@H]1C ZINC000501902425 332642718 /nfs/dbraw/zinc/64/27/18/332642718.db2.gz WHRGCKHGWHRXEZ-HUBLWGQQSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)cccc1[N+](=O)[O-] ZINC000502451604 332660596 /nfs/dbraw/zinc/66/05/96/332660596.db2.gz LGNLVUZHLUAEII-BMFZPTHFSA-N 1 0 274.364 3.572 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CSC[C@@H]2C)cc1[N+](=O)[O-] ZINC000512863084 332990254 /nfs/dbraw/zinc/99/02/54/332990254.db2.gz ZIYVCGBLVMDEBI-FZMZJTMJSA-N 1 0 294.420 3.559 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000178640485 333076298 /nfs/dbraw/zinc/07/62/98/333076298.db2.gz XHNXMYBNPCXTNL-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CN(Cc1ccccc1[N+](=O)[O-])c1cc[nH+]c2ccccc21 ZINC000521061844 333110699 /nfs/dbraw/zinc/11/06/99/333110699.db2.gz QEPJSXGEAMUEID-UHFFFAOYSA-N 1 0 293.326 3.779 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000522046689 333231536 /nfs/dbraw/zinc/23/15/36/333231536.db2.gz DWXOHDHFIUCIPT-DGCLKSJQSA-N 1 0 262.353 3.524 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2c2ccccc2)cc1 ZINC000522269143 333277136 /nfs/dbraw/zinc/27/71/36/333277136.db2.gz DOOYNEHBLFJBHS-GOSISDBHSA-N 1 0 296.370 3.974 20 5 CHBDRO CCC(CC)[N@H+](CCOc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000522475166 333287731 /nfs/dbraw/zinc/28/77/31/333287731.db2.gz NRADYEWQZGLTPJ-UHFFFAOYSA-N 1 0 292.379 3.627 20 5 CHBDRO CC(C)C(C[NH2+]Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000229537355 333305841 /nfs/dbraw/zinc/30/58/41/333305841.db2.gz KWEXSZSBSRHVTQ-UHFFFAOYSA-N 1 0 264.369 3.613 20 5 CHBDRO CC(C)C(C[NH2+]Cc1csc([N+](=O)[O-])c1)C(C)C ZINC000229531749 333306003 /nfs/dbraw/zinc/30/60/03/333306003.db2.gz GBBODJJLEAUGIT-UHFFFAOYSA-N 1 0 270.398 3.674 20 5 CHBDRO CCC1(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)CCCC1 ZINC000230200194 333315604 /nfs/dbraw/zinc/31/56/04/333315604.db2.gz VLEZLAJLLQXVNG-UHFFFAOYSA-N 1 0 292.379 3.663 20 5 CHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000523702135 333340199 /nfs/dbraw/zinc/34/01/99/333340199.db2.gz UZKAOHZPXLBTOK-GOSISDBHSA-N 1 0 296.370 3.757 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@H]1C(C)C ZINC000303695037 333345477 /nfs/dbraw/zinc/34/54/77/333345477.db2.gz QMRDZEVTDXWACF-HNNXBMFYSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000237816056 333381729 /nfs/dbraw/zinc/38/17/29/333381729.db2.gz KRWKGVKURWZHNI-QGZVFWFLSA-N 1 0 296.370 3.550 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000524766731 333387333 /nfs/dbraw/zinc/38/73/33/333387333.db2.gz NKOAZLPAOGNKJN-HNNXBMFYSA-N 1 0 262.353 3.607 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000398025227 333431587 /nfs/dbraw/zinc/43/15/87/333431587.db2.gz ADTGUCCTUYIIHB-SNVBAGLBSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2CCCC2)cccc1[N+](=O)[O-] ZINC000537918150 333511129 /nfs/dbraw/zinc/51/11/29/333511129.db2.gz CBOZEFZNFWUCBN-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO C[C@H]([NH2+]CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000037249715 333523873 /nfs/dbraw/zinc/52/38/73/333523873.db2.gz LQHCNVFUBPZWOL-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO CC(C)CCC[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037562617 333534984 /nfs/dbraw/zinc/53/49/84/333534984.db2.gz MDAUZGZOMBDQFZ-LLVKDONJSA-N 1 0 270.398 3.961 20 5 CHBDRO Cc1ccccc1C[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000037777320 333539520 /nfs/dbraw/zinc/53/95/20/333539520.db2.gz ZLOVVIQECXXQMJ-AWEZNQCLSA-N 1 0 284.359 3.624 20 5 CHBDRO Cc1ccsc1CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000538116348 333575086 /nfs/dbraw/zinc/57/50/86/333575086.db2.gz LGEHRWOKAYQAOR-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)cc1 ZINC000538399651 333588734 /nfs/dbraw/zinc/58/87/34/333588734.db2.gz VWSBLOYCCWUCMY-SOUVJXGZSA-N 1 0 274.364 3.653 20 5 CHBDRO C[C@@]1([NH2+]Cc2cccc([N+](=O)[O-])c2)CCCc2ccccc21 ZINC000538707788 333612954 /nfs/dbraw/zinc/61/29/54/333612954.db2.gz WTBGVPVJFVULAX-GOSISDBHSA-N 1 0 296.370 3.936 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC(C(F)F)CC1 ZINC000538735809 333620806 /nfs/dbraw/zinc/62/08/06/333620806.db2.gz DWNYLEZHIOELTH-HYXAFXHYSA-N 1 0 296.317 3.585 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc2cc[nH]c21)c1ccccc1[N+](=O)[O-] ZINC000539226739 333662366 /nfs/dbraw/zinc/66/23/66/333662366.db2.gz WEISEOOSLYOTPJ-GFCCVEGCSA-N 1 0 295.342 3.927 20 5 CHBDRO COc1ccc(C[NH2+]C2CCC(C)(C)CC2)cc1[N+](=O)[O-] ZINC000079678746 334159813 /nfs/dbraw/zinc/15/98/13/334159813.db2.gz IXTBKMMSLOJDNS-UHFFFAOYSA-N 1 0 292.379 3.662 20 5 CHBDRO CC(C)[C@@H](C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000081045308 334177259 /nfs/dbraw/zinc/17/72/59/334177259.db2.gz HJAGBRYJAQUXJA-RYUDHWBXSA-N 1 0 250.342 3.538 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H]1c1ccccc1 ZINC000549232890 334188246 /nfs/dbraw/zinc/18/82/46/334188246.db2.gz IYTRCYLKAFLIEK-JQFCIGGWSA-N 1 0 296.370 3.877 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H]1c1ccccc1 ZINC000549232889 334188303 /nfs/dbraw/zinc/18/83/03/334188303.db2.gz IYTRCYLKAFLIEK-COXVUDFISA-N 1 0 296.370 3.877 20 5 CHBDRO C[C@H]1CN(Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000081574989 334197654 /nfs/dbraw/zinc/19/76/54/334197654.db2.gz IXUVUQQYJLEODE-GUYCJALGSA-N 1 0 282.343 3.788 20 5 CHBDRO COc1ccc(C[NH2+]C2CC(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000549858968 334206878 /nfs/dbraw/zinc/20/68/78/334206878.db2.gz HNEZGMJKPYPBGJ-UHFFFAOYSA-N 1 0 292.379 3.518 20 5 CHBDRO CC(F)(F)C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000551240974 334242426 /nfs/dbraw/zinc/24/24/26/334242426.db2.gz IZEPLPJFKMCWHO-YPMHNXCESA-N 1 0 298.333 3.551 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@H]2CCC[C@H]2F)c2cc([N+](=O)[O-])ccc21 ZINC000551309275 334246338 /nfs/dbraw/zinc/24/63/38/334246338.db2.gz QJFNGAKWURYCOD-ILXRZTDVSA-N 1 0 292.354 3.797 20 5 CHBDRO CCC1CC([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000551519332 334252239 /nfs/dbraw/zinc/25/22/39/334252239.db2.gz DMSYIYJQIAMFCH-UHFFFAOYSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)C1CCCC1 ZINC000551585205 334255163 /nfs/dbraw/zinc/25/51/63/334255163.db2.gz BNYPMGPDHLJGGJ-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000552274178 334311263 /nfs/dbraw/zinc/31/12/63/334311263.db2.gz DSJRJKVPMWUAEO-KRWDZBQOSA-N 1 0 296.370 3.974 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000090035987 334355949 /nfs/dbraw/zinc/35/59/49/334355949.db2.gz NTHWSFIFGIGNJI-GXTWGEPZSA-N 1 0 290.363 3.753 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000251574459 334364694 /nfs/dbraw/zinc/36/46/94/334364694.db2.gz BUMQIQGFRFJRJM-NFAWXSAZSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@H]1C ZINC000251599670 334365299 /nfs/dbraw/zinc/36/52/99/334365299.db2.gz BQVYUJCANMICJI-DYEKYZERSA-N 1 0 262.353 3.509 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@@H]2C2CC2)c(Cl)c1 ZINC000554089474 334411256 /nfs/dbraw/zinc/41/12/56/334411256.db2.gz SWJPOCREQHBVRP-TZMCWYRMSA-N 1 0 280.755 3.526 20 5 CHBDRO CC[C@H]1CC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000554371344 334425493 /nfs/dbraw/zinc/42/54/93/334425493.db2.gz LIRAZYPRRAJALQ-TVQRCGJNSA-N 1 0 268.744 3.526 20 5 CHBDRO CCC[C@@H](C)C[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000565268972 334549098 /nfs/dbraw/zinc/54/90/98/334549098.db2.gz RZIPJXZEBYHISV-GFCCVEGCSA-N 1 0 289.379 3.644 20 5 CHBDRO CC[N@H+](CCC1CC1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000577252207 335329958 /nfs/dbraw/zinc/32/99/58/335329958.db2.gz WJOZYKJWFVTPHP-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2F)cc1[N+](=O)[O-] ZINC000577595062 335375418 /nfs/dbraw/zinc/37/54/18/335375418.db2.gz RPENSCGBTLEPLK-WCFLWFBJSA-N 1 0 296.342 3.535 20 5 CHBDRO Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000580903532 335982477 /nfs/dbraw/zinc/98/24/77/335982477.db2.gz VSWLYQFDQOOYKI-MRXNPFEDSA-N 1 0 282.343 3.680 20 5 CHBDRO CC[C@H](C)[C@@H](C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)OC ZINC000381185870 336054017 /nfs/dbraw/zinc/05/40/17/336054017.db2.gz SBVYXXBSMHGDBY-DETPVDSQSA-N 1 0 294.395 3.615 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCC2=CCCCC2)c(F)c1 ZINC000381236017 336056023 /nfs/dbraw/zinc/05/60/23/336056023.db2.gz YULNDJHTSZAZNB-UHFFFAOYSA-N 1 0 278.327 3.714 20 5 CHBDRO CCC1([NH2+]Cc2cccc([N+](=O)[O-])c2C)CCCC1 ZINC000382568104 336094153 /nfs/dbraw/zinc/09/41/53/336094153.db2.gz OXCABTGICNSYSH-UHFFFAOYSA-N 1 0 262.353 3.716 20 5 CHBDRO CCSCC[C@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000581954010 336178762 /nfs/dbraw/zinc/17/87/62/336178762.db2.gz GPGXOAWDRSNGPP-FZMZJTMJSA-N 1 0 294.420 3.703 20 5 CHBDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)o1 ZINC000344640364 533827702 /nfs/dbraw/zinc/82/77/02/533827702.db2.gz ZAHSPVOZLZNLHT-JTQLQIEISA-N 1 0 294.376 3.669 20 5 CHBDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000344632816 533828245 /nfs/dbraw/zinc/82/82/45/533828245.db2.gz SMXZDCQYTYKQPK-LBPRGKRZSA-N 1 0 288.347 3.607 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000340418830 519836300 /nfs/dbraw/zinc/83/63/00/519836300.db2.gz IPHZODHRVNZAEC-AWEZNQCLSA-N 1 0 262.353 3.606 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000222760728 521177566 /nfs/dbraw/zinc/17/75/66/521177566.db2.gz HQONWEZNRXQCCG-NOLJZWGESA-N 1 0 292.379 3.593 20 5 CHBDRO CO[C@]1(C)CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000280495956 521752912 /nfs/dbraw/zinc/75/29/12/521752912.db2.gz MOKFQNORUOMEGB-CZUORRHYSA-N 1 0 292.379 3.547 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000294498037 522652705 /nfs/dbraw/zinc/65/27/05/522652705.db2.gz ZESDKSDBAJXTBC-AWEZNQCLSA-N 1 0 276.361 3.897 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H]1CCCCS1)c1cccc([N+](=O)[O-])c1 ZINC000156334716 522854111 /nfs/dbraw/zinc/85/41/11/522854111.db2.gz AKEPTQJTEBWTCR-LSDHHAIUSA-N 1 0 294.420 3.921 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000048327002 524586390 /nfs/dbraw/zinc/58/63/90/524586390.db2.gz BVJDXPJVWIMAMK-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000037775712 524592997 /nfs/dbraw/zinc/59/29/97/524592997.db2.gz SRNAIXXSMMPJSW-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1cccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000037668421 524829962 /nfs/dbraw/zinc/82/99/62/524829962.db2.gz YKYQEJONNWCDKQ-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1ccccc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291638286 525166315 /nfs/dbraw/zinc/16/63/15/525166315.db2.gz BEMZLCOMBWHWIT-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@H](C)C2CCC2)cccc1[N+](=O)[O-] ZINC000357026872 525703170 /nfs/dbraw/zinc/70/31/70/525703170.db2.gz RGKJTOXVLOVTAO-GFCCVEGCSA-N 1 0 262.353 3.524 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000127380515 527396363 /nfs/dbraw/zinc/39/63/63/527396363.db2.gz QGIHJHPYHGGXNZ-BBOMDTFKSA-N 1 0 297.358 3.773 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000543628051 1121533858 /nfs/dbraw/zinc/53/38/58/1121533858.db2.gz KCJHPXYRLNEVJW-CQSZACIVSA-N 1 0 262.353 3.668 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCCCCCCc1ccccc1 ZINC001224560644 1135459892 /nfs/dbraw/zinc/45/98/92/1135459892.db2.gz NDDNAPGRIIMAQI-KRWDZBQOSA-N 1 0 278.460 3.901 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(Cl)c(C(F)(F)F)c1 ZINC001225670750 1135605938 /nfs/dbraw/zinc/60/59/38/1135605938.db2.gz FIHJRZHPDSOJBU-SECBINFHSA-N 1 0 296.740 3.832 20 5 CHBDRO CC(C)[C@@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000135191138 1125581494 /nfs/dbraw/zinc/58/14/94/1125581494.db2.gz RMAFREHOFWTVKO-GFCCVEGCSA-N 1 0 282.771 3.726 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000216462121 1125595149 /nfs/dbraw/zinc/59/51/49/1125595149.db2.gz NYOKDCVPJDXYHB-SLEUVZQESA-N 1 0 292.379 3.518 20 5 CHBDRO CC[C@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000533504896 1125611683 /nfs/dbraw/zinc/61/16/83/1125611683.db2.gz IVRHKXSQFOXBAE-LBPRGKRZSA-N 1 0 280.368 3.612 20 5 CHBDRO CO[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000886562120 1125691790 /nfs/dbraw/zinc/69/17/90/1125691790.db2.gz QRWVRCZBWNDYOC-MGPQQGTHSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OC(Cl)(Cl)c1ccc(F)cc1 ZINC001223924545 1125779570 /nfs/dbraw/zinc/77/95/70/1125779570.db2.gz VTHAJUVLJHFHPT-SNVBAGLBSA-N 1 0 295.205 3.525 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746666079 1130142460 /nfs/dbraw/zinc/14/24/60/1130142460.db2.gz IJMUDUJTCZQUBZ-LBPRGKRZSA-N 1 0 268.744 3.623 20 5 CHBDRO CC(C)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811472123 1130614483 /nfs/dbraw/zinc/61/44/83/1130614483.db2.gz WVWMZYJCMVWOKM-UHFFFAOYSA-N 1 0 277.151 3.647 20 5 CHBDRO COc1cc(C[N@@H+]2CCCC[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000485554228 1126924775 /nfs/dbraw/zinc/92/47/75/1126924775.db2.gz UTYFCJBSMGSSDD-AWEZNQCLSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccnc1 ZINC000192609259 1126962505 /nfs/dbraw/zinc/96/25/05/1126962505.db2.gz KZOQTOPNKGBZHW-YVEFUNNKSA-N 1 0 297.358 3.718 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCNc2ccccc21 ZINC000192971755 1126965824 /nfs/dbraw/zinc/96/58/24/1126965824.db2.gz JXKWUAUOKIRPTR-MRXNPFEDSA-N 1 0 297.358 3.631 20 5 CHBDRO CC1(CC[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000698085016 1127061820 /nfs/dbraw/zinc/06/18/20/1127061820.db2.gz JLEQEEOKLBXUNS-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000348927315 1127134872 /nfs/dbraw/zinc/13/48/72/1127134872.db2.gz ZXDFKHFBSSWZDA-KRWDZBQOSA-N 1 0 297.358 3.635 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CCC2)CC1 ZINC000586783008 1127141056 /nfs/dbraw/zinc/14/10/56/1127141056.db2.gz IWCBEDXQMFZFTM-ZDUSSCGKSA-N 1 0 274.364 3.922 20 5 CHBDRO CC[C@H](C)[N@H+](CC)Cc1cccc([N+](=O)[O-])c1C ZINC000595592012 1127154773 /nfs/dbraw/zinc/15/47/73/1127154773.db2.gz AHVYFIDNUPBAHP-NSHDSACASA-N 1 0 250.342 3.524 20 5 CHBDRO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)nc1 ZINC000156321770 1127151121 /nfs/dbraw/zinc/15/11/21/1127151121.db2.gz TVGLOKIECXTKRD-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1CCC(F)(F)CC1 ZINC000350053183 1127171006 /nfs/dbraw/zinc/17/10/06/1127171006.db2.gz YVVOCPHMJHRVRO-UHFFFAOYSA-N 1 0 284.306 3.571 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000589209277 1127216500 /nfs/dbraw/zinc/21/65/00/1127216500.db2.gz BQERHARHQDWWIM-HNNXBMFYSA-N 1 0 274.364 3.525 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(C2CC2)CC1 ZINC000590053091 1127246558 /nfs/dbraw/zinc/24/65/58/1127246558.db2.gz XTOXLXXHUFXULY-UHFFFAOYSA-N 1 0 274.364 3.525 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@H](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000590378138 1127257015 /nfs/dbraw/zinc/25/70/15/1127257015.db2.gz IQNGWCQZFRHOQW-OAHLLOKOSA-N 1 0 274.364 3.525 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@@H]2CC=CCC2)c1 ZINC000045629019 1127260790 /nfs/dbraw/zinc/26/07/90/1127260790.db2.gz CFEYSULUOQQTRD-LLVKDONJSA-N 1 0 280.755 3.694 20 5 CHBDRO CCC(C)(C)[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000590777413 1127271587 /nfs/dbraw/zinc/27/15/87/1127271587.db2.gz IVSUIWQXOBYOTJ-NSHDSACASA-N 1 0 250.342 3.509 20 5 CHBDRO COC1(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCCC1 ZINC000590778648 1127272121 /nfs/dbraw/zinc/27/21/21/1127272121.db2.gz ALGRHFCKNMNTAK-ZDUSSCGKSA-N 1 0 292.379 3.513 20 5 CHBDRO CS[C@H]1CCCC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000355216294 1127326093 /nfs/dbraw/zinc/32/60/93/1127326093.db2.gz UWYPFPZFZWALLC-AWEZNQCLSA-N 1 0 294.420 3.621 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CC1CCC(F)CC1 ZINC000592376682 1127343612 /nfs/dbraw/zinc/34/36/12/1127343612.db2.gz DXDBDPXWVLJNLO-HYXAFXHYSA-N 1 0 292.354 3.726 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)CC(F)F ZINC000592392405 1127344631 /nfs/dbraw/zinc/34/46/31/1127344631.db2.gz QWHREDLBXSYXDY-ONGXEEELSA-N 1 0 286.322 3.845 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CCC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000593080961 1127372320 /nfs/dbraw/zinc/37/23/20/1127372320.db2.gz NPPZOOVPULCNAP-LLVKDONJSA-N 1 0 260.337 3.578 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1Cc2ccccc21 ZINC000594493908 1127418195 /nfs/dbraw/zinc/41/81/95/1127418195.db2.gz AMLDXSLTFDKGBA-SUMWQHHRSA-N 1 0 294.354 3.512 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594503247 1127418801 /nfs/dbraw/zinc/41/88/01/1127418801.db2.gz SVDNQKJPLHIBON-MLGOLLRUSA-N 1 0 297.358 3.636 20 5 CHBDRO C[C@]1(CC[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC1(F)F ZINC000594977375 1127438087 /nfs/dbraw/zinc/43/80/87/1127438087.db2.gz KZVLOCGDHDNECL-SDQPKGBYSA-N 1 0 296.317 3.633 20 5 CHBDRO CC[C@@](C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000594979315 1127438195 /nfs/dbraw/zinc/43/81/95/1127438195.db2.gz JDEGPIBMTOHDQX-QKIRZYONSA-N 1 0 274.364 3.776 20 5 CHBDRO CC[C@](C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000594979313 1127438267 /nfs/dbraw/zinc/43/82/67/1127438267.db2.gz JDEGPIBMTOHDQX-IOBAAEILSA-N 1 0 274.364 3.776 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@]34C[C@H]3CCC4)o2)cc1 ZINC000594949493 1127439390 /nfs/dbraw/zinc/43/93/90/1127439390.db2.gz DGACFLHLAJYYHH-CXAGYDPISA-N 1 0 298.342 3.887 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@]23C[C@H]2CCC3)o1 ZINC000594952656 1127439999 /nfs/dbraw/zinc/43/99/99/1127439999.db2.gz QNNQXZHOGWUVOZ-SJKOYZFVSA-N 1 0 298.342 3.887 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCSCC2)cc1[N+](=O)[O-] ZINC000595027537 1127448890 /nfs/dbraw/zinc/44/88/90/1127448890.db2.gz PNISPOWXJUGBBX-JSGCOSHPSA-N 1 0 294.420 3.840 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCC23CC3)c(Cl)c1 ZINC000595034458 1127449503 /nfs/dbraw/zinc/44/95/03/1127449503.db2.gz ZYTRGDOWPJAYDS-ZDUSSCGKSA-N 1 0 280.755 3.671 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)c1ccccn1 ZINC000595051998 1127451243 /nfs/dbraw/zinc/45/12/43/1127451243.db2.gz ZZERNHVODBFYAP-UONOGXRCSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCOC(C)(C)C ZINC000595075727 1127453012 /nfs/dbraw/zinc/45/30/12/1127453012.db2.gz BGMQWFVBCOSUQS-ZDUSSCGKSA-N 1 0 294.395 3.759 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CCC(C)(C)F)cc1[N+](=O)[O-] ZINC000595085300 1127453491 /nfs/dbraw/zinc/45/34/91/1127453491.db2.gz JYCBINOQQLAQIJ-LLVKDONJSA-N 1 0 298.358 3.782 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CC)C2CC2)cc1[N+](=O)[O-] ZINC000595082290 1127453647 /nfs/dbraw/zinc/45/36/47/1127453647.db2.gz XZXYZXXEFMESKQ-FZMZJTMJSA-N 1 0 292.379 3.833 20 5 CHBDRO CC(C)CC1([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000595095852 1127455255 /nfs/dbraw/zinc/45/52/55/1127455255.db2.gz RFGAVRRTXTWSTG-LBPRGKRZSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1noc(C[NH2+][C@@H]2CCC[C@H]2CCC(C)C)c1[N+](=O)[O-] ZINC000595452166 1127463717 /nfs/dbraw/zinc/46/37/17/1127463717.db2.gz ZEPUOOZWYQZWQA-QWHCGFSZSA-N 1 0 295.383 3.586 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595562813 1127465728 /nfs/dbraw/zinc/46/57/28/1127465728.db2.gz RCDXIWCSHGBELC-WHOFXGATSA-N 1 0 260.337 3.530 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)C1(C)CC1 ZINC000360027081 1127486753 /nfs/dbraw/zinc/48/67/53/1127486753.db2.gz DBBRQDHWRSERFX-SNVBAGLBSA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000596650704 1127515337 /nfs/dbraw/zinc/51/53/37/1127515337.db2.gz KEFNRRGBCXFKBF-PIGZYNQJSA-N 1 0 297.358 3.515 20 5 CHBDRO Cc1ccc2c(c1)CN(Cc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000361109868 1127538457 /nfs/dbraw/zinc/53/84/57/1127538457.db2.gz FYIXNBKERKRECH-UHFFFAOYSA-N 1 0 282.343 3.727 20 5 CHBDRO CC[C@H](C)[C@H](C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000060562504 1127544724 /nfs/dbraw/zinc/54/47/24/1127544724.db2.gz WAOSZAWMZYFBEC-STQMWFEESA-N 1 0 276.380 3.994 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccoc2)cc1[N+](=O)[O-] ZINC000361918858 1127598808 /nfs/dbraw/zinc/59/88/08/1127598808.db2.gz LZFIUMRLZMAALL-OLZOCXBDSA-N 1 0 288.347 3.778 20 5 CHBDRO C[C@@H](CC(C)(C)C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602689657 1127604267 /nfs/dbraw/zinc/60/42/67/1127604267.db2.gz WWPKNVZFUFPRAV-JTQLQIEISA-N 1 0 291.351 3.650 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC[C@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000598647365 1127630601 /nfs/dbraw/zinc/63/06/01/1127630601.db2.gz LCRZGJOSQQWZKZ-LBPRGKRZSA-N 1 0 298.333 3.853 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@@H]1CC1(F)F ZINC000598680477 1127632061 /nfs/dbraw/zinc/63/20/61/1127632061.db2.gz YFUGBNZHTFQCGQ-WDEREUQCSA-N 1 0 284.306 3.599 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H](c2ccccn2)C2CCC2)c1 ZINC000598993764 1127650471 /nfs/dbraw/zinc/65/04/71/1127650471.db2.gz NAIUNXGBLMPQOW-KRWDZBQOSA-N 1 0 297.358 3.621 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1 ZINC000598993765 1127650954 /nfs/dbraw/zinc/65/09/54/1127650954.db2.gz NAIUNXGBLMPQOW-QGZVFWFLSA-N 1 0 297.358 3.621 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000593677263 1127657537 /nfs/dbraw/zinc/65/75/37/1127657537.db2.gz WHALLUWFNNMVKE-SFHVURJKSA-N 1 0 296.370 3.989 20 5 CHBDRO Cc1c(C[N@@H+](CCC(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000061185906 1127663566 /nfs/dbraw/zinc/66/35/66/1127663566.db2.gz CCILQAKOMBEPLP-UHFFFAOYSA-N 1 0 276.380 3.914 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000603847294 1127676026 /nfs/dbraw/zinc/67/60/26/1127676026.db2.gz PDUKWLZXSQMMHV-KMFMINBZSA-N 1 0 288.391 3.995 20 5 CHBDRO CC(C)(C)CC(C)(C)[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000603894799 1127681245 /nfs/dbraw/zinc/68/12/45/1127681245.db2.gz OLCFJIJIAQBZKQ-UHFFFAOYSA-N 1 0 294.395 3.778 20 5 CHBDRO CC[N@H+](CCc1ccccc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000603889853 1127680640 /nfs/dbraw/zinc/68/06/40/1127680640.db2.gz ZPSYNIZEGDMRNI-UHFFFAOYSA-N 1 0 298.386 3.702 20 5 CHBDRO Cc1c(C[N@H+]2CCC(F)(F)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000599624844 1127685430 /nfs/dbraw/zinc/68/54/30/1127685430.db2.gz ZWINNZOZXWRRSB-JTQLQIEISA-N 1 0 284.306 3.523 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012772 1127689645 /nfs/dbraw/zinc/68/96/45/1127689645.db2.gz YTFFGZSKAWOUGV-AWEZNQCLSA-N 1 0 292.379 3.628 20 5 CHBDRO CC(F)(F)CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000297177083 1127690312 /nfs/dbraw/zinc/69/03/12/1127690312.db2.gz DRECIPDFWVNSMW-CYBMUJFWSA-N 1 0 284.306 3.607 20 5 CHBDRO Cc1ccc(CCC[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000604478729 1127706706 /nfs/dbraw/zinc/70/67/06/1127706706.db2.gz IRIFHEYHTMFWTN-UHFFFAOYSA-N 1 0 298.386 3.934 20 5 CHBDRO CC(C)CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000410067780 1127794292 /nfs/dbraw/zinc/79/42/92/1127794292.db2.gz BDGCSAHRVHPSEU-UHFFFAOYSA-N 1 0 288.347 3.991 20 5 CHBDRO CC(C)(C)C1=CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000535375154 1127913771 /nfs/dbraw/zinc/91/37/71/1127913771.db2.gz QDCPYBAYNOCACA-UHFFFAOYSA-N 1 0 274.364 3.773 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000035277338 1127935245 /nfs/dbraw/zinc/93/52/45/1127935245.db2.gz CHFOMLYAAYKTSJ-AWEZNQCLSA-N 1 0 293.411 3.826 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000595050143 1127941052 /nfs/dbraw/zinc/94/10/52/1127941052.db2.gz QDXLQVHWZOOIRL-TZMCWYRMSA-N 1 0 299.374 3.753 20 5 CHBDRO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000466903939 1127949731 /nfs/dbraw/zinc/94/97/31/1127949731.db2.gz BALZSDCOPXRKLB-SMDDNHRTSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)C1CCCCC1 ZINC000094773659 1127954513 /nfs/dbraw/zinc/95/45/13/1127954513.db2.gz NTOJQCGKNDQDGE-NSHDSACASA-N 1 0 280.343 3.792 20 5 CHBDRO C[C@H]([NH2+]C1CCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000540149665 1127964002 /nfs/dbraw/zinc/96/40/02/1127964002.db2.gz WMJZEFHXBZFURK-JTQLQIEISA-N 1 0 284.306 3.823 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000544830503 1127985831 /nfs/dbraw/zinc/98/58/31/1127985831.db2.gz BOCUTTXBXUHNFH-MWLCHTKSSA-N 1 0 290.285 3.976 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468001650 1127987093 /nfs/dbraw/zinc/98/70/93/1127987093.db2.gz CWIVTSXOCGYFET-TZMCWYRMSA-N 1 0 276.380 3.552 20 5 CHBDRO CC[C@]1(C)CC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000468136755 1127994541 /nfs/dbraw/zinc/99/45/41/1127994541.db2.gz AMWIOQOJAWDAGU-IUODEOHRSA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)CC1 ZINC000468148316 1127995195 /nfs/dbraw/zinc/99/51/95/1127995195.db2.gz VJCCREBXFCUBJF-OLZOCXBDSA-N 1 0 262.353 3.778 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])[C@@H]1C ZINC000035308146 1128010411 /nfs/dbraw/zinc/01/04/11/1128010411.db2.gz ZVMAWDMFZNVNAK-JTNHKYCSSA-N 1 0 280.343 3.648 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000541774613 1128038775 /nfs/dbraw/zinc/03/87/75/1128038775.db2.gz XQQPQVCICLDXRA-CYBMUJFWSA-N 1 0 262.353 3.525 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)CCC1CC1 ZINC000470172509 1128064314 /nfs/dbraw/zinc/06/43/14/1128064314.db2.gz XWDXNXSKROGDGW-JLHYYAGUSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](C)C1 ZINC000470175901 1128064578 /nfs/dbraw/zinc/06/45/78/1128064578.db2.gz TUGRBAIGFWBRIG-FYQHACEVSA-N 1 0 274.364 3.730 20 5 CHBDRO CCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000470174974 1128065018 /nfs/dbraw/zinc/06/50/18/1128065018.db2.gz XGPYYVZQGVZBDT-JLHYYAGUSA-N 1 0 274.364 3.873 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCC[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000492543308 1128102455 /nfs/dbraw/zinc/10/24/55/1128102455.db2.gz ZCCQPXOMLZKPCL-AWEZNQCLSA-N 1 0 292.379 3.614 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@@H](C)C[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492629930 1128106329 /nfs/dbraw/zinc/10/63/29/1128106329.db2.gz KZSJRYOLCYNSFO-JSGCOSHPSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](C2CC2)C1 ZINC000492785039 1128112922 /nfs/dbraw/zinc/11/29/22/1128112922.db2.gz RWKPQAQALHQXDJ-OCCSQVGLSA-N 1 0 274.364 3.696 20 5 CHBDRO CC(C)[C@@H](C)C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524290 1128132397 /nfs/dbraw/zinc/13/23/97/1128132397.db2.gz AVQWSLWNPITVQA-JTQLQIEISA-N 1 0 270.760 3.630 20 5 CHBDRO CCC[NH+](CCC)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761511236 1128132430 /nfs/dbraw/zinc/13/24/30/1128132430.db2.gz NJYHQOVBMJOSNG-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO CC(C)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761514360 1128133141 /nfs/dbraw/zinc/13/31/41/1128133141.db2.gz IACHBXXQHMSMDC-LBPRGKRZSA-N 1 0 282.771 3.726 20 5 CHBDRO Cc1ccsc1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761520693 1128133153 /nfs/dbraw/zinc/13/31/53/1128133153.db2.gz DKILBUGKODQRRO-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CCC1 ZINC000761527995 1128133764 /nfs/dbraw/zinc/13/37/64/1128133764.db2.gz VMVMQMBCWKLKSQ-VIFPVBQESA-N 1 0 268.744 3.526 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494189614 1128159821 /nfs/dbraw/zinc/15/98/21/1128159821.db2.gz STYIKJIYIYIZRD-SNVBAGLBSA-N 1 0 270.760 3.725 20 5 CHBDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000494483945 1128175165 /nfs/dbraw/zinc/17/51/65/1128175165.db2.gz OYFDXFKDOPVVRH-XNRPHZJLSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1cnc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000926954668 1128206226 /nfs/dbraw/zinc/20/62/26/1128206226.db2.gz MRPXMCDFEBOIBU-AWEZNQCLSA-N 1 0 299.374 3.766 20 5 CHBDRO CC[C@@H](CSC)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193069545 1128206474 /nfs/dbraw/zinc/20/64/74/1128206474.db2.gz LLCMJRGKOAWHDG-SWLSCSKDSA-N 1 0 294.420 3.703 20 5 CHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000915685330 1128334231 /nfs/dbraw/zinc/33/42/31/1128334231.db2.gz VEFPDVRKNMDXGB-RISCZKNCSA-N 1 0 280.343 3.744 20 5 CHBDRO C[N@@H+]1CCCC[C@H]1CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000915666825 1128333606 /nfs/dbraw/zinc/33/36/06/1128333606.db2.gz IZDSWOITWDYXGE-LBPRGKRZSA-N 1 0 298.770 3.501 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cc3ccccc3o2)cc1 ZINC000194415063 1128377884 /nfs/dbraw/zinc/37/78/84/1128377884.db2.gz HBNOONJRGQLAMO-UHFFFAOYSA-N 1 0 296.326 3.673 20 5 CHBDRO C[C@@H]([NH2+]CCCCOC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000932177186 1128398659 /nfs/dbraw/zinc/39/86/59/1128398659.db2.gz LIRWAGXHPMWSTR-CYBMUJFWSA-N 1 0 294.395 3.841 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@H]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000917096889 1128481308 /nfs/dbraw/zinc/48/13/08/1128481308.db2.gz HKIPXWYTNBDCGR-WFASDCNBSA-N 1 0 276.380 3.914 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000563999228 1128488787 /nfs/dbraw/zinc/48/87/87/1128488787.db2.gz SPYVUTKKAZPFPA-UHFFFAOYSA-N 1 0 286.322 3.884 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC(C)(C)C1 ZINC000566020759 1128536899 /nfs/dbraw/zinc/53/68/99/1128536899.db2.gz CKBPGABWNLCVCQ-GFCCVEGCSA-N 1 0 276.380 3.694 20 5 CHBDRO CCC(CC)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000570551741 1128625811 /nfs/dbraw/zinc/62/58/11/1128625811.db2.gz OHBPQUAYGPPYID-UHFFFAOYSA-N 1 0 264.369 3.505 20 5 CHBDRO C[C@H](C[NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000572349570 1128644505 /nfs/dbraw/zinc/64/45/05/1128644505.db2.gz FLXPMHDDFAKTHK-CQSZACIVSA-N 1 0 284.359 3.531 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000556959515 1128652737 /nfs/dbraw/zinc/65/27/37/1128652737.db2.gz XDECYZPDIWANFE-AWEZNQCLSA-N 1 0 274.364 3.525 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccsc2)cc1 ZINC000046089184 1128658509 /nfs/dbraw/zinc/65/85/09/1128658509.db2.gz BTURIXHEKRAKOW-HNNXBMFYSA-N 1 0 288.372 3.993 20 5 CHBDRO CC1(C)C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]2CCC[C@H]21 ZINC000557055460 1128664186 /nfs/dbraw/zinc/66/41/86/1128664186.db2.gz NEUDQBYXNCUSSX-VXGBXAGGSA-N 1 0 280.393 3.667 20 5 CHBDRO Cc1ccc(-c2cccc([C@@H]3CCC[NH2+]3)c2)cc1[N+](=O)[O-] ZINC000600788930 1128681637 /nfs/dbraw/zinc/68/16/37/1128681637.db2.gz BZSXODCBGFYNRU-INIZCTEOSA-N 1 0 282.343 3.995 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2ncccc21)c1cccc([N+](=O)[O-])c1 ZINC000601264618 1128707024 /nfs/dbraw/zinc/70/70/24/1128707024.db2.gz BJOCVMGZSAVZHJ-SJCJKPOMSA-N 1 0 297.358 3.718 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609631873 1128721075 /nfs/dbraw/zinc/72/10/75/1128721075.db2.gz BPKRWLMLQKSMLZ-CYBMUJFWSA-N 1 0 294.370 3.992 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1C1CC1 ZINC000609705065 1128722838 /nfs/dbraw/zinc/72/28/38/1128722838.db2.gz MOXUZTWYHLEEOT-CYBMUJFWSA-N 1 0 280.755 3.623 20 5 CHBDRO CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CCO1 ZINC000578637211 1128724754 /nfs/dbraw/zinc/72/47/54/1128724754.db2.gz PBCJQGJGSHLOQY-VNHYZAJKSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000609766759 1128724793 /nfs/dbraw/zinc/72/47/93/1128724793.db2.gz OGRRFVRODVCYKG-AWEZNQCLSA-N 1 0 276.380 3.915 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609846135 1128728591 /nfs/dbraw/zinc/72/85/91/1128728591.db2.gz DTSJJXCUAUPRRI-XNRPHZJLSA-N 1 0 274.364 3.748 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000430193999 1117841365 /nfs/dbraw/zinc/84/13/65/1117841365.db2.gz HSARYLYYBFSMDN-JSGCOSHPSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)cc1 ZINC000014672859 1117859700 /nfs/dbraw/zinc/85/97/00/1117859700.db2.gz ZGGOMNCXKHKFCT-CQSZACIVSA-N 1 0 288.372 3.993 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000610215370 1117882534 /nfs/dbraw/zinc/88/25/34/1117882534.db2.gz JETLCCMMILJNBH-CHWSQXEVSA-N 1 0 262.353 3.605 20 5 CHBDRO CC1(C)CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000610216319 1117883143 /nfs/dbraw/zinc/88/31/43/1117883143.db2.gz MMCCIEUUCGEKEG-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1(C)C ZINC000801539817 1128759381 /nfs/dbraw/zinc/75/93/81/1128759381.db2.gz BEHAFUNFNLXLQZ-LLVKDONJSA-N 1 0 280.343 3.602 20 5 CHBDRO Cc1ccc(NC2CC[NH+](C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000301449026 1118236562 /nfs/dbraw/zinc/23/65/62/1118236562.db2.gz RVVCRBGPPMOEKA-UHFFFAOYSA-N 1 0 291.395 3.578 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccccc1)[NH+](C)C ZINC000301446450 1118242758 /nfs/dbraw/zinc/24/27/58/1118242758.db2.gz PXMNIOFVLDPAEC-KRWDZBQOSA-N 1 0 299.374 3.618 20 5 CHBDRO CC[C@@H](C)C[N@H+](CC)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083243351 1118368137 /nfs/dbraw/zinc/36/81/37/1118368137.db2.gz OCANCBWFLPELBC-LLVKDONJSA-N 1 0 291.351 3.604 20 5 CHBDRO C[C@H]([NH2+]Cc1cc2ccccc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000610420467 1118421461 /nfs/dbraw/zinc/42/14/61/1118421461.db2.gz PZTICJQHAAITOC-LBPRGKRZSA-N 1 0 295.342 3.927 20 5 CHBDRO CC(C)c1ccc(C[N@H+](C)CC2CC2)cc1[N+](=O)[O-] ZINC000510410154 1118575391 /nfs/dbraw/zinc/57/53/91/1118575391.db2.gz GUUCPGJYPLCFOR-UHFFFAOYSA-N 1 0 262.353 3.560 20 5 CHBDRO Cc1ccsc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000091437038 1118579612 /nfs/dbraw/zinc/57/96/12/1118579612.db2.gz CWLMRFXGSCAGCH-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)C2CCC2)cccc1[N+](=O)[O-] ZINC000090856202 1118645794 /nfs/dbraw/zinc/64/57/94/1118645794.db2.gz SZRWMHFOBWTOAN-VXGBXAGGSA-N 1 0 262.353 3.742 20 5 CHBDRO C[N@H+](CCCNc1sccc1[N+](=O)[O-])C1CCCCC1 ZINC000302001265 1118694704 /nfs/dbraw/zinc/69/47/04/1118694704.db2.gz RYLHHWPOPQZHET-UHFFFAOYSA-N 1 0 297.424 3.723 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](C2CC2)C2CCCCC2)cc1 ZINC000047904771 1118708304 /nfs/dbraw/zinc/70/83/04/1118708304.db2.gz PMWVHEQICHRNNH-UHFFFAOYSA-N 1 0 274.364 3.892 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000178316982 1118758556 /nfs/dbraw/zinc/75/85/56/1118758556.db2.gz GLUFAYXRGBHPLQ-NHYWBVRUSA-N 1 0 274.320 3.990 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580680 1118778278 /nfs/dbraw/zinc/77/82/78/1118778278.db2.gz BTRKVVWQOQEGHJ-NSHDSACASA-N 1 0 289.335 3.501 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC(C)=C[C@H](C)C1 ZINC000430884416 1118783544 /nfs/dbraw/zinc/78/35/44/1118783544.db2.gz WOVIVUADSIDVHU-LIOBOASVSA-N 1 0 286.375 3.896 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](C)C2CC2)cccc1[N+](=O)[O-] ZINC000610805339 1118893341 /nfs/dbraw/zinc/89/33/41/1118893341.db2.gz SCFHXBLEWIONPQ-PWSUYJOCSA-N 1 0 262.353 3.600 20 5 CHBDRO CCC[C@@]1(C)CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001167508869 1118968688 /nfs/dbraw/zinc/96/86/88/1118968688.db2.gz JLUAUGADUSBKOL-INIZCTEOSA-N 1 0 276.380 3.997 20 5 CHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC1 ZINC000127450629 1118988537 /nfs/dbraw/zinc/98/85/37/1118988537.db2.gz MOKWTXBVULZIES-UHFFFAOYSA-N 1 0 286.331 3.839 20 5 CHBDRO CCCC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC001167553345 1119030231 /nfs/dbraw/zinc/03/02/31/1119030231.db2.gz FJERCOVKMCIOIR-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO CC(C)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001167655901 1119301263 /nfs/dbraw/zinc/30/12/63/1119301263.db2.gz CNNJDFCVSFQLTQ-NSHDSACASA-N 1 0 282.771 3.726 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000219701589 1119511444 /nfs/dbraw/zinc/51/14/44/1119511444.db2.gz GCPYBZDXSAHDSB-JSGCOSHPSA-N 1 0 262.353 3.605 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC2(CCC2)C1 ZINC000176928102 1119629802 /nfs/dbraw/zinc/62/98/02/1119629802.db2.gz IJEAVHCJYILOJG-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CC=C(C)C)cc1[N+](=O)[O-] ZINC000188450634 1119748976 /nfs/dbraw/zinc/74/89/76/1119748976.db2.gz ZSADVHAPZIWAJG-GFCCVEGCSA-N 1 0 278.352 3.610 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000466921101 1119819613 /nfs/dbraw/zinc/81/96/13/1119819613.db2.gz ILQYIWABUMYZKQ-OKILXGFUSA-N 1 0 292.379 3.627 20 5 CHBDRO CC[C@@H]([NH2+]CC[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000180266647 1119966545 /nfs/dbraw/zinc/96/65/45/1119966545.db2.gz BGBQBRFHGWCAQR-HZPDHXFCSA-N 1 0 292.379 3.595 20 5 CHBDRO COC1([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000414325757 1119984684 /nfs/dbraw/zinc/98/46/84/1119984684.db2.gz XORIDAMZKSQKNS-QWHCGFSZSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2C[C@H]2c2ccco2)cccc1[N+](=O)[O-] ZINC000414344561 1119991019 /nfs/dbraw/zinc/99/10/19/1119991019.db2.gz RPVFMWBZJNGDON-IACUBPJLSA-N 1 0 286.331 3.703 20 5 CHBDRO CCCC[NH+]1CCC(Nc2ccc(C)cc2[N+](=O)[O-])CC1 ZINC000301453579 1120023424 /nfs/dbraw/zinc/02/34/24/1120023424.db2.gz VKKPCXVNYPNJTC-UHFFFAOYSA-N 1 0 291.395 3.580 20 5 CHBDRO Cc1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000542700462 1120123293 /nfs/dbraw/zinc/12/32/93/1120123293.db2.gz SSPMLYDMOVWPQM-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000062726462 1120206077 /nfs/dbraw/zinc/20/60/77/1120206077.db2.gz DSAKIHNXPSMKRW-ZDUSSCGKSA-N 1 0 290.388 3.940 20 5 CHBDRO CC[C@@H](Nc1cc(C)ccn1)c1cccc([N+](=O)[O-])c1 ZINC000301648289 1120245230 /nfs/dbraw/zinc/24/52/30/1120245230.db2.gz OUEVVJKIIUMHFT-CQSZACIVSA-N 1 0 271.320 3.861 20 5 CHBDRO CCC[C@H]([NH2+][C@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000020085780 1120279734 /nfs/dbraw/zinc/27/97/34/1120279734.db2.gz QUJCZGFIMWSGEE-RISCZKNCSA-N 1 0 250.342 3.824 20 5 CHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]12 ZINC000542974918 1120304597 /nfs/dbraw/zinc/30/45/97/1120304597.db2.gz FWFFUPCSSBJMNE-XYPHTWIQSA-N 1 0 288.391 3.648 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@@H]1CC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000417340140 1120428705 /nfs/dbraw/zinc/42/87/05/1120428705.db2.gz ACKFVKLNWGLSBP-DZGCQCFKSA-N 1 0 274.364 3.826 20 5 CHBDRO CC(F)(F)CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417352907 1120434735 /nfs/dbraw/zinc/43/47/35/1120434735.db2.gz WBRAQCXPNYFKGI-CQSZACIVSA-N 1 0 298.333 3.997 20 5 CHBDRO CC[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000067661163 1120446538 /nfs/dbraw/zinc/44/65/38/1120446538.db2.gz OLUYLVTVCKNXLG-JTQLQIEISA-N 1 0 256.371 3.523 20 5 CHBDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000068592614 1120478730 /nfs/dbraw/zinc/47/87/30/1120478730.db2.gz VUZCAKODVDYGFT-OCCSQVGLSA-N 1 0 292.379 3.662 20 5 CHBDRO CC1(C)CCC[C@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000388951106 1120544679 /nfs/dbraw/zinc/54/46/79/1120544679.db2.gz ABBNFGRCBMHDSK-ZDUSSCGKSA-N 1 0 262.353 3.511 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1cccc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000125519312 1120616035 /nfs/dbraw/zinc/61/60/35/1120616035.db2.gz MDOCNBDJLYUSRH-QGZVFWFLSA-N 1 0 299.374 3.929 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000511855394 1120665661 /nfs/dbraw/zinc/66/56/61/1120665661.db2.gz OAPZQBQDEIWROY-QVDQZQSHSA-N 1 0 286.375 3.873 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)[C@H]1CCCO1 ZINC000090857659 1128934125 /nfs/dbraw/zinc/93/41/25/1128934125.db2.gz WMBLVIVYXIQSGB-DUVNUKRYSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)c(C)o1 ZINC000044729508 1120731742 /nfs/dbraw/zinc/73/17/42/1120731742.db2.gz ASVSTYUGISKSSC-LLVKDONJSA-N 1 0 274.320 3.655 20 5 CHBDRO Cc1c(C[NH2+]C2(C)CCCCC2)cccc1[N+](=O)[O-] ZINC000045045564 1120743877 /nfs/dbraw/zinc/74/38/77/1120743877.db2.gz NMENNEXZBJUCDM-UHFFFAOYSA-N 1 0 262.353 3.716 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000049153294 1120852916 /nfs/dbraw/zinc/85/29/16/1120852916.db2.gz WCCVJIKCVLXJHI-HNNXBMFYSA-N 1 0 290.388 3.940 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000051574550 1120955776 /nfs/dbraw/zinc/95/57/76/1120955776.db2.gz GDWKDZPCNWYEGB-MRXNPFEDSA-N 1 0 285.347 3.539 20 5 CHBDRO CC(C)CC1([NH2+]CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC001174771473 1121024844 /nfs/dbraw/zinc/02/48/44/1121024844.db2.gz RRDWUVREVMIVFT-UHFFFAOYSA-N 1 0 292.379 3.532 20 5 CHBDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccco1 ZINC000569848204 1121025788 /nfs/dbraw/zinc/02/57/88/1121025788.db2.gz OQXPNQXJSSZKEU-LLVKDONJSA-N 1 0 299.330 3.562 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3cc(F)ccc32)cc1 ZINC000133829079 1121045162 /nfs/dbraw/zinc/04/51/62/1121045162.db2.gz UQGRUDRKVFXOIK-INIZCTEOSA-N 1 0 286.306 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)C[C@@H]1CC1(C)C ZINC001174908299 1121086949 /nfs/dbraw/zinc/08/69/49/1121086949.db2.gz ZAACLRWAYGBKJU-OLZOCXBDSA-N 1 0 276.380 3.942 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc2[nH]ccc21)c1cccc([N+](=O)[O-])c1 ZINC000171130823 1121094922 /nfs/dbraw/zinc/09/49/22/1121094922.db2.gz LNHXEJAROKFARE-GFCCVEGCSA-N 1 0 295.342 3.927 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1ccc([N+](=O)[O-])cc1 ZINC000584743913 1121162949 /nfs/dbraw/zinc/16/29/49/1121162949.db2.gz KGSBNCCAYWVKQA-UHFFFAOYSA-N 1 0 250.342 3.605 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000042857658 1121317873 /nfs/dbraw/zinc/31/78/73/1121317873.db2.gz SUOAJIIYZYGFSE-CHWSQXEVSA-N 1 0 262.353 3.511 20 5 CHBDRO CC[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000509535928 1121387856 /nfs/dbraw/zinc/38/78/56/1121387856.db2.gz AEDVNCQHEJFENM-VIIAAUOXSA-N 1 0 274.364 3.730 20 5 CHBDRO CC(C)(C)C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000512527217 1121408763 /nfs/dbraw/zinc/40/87/63/1121408763.db2.gz PBJLLLJDDBXYKT-UHFFFAOYSA-N 1 0 282.409 3.914 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000708505702 1121468458 /nfs/dbraw/zinc/46/84/58/1121468458.db2.gz ZVLURCZGZOHWCV-GFCCVEGCSA-N 1 0 280.343 3.746 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000512622156 1121495299 /nfs/dbraw/zinc/49/52/99/1121495299.db2.gz JRJCEUDGROMYBL-OAHLLOKOSA-N 1 0 274.364 3.668 20 5 CHBDRO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000543628694 1121535034 /nfs/dbraw/zinc/53/50/34/1121535034.db2.gz WFKTWDCVAMXVLX-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)CCc1ccccc1 ZINC000543630264 1121535468 /nfs/dbraw/zinc/53/54/68/1121535468.db2.gz KAUNNJZRQATDJU-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC12CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000429442609 1121586763 /nfs/dbraw/zinc/58/67/63/1121586763.db2.gz LOBDIOQJDHDAIZ-WFASDCNBSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@@H]1C[C@@H]1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433161402 1121598957 /nfs/dbraw/zinc/59/89/57/1121598957.db2.gz RGMOXPFYIXQSRN-HFAKWTLXSA-N 1 0 274.364 3.563 20 5 CHBDRO CC(C)CC[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000611254179 1121631797 /nfs/dbraw/zinc/63/17/97/1121631797.db2.gz HBDHMYUXORMLBU-VURMDHGXSA-N 1 0 262.353 3.586 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000611248317 1121631967 /nfs/dbraw/zinc/63/19/67/1121631967.db2.gz RSHNUAPFPTZGIL-NEPJUHHUSA-N 1 0 280.368 3.833 20 5 CHBDRO CSC[C@@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433263786 1121632488 /nfs/dbraw/zinc/63/24/88/1121632488.db2.gz WXCAFJWKTNGPRB-YGRLFVJLSA-N 1 0 294.420 3.658 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000611293074 1121635448 /nfs/dbraw/zinc/63/54/48/1121635448.db2.gz AEOMFMCUDYEGIZ-HZRUHFOJSA-N 1 0 297.358 3.662 20 5 CHBDRO CC1(C)C[C@@H]1[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000611468904 1121650234 /nfs/dbraw/zinc/65/02/34/1121650234.db2.gz GROPBOVEGBPPGK-XPKDYRNWSA-N 1 0 288.391 3.694 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCc2ccccc21 ZINC000611549039 1121654953 /nfs/dbraw/zinc/65/49/53/1121654953.db2.gz KVGJFCPTDAXCGL-OAHLLOKOSA-N 1 0 296.370 3.757 20 5 CHBDRO Cc1ccc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000544186768 1121683719 /nfs/dbraw/zinc/68/37/19/1121683719.db2.gz IYGSHXZHDCPYJP-QGZVFWFLSA-N 1 0 296.370 3.893 20 5 CHBDRO CC[C@@H]([NH2+]CCC=C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000397750003 1121695423 /nfs/dbraw/zinc/69/54/23/1121695423.db2.gz FMKYSLOUVHTVBB-OAHLLOKOSA-N 1 0 262.353 3.992 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCc1cccs1 ZINC001177082087 1121709227 /nfs/dbraw/zinc/70/92/27/1121709227.db2.gz WBJIPLJPDNUEAS-UHFFFAOYSA-N 1 0 290.388 3.605 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC001178425410 1121788172 /nfs/dbraw/zinc/78/81/72/1121788172.db2.gz AGSUYEARZUZODX-LBPRGKRZSA-N 1 0 276.380 3.996 20 5 CHBDRO CC[C@H]1CCC[C@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC001178748967 1121810842 /nfs/dbraw/zinc/81/08/42/1121810842.db2.gz XYFLQBMXYSUQKW-ZFWWWQNUSA-N 1 0 276.380 3.819 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC001178748966 1121811453 /nfs/dbraw/zinc/81/14/53/1121811453.db2.gz XYFLQBMXYSUQKW-UKRRQHHQSA-N 1 0 276.380 3.819 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000037775710 1129014289 /nfs/dbraw/zinc/01/42/89/1129014289.db2.gz IEYDXLSMNXNLEF-QWHCGFSZSA-N 1 0 260.337 3.602 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc2[nH]ccc21)c1ccc([N+](=O)[O-])cc1 ZINC001179574870 1121889740 /nfs/dbraw/zinc/88/97/40/1121889740.db2.gz GZNHBLLVRXKEKU-GFCCVEGCSA-N 1 0 295.342 3.927 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)oc1C ZINC000502412032 1122081228 /nfs/dbraw/zinc/08/12/28/1122081228.db2.gz BKRFXWFKRIYXHF-GFCCVEGCSA-N 1 0 288.347 3.698 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC1CCC1)CCC2 ZINC000774260976 1122148554 /nfs/dbraw/zinc/14/85/54/1122148554.db2.gz UZAIGQDZWWTBIM-MRXNPFEDSA-N 1 0 274.364 3.752 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCC1CCC1)CCC2 ZINC000774260975 1122148657 /nfs/dbraw/zinc/14/86/57/1122148657.db2.gz UZAIGQDZWWTBIM-INIZCTEOSA-N 1 0 274.364 3.752 20 5 CHBDRO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)CC1CCCCC1 ZINC000515040025 1122472690 /nfs/dbraw/zinc/47/26/90/1122472690.db2.gz QAZFNKRPHVSRHB-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO CCCC[N@H+](CC)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000505908657 1122598617 /nfs/dbraw/zinc/59/86/17/1122598617.db2.gz ZJPIVEFDDLFJSA-NTMALXAHSA-N 1 0 262.353 3.730 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000437046230 1122606833 /nfs/dbraw/zinc/60/68/33/1122606833.db2.gz MNNOSFZGSPDCKJ-WCFLWFBJSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000516558729 1122611197 /nfs/dbraw/zinc/61/11/97/1122611197.db2.gz DGGZWXNVNYJHMI-VXGBXAGGSA-N 1 0 298.333 3.941 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc(C(F)(F)F)c1Cl ZINC001225889432 1122623588 /nfs/dbraw/zinc/62/35/88/1122623588.db2.gz VXEZBFCANKHPGU-VIFPVBQESA-N 1 0 296.740 3.832 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000438338896 1122692105 /nfs/dbraw/zinc/69/21/05/1122692105.db2.gz LXTRFVYZSCOOCP-LBPRGKRZSA-N 1 0 268.382 3.524 20 5 CHBDRO Cc1ccc(C[N@H+](C)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000506371346 1122726113 /nfs/dbraw/zinc/72/61/13/1122726113.db2.gz VBNGULGVMQKDFV-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC001194426143 1122775549 /nfs/dbraw/zinc/77/55/49/1122775549.db2.gz JPWXROAKOKHMKF-AWEZNQCLSA-N 1 0 264.369 3.899 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2c2cccs2)c1 ZINC000015301339 1122800812 /nfs/dbraw/zinc/80/08/12/1122800812.db2.gz PNJTZRKGMVUFIE-AWEZNQCLSA-N 1 0 288.372 3.993 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001195808818 1122890275 /nfs/dbraw/zinc/89/02/75/1122890275.db2.gz CTNOQHCNJUICHA-CQSZACIVSA-N 1 0 296.370 3.757 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000507170377 1122934613 /nfs/dbraw/zinc/93/46/13/1122934613.db2.gz MXJUQFFOCSILQO-AWEZNQCLSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000507230727 1122939818 /nfs/dbraw/zinc/93/98/18/1122939818.db2.gz KPALTIPKDNRSJN-UHFFFAOYSA-N 1 0 286.331 3.839 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000086887710 1122945217 /nfs/dbraw/zinc/94/52/17/1122945217.db2.gz KNAFOQAXNSFZEI-OCCSQVGLSA-N 1 0 262.353 3.653 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000438338895 1122962526 /nfs/dbraw/zinc/96/25/26/1122962526.db2.gz LXTRFVYZSCOOCP-GFCCVEGCSA-N 1 0 268.382 3.524 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H]2CCCCC2(F)F)c1 ZINC000294164121 1123075804 /nfs/dbraw/zinc/07/58/04/1123075804.db2.gz IRQSWETVGXACQB-GFCCVEGCSA-N 1 0 284.306 3.510 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H]1CCC[C@H]1C ZINC001202134220 1123177129 /nfs/dbraw/zinc/17/71/29/1123177129.db2.gz CQMNACXMKQUVDS-RISCZKNCSA-N 1 0 276.380 3.737 20 5 CHBDRO CC[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000129579443 1123187381 /nfs/dbraw/zinc/18/73/81/1123187381.db2.gz YEPJEISSPPCHLD-GZBFAFLISA-N 1 0 276.380 3.694 20 5 CHBDRO CC[C@H]([NH2+]CCC1(OC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000294483277 1123193519 /nfs/dbraw/zinc/19/35/19/1123193519.db2.gz HKDLJOJEPHETKQ-HNNXBMFYSA-N 1 0 292.379 3.595 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC001202356885 1123201803 /nfs/dbraw/zinc/20/18/03/1123201803.db2.gz MIGPQQXIIUQUMB-OAHLLOKOSA-N 1 0 276.380 3.996 20 5 CHBDRO CCOC1CCC([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000850470887 1123271945 /nfs/dbraw/zinc/27/19/45/1123271945.db2.gz IFPXVJRLQCDXJY-YGONEPDPSA-N 1 0 292.379 3.593 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@H]2C=CCC2)c2cc([N+](=O)[O-])ccc21 ZINC000850506903 1123277117 /nfs/dbraw/zinc/27/71/17/1123277117.db2.gz CHAARMJDXFNILG-NHYWBVRUSA-N 1 0 272.348 3.625 20 5 CHBDRO C=C/C=C/CC[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000713456115 1123294932 /nfs/dbraw/zinc/29/49/32/1123294932.db2.gz LWBZOZXPZLKSDZ-LLYBFZRZSA-N 1 0 260.337 3.768 20 5 CHBDRO C[C@H](CC1CCC1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000129622984 1123458484 /nfs/dbraw/zinc/45/84/84/1123458484.db2.gz ZIGQCKDPBIQSDG-NEPJUHHUSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]CC[C@H]2CCCC2(F)F)cc1 ZINC000895546056 1123491113 /nfs/dbraw/zinc/49/11/13/1123491113.db2.gz YBLDZFZUSJLIBT-CYBMUJFWSA-N 1 0 298.333 3.552 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]CC[C@@H]2CCCC2(F)F)cc1 ZINC000895546057 1123491308 /nfs/dbraw/zinc/49/13/08/1123491308.db2.gz YBLDZFZUSJLIBT-ZDUSSCGKSA-N 1 0 298.333 3.552 20 5 CHBDRO C[N@H+](CCCCNc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000840316909 1123526741 /nfs/dbraw/zinc/52/67/41/1123526741.db2.gz UVIQEYMMUFGVJC-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C1(C)CC1 ZINC000776883486 1123557391 /nfs/dbraw/zinc/55/73/91/1123557391.db2.gz YWWRBXZRHGQUOT-QWHCGFSZSA-N 1 0 276.380 3.694 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)C2(C)CC2)cccc1[N+](=O)[O-] ZINC000776884041 1123559695 /nfs/dbraw/zinc/55/96/95/1123559695.db2.gz WMQMJWSFUVTDAH-NEPJUHHUSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)C2(C)CC2)cccc1[N+](=O)[O-] ZINC000776884043 1123559935 /nfs/dbraw/zinc/55/99/35/1123559935.db2.gz WMQMJWSFUVTDAH-RYUDHWBXSA-N 1 0 262.353 3.742 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000776884013 1123559979 /nfs/dbraw/zinc/55/99/79/1123559979.db2.gz VRHCGPQFWREJRM-NWDGAFQWSA-N 1 0 292.379 3.833 20 5 CHBDRO C[C@H](O)CC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000114771060 1123578783 /nfs/dbraw/zinc/57/87/83/1123578783.db2.gz NZWCKTIGOOQKMQ-AWEZNQCLSA-N 1 0 279.383 3.854 20 5 CHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000542631651 1129138946 /nfs/dbraw/zinc/13/89/46/1129138946.db2.gz HRMJHSREPIRWOJ-AWEZNQCLSA-N 1 0 262.353 3.749 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1(C(F)F)CC1 ZINC000475211635 1123824632 /nfs/dbraw/zinc/82/46/32/1123824632.db2.gz AIQHJPJGPOXWFI-LLVKDONJSA-N 1 0 298.333 3.551 20 5 CHBDRO CC1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCCC1 ZINC000084440132 1129153206 /nfs/dbraw/zinc/15/32/06/1129153206.db2.gz ZKONYYZOJLHSNT-UHFFFAOYSA-N 1 0 282.771 3.918 20 5 CHBDRO C[C@H](Cc1ccco1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783596564 1124006605 /nfs/dbraw/zinc/00/66/05/1124006605.db2.gz WHOQSEJSYLNWOV-SNVBAGLBSA-N 1 0 294.738 3.562 20 5 CHBDRO C[C@@H](Cc1ccco1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783596561 1124006760 /nfs/dbraw/zinc/00/67/60/1124006760.db2.gz WHOQSEJSYLNWOV-JTQLQIEISA-N 1 0 294.738 3.562 20 5 CHBDRO COc1ccc(C[NH2+]C2[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000237324402 1124030370 /nfs/dbraw/zinc/03/03/70/1124030370.db2.gz GXDWPEVLTWQOJX-VXGBXAGGSA-N 1 0 292.379 3.518 20 5 CHBDRO C[C@H]1CCCCC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000088508032 1124061431 /nfs/dbraw/zinc/06/14/31/1124061431.db2.gz RMDGVAWKMVALRE-GXTWGEPZSA-N 1 0 262.353 3.653 20 5 CHBDRO CCCCC[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000034995162 1124110264 /nfs/dbraw/zinc/11/02/64/1124110264.db2.gz WFZUGYGDCONDRD-ZDUSSCGKSA-N 1 0 264.369 3.962 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCCC12CCC2 ZINC000446837113 1124124867 /nfs/dbraw/zinc/12/48/67/1124124867.db2.gz XWSIYIVAAPHCKV-CLTKARDFSA-N 1 0 272.348 3.627 20 5 CHBDRO C[C@@H]1Cc2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000525637703 1124451182 /nfs/dbraw/zinc/45/11/82/1124451182.db2.gz ZEELYSGWZMDDDP-CQSZACIVSA-N 1 0 296.370 3.584 20 5 CHBDRO CSCC[C@H](C)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038752 1124663544 /nfs/dbraw/zinc/66/35/44/1124663544.db2.gz PUZDBZRNZHSLHW-UWVGGRQHSA-N 1 0 286.372 3.526 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1(C2CC2)CC1 ZINC000872054875 1124667572 /nfs/dbraw/zinc/66/75/72/1124667572.db2.gz CPAGVXGKPTZRGZ-SNVBAGLBSA-N 1 0 292.404 3.910 20 5 CHBDRO CC(C)OCCCC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872061433 1124670529 /nfs/dbraw/zinc/67/05/29/1124670529.db2.gz YOFNHTJWQXECHF-GFCCVEGCSA-N 1 0 298.358 3.590 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])C1CC1 ZINC000872084070 1124678209 /nfs/dbraw/zinc/67/82/09/1124678209.db2.gz DJQZGFYNQVBNLU-JOYOIKCWSA-N 1 0 266.316 3.573 20 5 CHBDRO C[C@H](CCC(F)(F)F)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129515 1124690371 /nfs/dbraw/zinc/69/03/71/1124690371.db2.gz GSUZQAHKFKCUCU-NXEZZACHSA-N 1 0 290.285 3.976 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449445457 1124740175 /nfs/dbraw/zinc/74/01/75/1124740175.db2.gz IORVIKHKOPBJJV-NSHDSACASA-N 1 0 286.331 3.743 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC[C@@]1(C)CC1(F)F ZINC000873138649 1124740900 /nfs/dbraw/zinc/74/09/00/1124740900.db2.gz UZUJKEPTFQURPK-AWEZNQCLSA-N 1 0 298.333 3.737 20 5 CHBDRO CC(C)OC1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000531164909 1125198449 /nfs/dbraw/zinc/19/84/49/1125198449.db2.gz ZDWNISFTXHVSEZ-CYBMUJFWSA-N 1 0 292.379 3.545 20 5 CHBDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000532195801 1125239309 /nfs/dbraw/zinc/23/93/09/1125239309.db2.gz HNDVDQFBYMJXAU-ZDUSSCGKSA-N 1 0 288.347 3.698 20 5 CHBDRO CCN(CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1F ZINC000610476350 1125349215 /nfs/dbraw/zinc/34/92/15/1125349215.db2.gz TZMGLRVWFNOMOI-UHFFFAOYSA-N 1 0 294.248 3.508 20 5 CHBDRO C[C@@H](c1ccccc1F)N(C)Cc1cccc([N+](=O)[O-])c1 ZINC000052074205 1125374348 /nfs/dbraw/zinc/37/43/48/1125374348.db2.gz RZFSRSWKCIPPQT-LBPRGKRZSA-N 1 0 288.322 3.927 20 5 CHBDRO C[C@@H]([NH2+]CC(C)(C)CC(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000883258859 1125386621 /nfs/dbraw/zinc/38/66/21/1125386621.db2.gz RLPAIGKWFSDWFP-SNVBAGLBSA-N 1 0 286.322 3.927 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C1CCCCC1)C1CC1 ZINC000532441681 1125386646 /nfs/dbraw/zinc/38/66/46/1125386646.db2.gz RFLUFRLGTCKBGH-MRXNPFEDSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1csc([N+](=O)[O-])c1)C(C)(C)C ZINC000532488981 1125406798 /nfs/dbraw/zinc/40/67/98/1125406798.db2.gz AVJLMPJRIBCWLN-SECBINFHSA-N 1 0 256.371 3.523 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000132295307 1125416592 /nfs/dbraw/zinc/41/65/92/1125416592.db2.gz PHDIHARCTRFUBU-BXKDBHETSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@H](C[NH2+][C@@H]1CC[C@@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000897461635 1125424061 /nfs/dbraw/zinc/42/40/61/1125424061.db2.gz UIMWOWFRCIIEHO-JHJVBQTASA-N 1 0 294.420 3.572 20 5 CHBDRO C[C@@H](C[NH2+]Cc1ccsc1)c1ccccc1[N+](=O)[O-] ZINC000897469569 1125433342 /nfs/dbraw/zinc/43/33/42/1125433342.db2.gz MPTDSDFLZRKEED-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO C[C@@H](NCc1ncc(Cl)s1)c1ccc([N+](=O)[O-])cc1 ZINC000719430430 1129332536 /nfs/dbraw/zinc/33/25/36/1129332536.db2.gz OCSHGJBYTMWYSV-MRVPVSSYSA-N 1 0 297.767 3.556 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC2(CCCC2)CC1 ZINC000738341542 1129391440 /nfs/dbraw/zinc/39/14/40/1129391440.db2.gz SDKSIJRSYMVGAE-UHFFFAOYSA-N 1 0 292.354 3.890 20 5 CHBDRO CCCCCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000740874755 1129421686 /nfs/dbraw/zinc/42/16/86/1129421686.db2.gz GQYZQGNIHFSUIB-UHFFFAOYSA-N 1 0 250.342 3.607 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000094325164 1129442986 /nfs/dbraw/zinc/44/29/86/1129442986.db2.gz WPAYWBQSQWNUPS-AWEZNQCLSA-N 1 0 280.343 3.792 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000094772895 1129451619 /nfs/dbraw/zinc/45/16/19/1129451619.db2.gz HPGYRVLPBJKSRT-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)s1 ZINC000094773507 1129451646 /nfs/dbraw/zinc/45/16/46/1129451646.db2.gz YJDSIVRYWGAFJN-JTQLQIEISA-N 1 0 294.351 3.955 20 5 CHBDRO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000094774218 1129451690 /nfs/dbraw/zinc/45/16/90/1129451690.db2.gz FSURGGHNQMWUKY-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]1C ZINC000094773109 1129451755 /nfs/dbraw/zinc/45/17/55/1129451755.db2.gz VJZVKMFTMJWIEU-GYSYKLTISA-N 1 0 280.343 3.648 20 5 CHBDRO CC[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774232 1129451915 /nfs/dbraw/zinc/45/19/15/1129451915.db2.gz SBUMGANOESLVIA-UHFFFAOYSA-N 1 0 288.322 3.756 20 5 CHBDRO Cc1cscc1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000094881111 1129454676 /nfs/dbraw/zinc/45/46/76/1129454676.db2.gz NAVUAILQFZIREE-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO Cc1cccc(F)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000746048632 1129623676 /nfs/dbraw/zinc/62/36/76/1129623676.db2.gz CXKQCHJWPMDSOD-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168976686 1129686587 /nfs/dbraw/zinc/68/65/87/1129686587.db2.gz FBEDHCMVGMYSBR-IMJJTQAJSA-N 1 0 276.380 3.563 20 5 CHBDRO CC(C)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(Cl)c1 ZINC001168981219 1129687169 /nfs/dbraw/zinc/68/71/69/1129687169.db2.gz GUOMMXJGYUODBL-BXUZGUMPSA-N 1 0 296.798 3.610 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168985904 1129687652 /nfs/dbraw/zinc/68/76/52/1129687652.db2.gz VQJALAFOUIXEFT-KCXAZCMYSA-N 1 0 294.370 3.702 20 5 CHBDRO CC(C)C[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168971399 1129688469 /nfs/dbraw/zinc/68/84/69/1129688469.db2.gz KDUQFNSANIUTIV-OIISXLGYSA-N 1 0 290.407 3.809 20 5 CHBDRO CC[C@H](C)C1CCC([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168988874 1129690149 /nfs/dbraw/zinc/69/01/49/1129690149.db2.gz ULVMCDWQWICQCX-AOTHYSKPSA-N 1 0 282.428 3.626 20 5 CHBDRO C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C1CCC(C(C)(C)C)CC1 ZINC001169036356 1129690437 /nfs/dbraw/zinc/69/04/37/1129690437.db2.gz FRBHNRGECUFPBK-PRLABOORSA-N 1 0 296.455 3.969 20 5 CHBDRO C[N@H+](Cc1ccc2ccccc2c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046785 1129691257 /nfs/dbraw/zinc/69/12/57/1129691257.db2.gz NANWOJCGYNPXLE-CRAIPNDOSA-N 1 0 298.386 3.717 20 5 CHBDRO CC1([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC(F)(F)C1 ZINC000720911117 1129719421 /nfs/dbraw/zinc/71/94/21/1129719421.db2.gz FJXCSOFYQKXFNU-UHFFFAOYSA-N 1 0 290.697 3.526 20 5 CHBDRO CC(C)C1(C)CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC001169506859 1129731211 /nfs/dbraw/zinc/73/12/11/1129731211.db2.gz FALACWFRIUZRKQ-UHFFFAOYSA-N 1 0 294.370 3.992 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCC[C@H]3C[C@H]32)c1 ZINC000800890599 1129896713 /nfs/dbraw/zinc/89/67/13/1129896713.db2.gz WLOLQWQPUGMNMF-BHYNMZESSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC(C)(C)C1 ZINC000801539450 1129925626 /nfs/dbraw/zinc/92/56/26/1129925626.db2.gz GWQNJRWLHCYDQU-LLVKDONJSA-N 1 0 280.343 3.602 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCC23CCC3)c1 ZINC000770004352 1129935323 /nfs/dbraw/zinc/93/53/23/1129935323.db2.gz VAOHHGWEWYAYKC-UHFFFAOYSA-N 1 0 280.755 3.767 20 5 CHBDRO CNc1ccc(C)cc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000902522310 1130019196 /nfs/dbraw/zinc/01/91/96/1130019196.db2.gz BDDRCCUHHKCKSZ-UHFFFAOYSA-N 1 0 299.374 3.543 20 5 CHBDRO CNc1ccccc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000902574876 1130027479 /nfs/dbraw/zinc/02/74/79/1130027479.db2.gz NCWRSNAUAQJVRP-UHFFFAOYSA-N 1 0 299.374 3.661 20 5 CHBDRO CCO[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000902766424 1130054815 /nfs/dbraw/zinc/05/48/15/1130054815.db2.gz KFRIQZXXPZBBDL-XNRPHZJLSA-N 1 0 292.379 3.593 20 5 CHBDRO CCO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000902766423 1130054037 /nfs/dbraw/zinc/05/40/37/1130054037.db2.gz KFRIQZXXPZBBDL-JGGQBBKZSA-N 1 0 292.379 3.593 20 5 CHBDRO COC1(C[C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000903288321 1130146937 /nfs/dbraw/zinc/14/69/37/1130146937.db2.gz XMZQPLYMCLUMAU-CHWSQXEVSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H]21)c1c(F)cccc1[N+](=O)[O-] ZINC000903318551 1130153147 /nfs/dbraw/zinc/15/31/47/1130153147.db2.gz QGHNSNOIDSAJAL-SRRSOLGSSA-N 1 0 278.327 3.573 20 5 CHBDRO CC(C)CC[C@@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788498164 1130191403 /nfs/dbraw/zinc/19/14/03/1130191403.db2.gz LKYSKPIMIWMVCR-VXGBXAGGSA-N 1 0 279.384 3.652 20 5 CHBDRO C[C@H]1C[NH2+]CCN1Cc1c2ccccc2cc2ccccc21 ZINC001235362961 1130737852 /nfs/dbraw/zinc/73/78/52/1130737852.db2.gz SWEOIPXXOVRPTP-HNNXBMFYSA-N 1 0 290.410 3.787 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+](CC2CC2)CC2CC2)cc1Cl ZINC000783569136 1130839415 /nfs/dbraw/zinc/83/94/15/1130839415.db2.gz CNTNSHUWNCQRKL-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO CC[C@@]1(C)CC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783573913 1130839877 /nfs/dbraw/zinc/83/98/77/1130839877.db2.gz MYWKFHSUAPDFPR-AWEZNQCLSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000217235693 1130922465 /nfs/dbraw/zinc/92/24/65/1130922465.db2.gz RKFZUTYUIVUFST-XUJVJEKNSA-N 1 0 292.354 3.887 20 5 CHBDRO C[C@@H]([NH2+]C[C@H](C)C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815581014 1131002842 /nfs/dbraw/zinc/00/28/42/1131002842.db2.gz VNZZQLRFENIEHN-WDEREUQCSA-N 1 0 279.384 3.510 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000815584268 1131003730 /nfs/dbraw/zinc/00/37/30/1131003730.db2.gz ZHQPIKZOAMREKH-NEPJUHHUSA-N 1 0 291.395 3.796 20 5 CHBDRO C[C@@H]([NH3+])CCNc1nc2ccccc2c2ccccc21 ZINC001170894492 1131204482 /nfs/dbraw/zinc/20/44/82/1131204482.db2.gz IIWRCFVEHFZIKB-GFCCVEGCSA-N 1 0 265.360 3.537 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C2CC3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC001118493301 1131229919 /nfs/dbraw/zinc/22/99/19/1131229919.db2.gz RUGRIDZZSLVLNP-IFQILLTASA-N 1 0 296.317 3.742 20 5 CHBDRO CC[C@H](C)c1ccccc1O[C@@H](C)C[N+](C)(C)C ZINC001227760408 1131739202 /nfs/dbraw/zinc/73/92/02/1131739202.db2.gz RHXBZBQIHDYSMI-KBPBESRZSA-N 1 0 250.406 3.674 20 5 CHBDRO CCc1ccc2cc(O[C@H](C)C[N+](C)(C)C)ccc2c1 ZINC001228044468 1131795743 /nfs/dbraw/zinc/79/57/43/1131795743.db2.gz KEVZRXJABKJYGY-CQSZACIVSA-N 1 0 272.412 3.876 20 5 CHBDRO C[N@@H+]1CCC[C@@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001228175680 1131823962 /nfs/dbraw/zinc/82/39/62/1131823962.db2.gz GJABSLZTRKUJDV-MRXNPFEDSA-N 1 0 292.382 3.861 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CCC2CCC2)cc1[N+](=O)[O-] ZINC000773037407 1131924906 /nfs/dbraw/zinc/92/49/06/1131924906.db2.gz UYLQHBQLYYINFT-LBPRGKRZSA-N 1 0 292.379 3.834 20 5 CHBDRO CCOc1cc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC001171381481 1131942827 /nfs/dbraw/zinc/94/28/27/1131942827.db2.gz MEDADSJNLAATHD-CHWSQXEVSA-N 1 0 292.379 3.614 20 5 CHBDRO CC(C)C1CC([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000714734609 1131976035 /nfs/dbraw/zinc/97/60/35/1131976035.db2.gz IPLKBRDDGVZDGS-UHFFFAOYSA-N 1 0 282.771 3.772 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)c1cccc(O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000037150782 1132002993 /nfs/dbraw/zinc/00/29/93/1132002993.db2.gz CWRNCZCYWZLQNP-VXGBXAGGSA-N 1 0 286.331 3.712 20 5 CHBDRO OCCC1C[NH+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000839140127 1132184127 /nfs/dbraw/zinc/18/41/27/1132184127.db2.gz JWOMMQLZUPKIKN-UHFFFAOYSA-N 1 0 291.394 3.807 20 5 CHBDRO C[C@H]([NH2+]C1(C2CCC2)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000840812294 1132291076 /nfs/dbraw/zinc/29/10/76/1132291076.db2.gz XZPCPRAVXIEROL-NSHDSACASA-N 1 0 289.379 3.550 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900806 1132347378 /nfs/dbraw/zinc/34/73/78/1132347378.db2.gz FXJYSRUOBZFIJH-BBRMVZONSA-N 1 0 290.407 3.866 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CC=CCC1)CC2 ZINC001172906085 1132348804 /nfs/dbraw/zinc/34/88/04/1132348804.db2.gz WKWJSZKYFLOERP-JKSUJKDBSA-N 1 0 286.375 3.541 20 5 CHBDRO CCC(CC)[N@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172920989 1132362159 /nfs/dbraw/zinc/36/21/59/1132362159.db2.gz NGGWUMRTWLJPMZ-INIZCTEOSA-N 1 0 290.407 3.963 20 5 CHBDRO CC[C@@H]1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172913018 1132371936 /nfs/dbraw/zinc/37/19/36/1132371936.db2.gz OGTPLPJZIRFFDK-CZUORRHYSA-N 1 0 288.391 3.574 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173219220 1132411914 /nfs/dbraw/zinc/41/19/14/1132411914.db2.gz ZFGLZXMSHULSNM-QWHCGFSZSA-N 1 0 264.369 3.550 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC(C)(C)C ZINC001173227253 1132412646 /nfs/dbraw/zinc/41/26/46/1132412646.db2.gz OYBXFHUPMXBJAG-GFCCVEGCSA-N 1 0 264.369 3.504 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C)(C)CC1 ZINC001173225643 1132412650 /nfs/dbraw/zinc/41/26/50/1132412650.db2.gz FBCGJAKDWFQARU-ZDUSSCGKSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCCCCCC1 ZINC001173233314 1132413667 /nfs/dbraw/zinc/41/36/67/1132413667.db2.gz KSMFMWVYZXBVNF-AWEZNQCLSA-N 1 0 276.380 3.792 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC2(C1)CCCCC2 ZINC001173232405 1132413925 /nfs/dbraw/zinc/41/39/25/1132413925.db2.gz FUZGEQBMGBKMEY-AWEZNQCLSA-N 1 0 288.391 3.792 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001173214585 1132416611 /nfs/dbraw/zinc/41/66/11/1132416611.db2.gz PLUWCNOCEHVOMI-UONOGXRCSA-N 1 0 284.359 3.877 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C[NH+]3C4CCC3CC4)nc12 ZINC001232223171 1132438276 /nfs/dbraw/zinc/43/82/76/1132438276.db2.gz LBKWEABIUJXIFZ-UHFFFAOYSA-N 1 0 289.382 3.910 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2cccc3c2C[NH2+]C3)c(Cl)c1 ZINC001159766391 1132904986 /nfs/dbraw/zinc/90/49/86/1132904986.db2.gz KKWDXYZTEXEEEB-UHFFFAOYSA-N 1 0 289.722 3.595 20 5 CHBDRO C1=C(Nc2c3ccccc3cc3ccccc32)C[NH2+]C1 ZINC001160243453 1132950821 /nfs/dbraw/zinc/95/08/21/1132950821.db2.gz OVRDTZOPRNUESK-UHFFFAOYSA-N 1 0 260.340 3.892 20 5 CHBDRO CC(C)[PH+](CCNc1cc([N+](=O)[O-])ccn1)C(C)C ZINC001162359417 1133072323 /nfs/dbraw/zinc/07/23/23/1133072323.db2.gz ZZSQYQODBOVGKI-UHFFFAOYSA-N 1 0 283.312 3.700 20 5 CHBDRO Cc1cccc([N+](=O)[O-])c1-n1ccc2cc([C@H](C)[NH3+])ccc21 ZINC001162909821 1133121967 /nfs/dbraw/zinc/12/19/67/1133121967.db2.gz OJRCTTSOSDSAPM-LBPRGKRZSA-N 1 0 295.342 3.867 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCCc1cccc(O)c1 ZINC001163702819 1133166692 /nfs/dbraw/zinc/16/66/92/1133166692.db2.gz GDQZYPPBJXRXKL-UHFFFAOYSA-O 1 0 299.438 3.643 20 5 CHBDRO CC1(C)C(C)(C)C1(C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC001203944281 1133388780 /nfs/dbraw/zinc/38/87/80/1133388780.db2.gz JKMLSONHSFKMCX-UHFFFAOYSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@H](C3CC3)[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001205875830 1133625577 /nfs/dbraw/zinc/62/55/77/1133625577.db2.gz PNHOAPBNFIKFGD-NVXWUHKLSA-N 1 0 286.375 3.524 20 5 CHBDRO Cn1c[nH+]cc1Nc1ccc2nc3ccccc3cc2c1 ZINC001211252061 1134400056 /nfs/dbraw/zinc/40/00/56/1134400056.db2.gz XQVSYEQWRLKVKW-UHFFFAOYSA-N 1 0 274.327 3.865 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000403400009 1134770403 /nfs/dbraw/zinc/77/04/03/1134770403.db2.gz RYBZMAHDPHWNSY-MXYBEHONSA-N 1 0 274.364 3.682 20 5 CHBDRO C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000308717564 1134977570 /nfs/dbraw/zinc/97/75/70/1134977570.db2.gz YHJNOFPGDSLTKO-DOMZBBRYSA-N 1 0 262.353 3.653 20 5 CHBDRO Oc1c2ccccc2c(OC2CC[NH2+]CC2)c2ccccc12 ZINC001217964305 1135032492 /nfs/dbraw/zinc/03/24/92/1135032492.db2.gz SKAFMLUAKIDUIK-UHFFFAOYSA-N 1 0 293.366 3.829 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@@H]3CCCC[NH2+]C3)cc2c1 ZINC001217969750 1135033798 /nfs/dbraw/zinc/03/37/98/1135033798.db2.gz CCIVSMCKXDKJGH-MRXNPFEDSA-N 1 0 292.382 3.909 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000316526956 1135167218 /nfs/dbraw/zinc/16/72/18/1135167218.db2.gz ZGEZSPWKQSPIRO-APPDUMDISA-N 1 0 297.358 3.515 20 5 CHBDRO CC(C)[N@@H+]1CCC[C@@H](O[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC001223428018 1135344359 /nfs/dbraw/zinc/34/43/59/1135344359.db2.gz YSSXLPJBVAOMDR-XJKSGUPXSA-N 1 0 292.379 3.545 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H](OCCC[N+](C)(C)C)CC1 ZINC001224622532 1135462290 /nfs/dbraw/zinc/46/22/90/1135462290.db2.gz HVBIZGQYWCQRBZ-SHTZXODSSA-N 1 0 256.454 3.704 20 5 CHBDRO CC(C)C[C@H](Cc1ccccc1)OCCC[N+](C)(C)C ZINC001224621755 1135462746 /nfs/dbraw/zinc/46/27/46/1135462746.db2.gz CUFFQNAXUKWYRB-GOSISDBHSA-N 1 0 278.460 3.757 20 5 CHBDRO O=[N+]([O-])c1ccc([C@H](Oc2ccncc2)C(F)(F)F)cc1 ZINC001225294356 1135536723 /nfs/dbraw/zinc/53/67/23/1135536723.db2.gz HSFSMBAXTRZESU-LBPRGKRZSA-N 1 0 298.220 3.672 20 5 CHBDRO CC(=O)c1ccc2ccccc2c1O[C@H](C)C[N+](C)(C)C ZINC001226031507 1135654739 /nfs/dbraw/zinc/65/47/39/1135654739.db2.gz WECPOCMMBMIWIT-CYBMUJFWSA-N 1 0 286.395 3.516 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc(Oc2ccccc2)c1 ZINC001226877124 1135753883 /nfs/dbraw/zinc/75/38/83/1135753883.db2.gz FEQFCKSZIJCDIA-HNNXBMFYSA-N 1 0 286.395 3.952 20 5 CHBDRO CC(F)(F)CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000574417896 335018488 /nfs/dbraw/zinc/01/84/88/335018488.db2.gz KDRGETIAYUJFKO-UHFFFAOYSA-N 1 0 296.273 3.600 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000020130154 171018884 /nfs/dbraw/zinc/01/88/84/171018884.db2.gz DSTRSRNUSFCSNX-SJCJKPOMSA-N 1 0 282.343 3.933 20 5 CHBDRO C[C@H]([NH2+]CCc1cccs1)c1ccccc1[N+](=O)[O-] ZINC000020526072 171239016 /nfs/dbraw/zinc/23/90/16/171239016.db2.gz UXWMITGHUFRFSO-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO CCC[C@H]([NH2+]CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000021011425 171287333 /nfs/dbraw/zinc/28/73/33/171287333.db2.gz OIMHTHNFSDLRCK-AWEZNQCLSA-N 1 0 250.342 3.682 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)CCC(C)C)cc1[N+](=O)[O-] ZINC000034995249 171923634 /nfs/dbraw/zinc/92/36/34/171923634.db2.gz OSTNRCYYBZRQMC-CYBMUJFWSA-N 1 0 264.369 3.818 20 5 CHBDRO CC[C@@H]([NH2+]CC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000037257485 173068266 /nfs/dbraw/zinc/06/82/66/173068266.db2.gz AKCAMLYOEMEZPL-OAHLLOKOSA-N 1 0 262.353 3.826 20 5 CHBDRO Cc1ccc(CCC[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cn1 ZINC000354567415 227034672 /nfs/dbraw/zinc/03/46/72/227034672.db2.gz MUDVGKGUFSNTMY-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC=C(c3ccco3)C2)cc1 ZINC000352571200 227073006 /nfs/dbraw/zinc/07/30/06/227073006.db2.gz RLGMKDVPYSUDSC-UHFFFAOYSA-N 1 0 298.342 3.520 20 5 CHBDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000076866784 260166692 /nfs/dbraw/zinc/16/66/92/260166692.db2.gz CPHIJZUVDUBEAG-VIFPVBQESA-N 1 0 291.376 3.519 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000086642791 260208716 /nfs/dbraw/zinc/20/87/16/260208716.db2.gz LQAXSBHTOARUQD-UHFFFAOYSA-N 1 0 264.369 3.962 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@@H](C)SC)c1cccc([N+](=O)[O-])c1 ZINC000090724893 260393100 /nfs/dbraw/zinc/39/31/00/260393100.db2.gz KDRPHJTZWMNUJI-BXUZGUMPSA-N 1 0 282.409 3.777 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccncc1 ZINC000173441029 261533641 /nfs/dbraw/zinc/53/36/41/261533641.db2.gz HCTCFVKZDHBPDJ-LRDDRELGSA-N 1 0 285.347 3.792 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2C2CCCC2)c(F)c1 ZINC000313868535 261534145 /nfs/dbraw/zinc/53/41/45/261534145.db2.gz YIMVJLZQEWVHCG-INIZCTEOSA-N 1 0 292.354 3.889 20 5 CHBDRO Cc1cncc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000184305443 262015791 /nfs/dbraw/zinc/01/57/91/262015791.db2.gz PBCBGUAXVVCABY-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1cncc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000184305480 262015890 /nfs/dbraw/zinc/01/58/90/262015890.db2.gz PBCBGUAXVVCABY-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000185935079 262072936 /nfs/dbraw/zinc/07/29/36/262072936.db2.gz CDXWUXYWJRUKRL-OAHLLOKOSA-N 1 0 285.347 3.621 20 5 CHBDRO C[C@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000186003987 262075179 /nfs/dbraw/zinc/07/51/79/262075179.db2.gz YPKVXZLWJRXWCJ-XJKSGUPXSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@@H]([NH2+]CCOC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000108942779 262075433 /nfs/dbraw/zinc/07/54/33/262075433.db2.gz XZNQUNAPITZBLH-MRXNPFEDSA-N 1 0 292.379 3.595 20 5 CHBDRO CSCCCCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000186781658 262323508 /nfs/dbraw/zinc/32/35/08/262323508.db2.gz SHVCUZXPFJSDIZ-LBPRGKRZSA-N 1 0 282.409 3.779 20 5 CHBDRO CCCC[C@@H](CC)C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000021508412 262389664 /nfs/dbraw/zinc/38/96/64/262389664.db2.gz RTUUKVZYJIREHQ-CYBMUJFWSA-N 1 0 264.369 3.901 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)c2ccsc2)cccc1[N+](=O)[O-] ZINC000061363026 262396132 /nfs/dbraw/zinc/39/61/32/262396132.db2.gz RRFCGFRSRPMCIG-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000284047754 263085606 /nfs/dbraw/zinc/08/56/06/263085606.db2.gz KCGOVUWJIZJVNM-NEPJUHHUSA-N 1 0 285.347 3.589 20 5 CHBDRO CC1(C)C[C@H]([NH2+]C[C@H]2CC23CC3)c2cc([N+](=O)[O-])ccc21 ZINC000417334023 263801837 /nfs/dbraw/zinc/80/18/37/263801837.db2.gz GQOCTVDSKWDRFP-ABAIWWIYSA-N 1 0 286.375 3.707 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000330695812 264005433 /nfs/dbraw/zinc/00/54/33/264005433.db2.gz DFGUSUJVFWNWPY-RISCZKNCSA-N 1 0 292.379 3.592 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@H+](CC1CC1)C1CCC1 ZINC000475673485 264335453 /nfs/dbraw/zinc/33/54/53/264335453.db2.gz NYTAEKXKAVRTNZ-XQRVVYSFSA-N 1 0 286.375 3.873 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1cc(C)ccc1[N+](=O)[O-] ZINC000094659348 265248807 /nfs/dbraw/zinc/24/88/07/265248807.db2.gz GDHILRNPUUNJHM-AWEZNQCLSA-N 1 0 293.411 3.826 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000062726403 327894529 /nfs/dbraw/zinc/89/45/29/327894529.db2.gz YFXYOZVKUUEOCL-ZFWWWQNUSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@H]1CCCCO1 ZINC000540952859 328013571 /nfs/dbraw/zinc/01/35/71/328013571.db2.gz ARBYCDKGEUUAAP-DZGCQCFKSA-N 1 0 292.379 3.513 20 5 CHBDRO CCCC[C@H](CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000069376880 328040113 /nfs/dbraw/zinc/04/01/13/328040113.db2.gz ILLUXTVUJSRJFH-ZDUSSCGKSA-N 1 0 250.342 3.653 20 5 CHBDRO CC1=CC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000571153280 328088619 /nfs/dbraw/zinc/08/86/19/328088619.db2.gz APMAJNRZDAQJKL-JSGCOSHPSA-N 1 0 260.337 3.744 20 5 CHBDRO CCOc1cc(C[N@H+](C)[C@H](C)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000571398739 328118872 /nfs/dbraw/zinc/11/88/72/328118872.db2.gz UVGVHONTXVWGKN-GFCCVEGCSA-N 1 0 294.395 3.860 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@H]2CCC[C@H]2C2CC2)cs1 ZINC000414485638 328185749 /nfs/dbraw/zinc/18/57/49/328185749.db2.gz PSRJUWIPQBGHGP-OLZOCXBDSA-N 1 0 280.393 3.572 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)cs1 ZINC000049442845 328362801 /nfs/dbraw/zinc/36/28/01/328362801.db2.gz GPGQFIYZYYZSJS-KCXRBIIJSA-N 1 0 292.404 3.667 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1cccs1 ZINC000155586496 328374929 /nfs/dbraw/zinc/37/49/29/328374929.db2.gz BXKMKFSWEXVNPG-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@]1(c2ccccc2)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532038423 328398383 /nfs/dbraw/zinc/39/83/83/328398383.db2.gz ASPZKMDTEVBEAR-SFHVURJKSA-N 1 0 296.370 3.758 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)c1 ZINC000538399301 326827361 /nfs/dbraw/zinc/82/73/61/326827361.db2.gz ORNFJXUBZGORDG-SOUVJXGZSA-N 1 0 274.364 3.653 20 5 CHBDRO CCC[C@H]([NH2+]CCCSC)c1cccc([N+](=O)[O-])c1 ZINC000069434225 326902295 /nfs/dbraw/zinc/90/22/95/326902295.db2.gz SAYRGKRTYAWGEF-AWEZNQCLSA-N 1 0 282.409 3.779 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000556572379 326952331 /nfs/dbraw/zinc/95/23/31/326952331.db2.gz CXRSGWSOZSBQOL-ZDUSSCGKSA-N 1 0 282.771 3.569 20 5 CHBDRO CC1=CC[C@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000556876168 326977140 /nfs/dbraw/zinc/97/71/40/326977140.db2.gz ABOXHYUZSMACSL-AWEZNQCLSA-N 1 0 299.374 3.707 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000558697933 327114808 /nfs/dbraw/zinc/11/48/08/327114808.db2.gz IAMXLXFCWSNAAF-IACUBPJLSA-N 1 0 294.782 3.569 20 5 CHBDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CS1 ZINC000449348651 327166201 /nfs/dbraw/zinc/16/62/01/327166201.db2.gz MRVBBXZJNXNRKF-LNSITVRQSA-N 1 0 294.420 3.776 20 5 CHBDRO C[C@H](C[NH+]1CCCCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000047873379 327216352 /nfs/dbraw/zinc/21/63/52/327216352.db2.gz TYOYZNUSLGGCBQ-LLVKDONJSA-N 1 0 297.786 3.535 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CCCC23CCCC3)c1 ZINC000559790446 327261351 /nfs/dbraw/zinc/26/13/51/327261351.db2.gz XFDMRSRTXVMBQJ-INIZCTEOSA-N 1 0 288.391 3.840 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccsc2)c(Cl)c1 ZINC000049963620 327299568 /nfs/dbraw/zinc/29/95/68/327299568.db2.gz VUXNHYPBHZTUDG-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO Cc1cccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000051668992 328627030 /nfs/dbraw/zinc/62/70/30/328627030.db2.gz XNIIQGPCNSOITG-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCSC(C)C)cc1[N+](=O)[O-] ZINC000389146453 328629281 /nfs/dbraw/zinc/62/92/81/328629281.db2.gz UNXRJEYAYQSXJI-LBPRGKRZSA-N 1 0 282.409 3.695 20 5 CHBDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000042857663 328771478 /nfs/dbraw/zinc/77/14/78/328771478.db2.gz SUOAJIIYZYGFSE-OLZOCXBDSA-N 1 0 262.353 3.511 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]C[C@@H]2CC=CCC2)cc1 ZINC000532785788 328810617 /nfs/dbraw/zinc/81/06/17/328810617.db2.gz IZCRSUFDLNDEKF-MRXNPFEDSA-N 1 0 288.391 3.863 20 5 CHBDRO Cc1c(C[NH2+][C@H](C2CC2)C2CCC2)cccc1[N+](=O)[O-] ZINC000325026207 328816876 /nfs/dbraw/zinc/81/68/76/328816876.db2.gz KJZBEKXMYFVYSI-INIZCTEOSA-N 1 0 274.364 3.572 20 5 CHBDRO Cn1cccc1[C@@H]1CCCCN1Cc1ccccc1[N+](=O)[O-] ZINC000175125549 329163378 /nfs/dbraw/zinc/16/33/78/329163378.db2.gz FCQYJIMQESQRPZ-KRWDZBQOSA-N 1 0 299.374 3.661 20 5 CHBDRO Cn1cccc1[C@H]1CCCCN1Cc1ccccc1[N+](=O)[O-] ZINC000175125566 329163421 /nfs/dbraw/zinc/16/34/21/329163421.db2.gz FCQYJIMQESQRPZ-QGZVFWFLSA-N 1 0 299.374 3.661 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000421874294 330100912 /nfs/dbraw/zinc/10/09/12/330100912.db2.gz ICYXIGZOBZLPFH-PWSUYJOCSA-N 1 0 250.342 3.600 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1C[C@@H](C)O[C@H](C)C1 ZINC000536831568 330229262 /nfs/dbraw/zinc/22/92/62/330229262.db2.gz GBEMVDYMRZPOKD-UPJWGTAASA-N 1 0 292.379 3.510 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000035257091 330244925 /nfs/dbraw/zinc/24/49/25/330244925.db2.gz VMHGXDZQCHLLAS-CABCVRRESA-N 1 0 276.380 3.962 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CCCC2CC2)cc1[N+](=O)[O-] ZINC000536856029 330251943 /nfs/dbraw/zinc/25/19/43/330251943.db2.gz CFLRIZZCRJVRAT-LBPRGKRZSA-N 1 0 292.379 3.834 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC(C)C1 ZINC000536871117 330265386 /nfs/dbraw/zinc/26/53/86/330265386.db2.gz NUUNJAJLLJIWNO-CPCZMJQVSA-N 1 0 294.420 3.854 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCC23CCCC3)cc1 ZINC000328070855 330308121 /nfs/dbraw/zinc/30/81/21/330308121.db2.gz DOOKOQXWHUGKQM-HNNXBMFYSA-N 1 0 274.364 3.797 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C2(c3ccccc3)CCC2)cc1 ZINC000533029979 330324914 /nfs/dbraw/zinc/32/49/14/330324914.db2.gz OVHGHKSCOUNDBV-UHFFFAOYSA-N 1 0 296.370 3.806 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000580491067 330348580 /nfs/dbraw/zinc/34/85/80/330348580.db2.gz CUQHYJQNFRHHSC-HNNXBMFYSA-N 1 0 274.364 3.524 20 5 CHBDRO CC[C@@H](C)C[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000088293577 330375716 /nfs/dbraw/zinc/37/57/16/330375716.db2.gz OBYYGJNDDQYANA-NXEZZACHSA-N 1 0 256.371 3.571 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1CCC2(CC2)CC1 ZINC000434777242 330645016 /nfs/dbraw/zinc/64/50/16/330645016.db2.gz OYADAMBBQFAYQP-UHFFFAOYSA-N 1 0 274.364 3.716 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2ccccc21 ZINC000449068095 330896749 /nfs/dbraw/zinc/89/67/49/330896749.db2.gz QUWNURGXCCISER-SUMWQHHRSA-N 1 0 296.370 3.803 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000449349552 330917092 /nfs/dbraw/zinc/91/70/92/330917092.db2.gz QQQUYPUBIPKDDE-ZDUSSCGKSA-N 1 0 296.370 3.934 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000449445720 330926191 /nfs/dbraw/zinc/92/61/91/330926191.db2.gz LLSXTNBKCLJKGO-JGGQBBKZSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCC2 ZINC000194619739 330945121 /nfs/dbraw/zinc/94/51/21/330945121.db2.gz BHSOTQNYNGSFLE-CYBMUJFWSA-N 1 0 296.370 3.934 20 5 CHBDRO CC(C)([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccccc1[N+](=O)[O-] ZINC000451059547 331014069 /nfs/dbraw/zinc/01/40/69/331014069.db2.gz XDAZETKLXSAYOI-LLVKDONJSA-N 1 0 298.333 3.855 20 5 CHBDRO CCC[C@@H]([NH2+]C1CC(C)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000453258512 331108474 /nfs/dbraw/zinc/10/84/74/331108474.db2.gz WIRUHWCHJZWSIM-HNFVBEJKSA-N 1 0 280.343 3.916 20 5 CHBDRO CC/C=C\C[NH2+][C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000453316815 331115654 /nfs/dbraw/zinc/11/56/54/331115654.db2.gz JZWZHORPMMYCAL-DGMVEKRQSA-N 1 0 278.352 3.610 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C1CC1)C1CCC1 ZINC000453438095 331131829 /nfs/dbraw/zinc/13/18/29/331131829.db2.gz VOIWSAAJEPKLRE-SJCJKPOMSA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1cc(NCc2ccc([N+](=O)[O-])cc2)ccc1C[NH+](C)C ZINC000459743264 331297640 /nfs/dbraw/zinc/29/76/40/331297640.db2.gz PRBCFTBHFSSQIJ-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO Cc1cc(C)cc(C[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000462731604 331325941 /nfs/dbraw/zinc/32/59/41/331325941.db2.gz PDPAVUSYMZSQJZ-OAHLLOKOSA-N 1 0 298.386 3.932 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC(C)(C)C ZINC000463358397 331346537 /nfs/dbraw/zinc/34/65/37/331346537.db2.gz CXUXMYWGFDUBIJ-UHFFFAOYSA-N 1 0 264.369 3.771 20 5 CHBDRO CCCC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C1CC1 ZINC000463481343 331348475 /nfs/dbraw/zinc/34/84/75/331348475.db2.gz CRHADQLNMWLXRN-UHFFFAOYSA-N 1 0 296.342 3.507 20 5 CHBDRO CC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000463520001 331348991 /nfs/dbraw/zinc/34/89/91/331348991.db2.gz WATFYKDVRBPNJH-LLVKDONJSA-N 1 0 298.358 3.609 20 5 CHBDRO CC(C)[C@H]1C[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CCS1 ZINC000464774710 331367323 /nfs/dbraw/zinc/36/73/23/331367323.db2.gz PZZIPVWKMKMHTI-IUODEOHRSA-N 1 0 294.420 3.729 20 5 CHBDRO CC(C)[C@@H]1C[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CCS1 ZINC000464779743 331367977 /nfs/dbraw/zinc/36/79/77/331367977.db2.gz ZJZHMMDEWFFGRY-DOMZBBRYSA-N 1 0 294.420 3.729 20 5 CHBDRO CC/C=C/CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000466235020 331391438 /nfs/dbraw/zinc/39/14/38/331391438.db2.gz KKOAAYZJGFUAIW-ONEGZZNKSA-N 1 0 274.364 3.916 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)CCC1CC1 ZINC000469131247 331446407 /nfs/dbraw/zinc/44/64/07/331446407.db2.gz ZDPUMCCVLKAMMN-GFCCVEGCSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H]1C1CCC1)c1ccccc1[N+](=O)[O-] ZINC000510699613 332912304 /nfs/dbraw/zinc/91/23/04/332912304.db2.gz ZQNFEMZUTSPEOS-NILFDRSVSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1ccccc1C[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000478493197 331707244 /nfs/dbraw/zinc/70/72/44/331707244.db2.gz RTWFLAGMSKUJPQ-CQSZACIVSA-N 1 0 298.386 3.932 20 5 CHBDRO CCCCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000479876341 331750558 /nfs/dbraw/zinc/75/05/58/331750558.db2.gz SWQKYQIPPFLLND-GFCCVEGCSA-N 1 0 250.342 3.744 20 5 CHBDRO COc1cc(C[NH2+][C@H]2CCCCC2(C)C)ccc1[N+](=O)[O-] ZINC000481172939 331799703 /nfs/dbraw/zinc/79/97/03/331799703.db2.gz GKMZQXAQUTXWHS-HNNXBMFYSA-N 1 0 292.379 3.662 20 5 CHBDRO CC(C)[C@@H](C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000484160481 331893734 /nfs/dbraw/zinc/89/37/34/331893734.db2.gz LJJDYSNLFPPUDW-BBRMVZONSA-N 1 0 290.407 3.798 20 5 CHBDRO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CS1 ZINC000488447813 332009885 /nfs/dbraw/zinc/00/98/85/332009885.db2.gz XUFMIGYYXFTNOQ-HUBLWGQQSA-N 1 0 294.420 3.776 20 5 CHBDRO CC[C@@H]1CC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490010392 332076528 /nfs/dbraw/zinc/07/65/28/332076528.db2.gz BCSNTBOEMISIJV-CHWSQXEVSA-N 1 0 262.353 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C)[C@H]1C ZINC000490067160 332079751 /nfs/dbraw/zinc/07/97/51/332079751.db2.gz MGHMCNSXHMFOMY-RTXFEEFZSA-N 1 0 262.353 3.695 20 5 CHBDRO CCOc1cc(C[NH2+][C@@H]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000491813153 332365092 /nfs/dbraw/zinc/36/50/92/332365092.db2.gz LTCHXTHXRLNUHK-GXTWGEPZSA-N 1 0 292.379 3.662 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH+](CC1CC1)CC1CC1 ZINC000492439699 332397607 /nfs/dbraw/zinc/39/76/07/332397607.db2.gz LNWUCSFOHCQUCS-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO C[C@@H]1C[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000495068422 332503020 /nfs/dbraw/zinc/50/30/20/332503020.db2.gz KUZYLJPEZMJVDO-IOASZLSFSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000251978748 334372566 /nfs/dbraw/zinc/37/25/66/334372566.db2.gz YOEAELYWXYIKPF-YRGRVCCFSA-N 1 0 262.353 3.509 20 5 CHBDRO CC(C)C[C@@H](C)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000499610455 332590087 /nfs/dbraw/zinc/59/00/87/332590087.db2.gz JXNUACPSWGUKEQ-OLZOCXBDSA-N 1 0 264.369 3.928 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)oc1C ZINC000502412033 332657854 /nfs/dbraw/zinc/65/78/54/332657854.db2.gz BKRFXWFKRIYXHF-LBPRGKRZSA-N 1 0 288.347 3.698 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H]1C ZINC000504899488 332723996 /nfs/dbraw/zinc/72/39/96/332723996.db2.gz HRPICUJFLLPNNO-FRRDWIJNSA-N 1 0 294.420 3.711 20 5 CHBDRO CC(C)(C)CCCC[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000520959459 333109000 /nfs/dbraw/zinc/10/90/00/333109000.db2.gz MCHSRXFSFJENOL-UHFFFAOYSA-N 1 0 264.369 3.901 20 5 CHBDRO C[C@@H]1CCC[C@H](C[NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000218940096 333138718 /nfs/dbraw/zinc/13/87/18/333138718.db2.gz BWXQPKVWGTVYCH-KGLIPLIRSA-N 1 0 276.380 3.553 20 5 CHBDRO CC(C)C(C)(C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000219266029 333145945 /nfs/dbraw/zinc/14/59/45/333145945.db2.gz SMULFEFFTRQGDC-GFCCVEGCSA-N 1 0 264.369 3.928 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000189086129 333180566 /nfs/dbraw/zinc/18/05/66/333180566.db2.gz YVSVPPZFWXMSLK-SWLSCSKDSA-N 1 0 274.364 3.968 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCOC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000336894091 335122786 /nfs/dbraw/zinc/12/27/86/335122786.db2.gz LMKXCVYACRWSHX-GJZGRUSLSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000226165311 333252214 /nfs/dbraw/zinc/25/22/14/333252214.db2.gz OOJRRGUPKLBNIY-DYEKYZERSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000226179015 333253315 /nfs/dbraw/zinc/25/33/15/333253315.db2.gz WBOCSCKHXMQRPQ-DVOMOZLQSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522466261 333287443 /nfs/dbraw/zinc/28/74/43/333287443.db2.gz IGCYBEARAOFYAP-WMLDXEAASA-N 1 0 296.370 3.973 20 5 CHBDRO CC1(C[NH2+]Cc2ccccc2[N+](=O)[O-])CCCCC1 ZINC000229587797 333306617 /nfs/dbraw/zinc/30/66/17/333306617.db2.gz AMJVCIHRXSTNFM-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC000524607954 333368457 /nfs/dbraw/zinc/36/84/57/333368457.db2.gz CCAXXZPISCGOGV-AWEZNQCLSA-N 1 0 292.379 3.758 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CSC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000338783270 335138283 /nfs/dbraw/zinc/13/82/83/335138283.db2.gz UTXVZNHRFCKZNS-OLZOCXBDSA-N 1 0 280.393 3.530 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000322863673 333415627 /nfs/dbraw/zinc/41/56/27/333415627.db2.gz USITYSQYECZRCL-AWEZNQCLSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@H](Cc1cccs1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000036992516 333452364 /nfs/dbraw/zinc/45/23/64/333452364.db2.gz RSIQJONBLAXKNS-NEPJUHHUSA-N 1 0 290.388 3.938 20 5 CHBDRO CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000068590651 333710016 /nfs/dbraw/zinc/71/00/16/333710016.db2.gz UJKQIGRMTFUKSK-ZFWWWQNUSA-N 1 0 276.380 3.962 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)CC(C)C ZINC000540151621 333713625 /nfs/dbraw/zinc/71/36/25/333713625.db2.gz SPASVZFZKOFIMD-OLZOCXBDSA-N 1 0 264.369 3.988 20 5 CHBDRO C[C@@H]([NH2+]CCC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000135457223 334130488 /nfs/dbraw/zinc/13/04/88/334130488.db2.gz BWOAWHKJAAZVKA-LLVKDONJSA-N 1 0 250.342 3.682 20 5 CHBDRO CC(C)([NH2+]Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000080347044 334170609 /nfs/dbraw/zinc/17/06/09/334170609.db2.gz LWKYYUOQCMHVHS-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO CC(C)[C@@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000081046887 334177256 /nfs/dbraw/zinc/17/72/56/334177256.db2.gz NQBYFYFHBLOKLB-RYUDHWBXSA-N 1 0 250.342 3.538 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CCC(C)(C)C ZINC000548935751 334180741 /nfs/dbraw/zinc/18/07/41/334180741.db2.gz WEKAVNAYYLLNER-UHFFFAOYSA-N 1 0 264.369 3.505 20 5 CHBDRO CCCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549344023 334190411 /nfs/dbraw/zinc/19/04/11/334190411.db2.gz SQUXYRLKLKMPQC-UHFFFAOYSA-N 1 0 290.285 3.846 20 5 CHBDRO C[C@H](Cc1ccsc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000081598493 334198822 /nfs/dbraw/zinc/19/88/22/334198822.db2.gz SZAXPCWZHBHQGB-GFCCVEGCSA-N 1 0 290.388 3.719 20 5 CHBDRO CC[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000245568481 334204564 /nfs/dbraw/zinc/20/45/64/334204564.db2.gz YEPJEISSPPCHLD-KCQAQPDRSA-N 1 0 276.380 3.694 20 5 CHBDRO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000550079267 334212587 /nfs/dbraw/zinc/21/25/87/334212587.db2.gz LFTFTJIESUGHNM-HIFRSBDPSA-N 1 0 274.364 3.605 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCC[C@@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000551302717 334245585 /nfs/dbraw/zinc/24/55/85/334245585.db2.gz XTXYKZYFLFXBQM-BFHYXJOUSA-N 1 0 266.316 3.526 20 5 CHBDRO CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000552275331 334311417 /nfs/dbraw/zinc/31/14/17/334311417.db2.gz RTDHVHWBAIQMOM-OBJOEFQTSA-N 1 0 262.353 3.680 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CC=CCC1)C1CC1 ZINC000090035859 334355938 /nfs/dbraw/zinc/35/59/38/334355938.db2.gz LQJCRDXBLZMDRJ-HZPDHXFCSA-N 1 0 286.375 3.614 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000090035984 334355989 /nfs/dbraw/zinc/35/59/89/334355989.db2.gz NTHWSFIFGIGNJI-OCCSQVGLSA-N 1 0 290.363 3.753 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@H]1C ZINC000251599679 334365293 /nfs/dbraw/zinc/36/52/93/334365293.db2.gz BQVYUJCANMICJI-MBNYWOFBSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000554082851 334409888 /nfs/dbraw/zinc/40/98/88/334409888.db2.gz AVTWVSCHGOZBGS-NILFDRSVSA-N 1 0 274.364 3.742 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccccc1F ZINC000565216081 334545488 /nfs/dbraw/zinc/54/54/88/334545488.db2.gz JANGQSKWQONGCZ-OAHLLOKOSA-N 1 0 286.306 3.511 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])s1 ZINC000565219477 334545869 /nfs/dbraw/zinc/54/58/69/334545869.db2.gz VYYKVAVXYWOHSF-CQSZACIVSA-N 1 0 288.372 3.742 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000578012741 335459624 /nfs/dbraw/zinc/45/96/24/335459624.db2.gz WTJLDCBQLNJBOB-YDHLFZDLSA-N 1 0 280.343 3.916 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000581196060 336022974 /nfs/dbraw/zinc/02/29/74/336022974.db2.gz CZQYNBNKOPLIMW-MRXNPFEDSA-N 1 0 296.370 3.974 20 5 CHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000383626628 336115952 /nfs/dbraw/zinc/11/59/52/336115952.db2.gz UIFHWZUPYNSXFD-AAEUAGOBSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCC1CC[NH2+]CC1 ZINC000581820443 336147054 /nfs/dbraw/zinc/14/70/54/336147054.db2.gz GKYMKTBJRXILCD-LBPRGKRZSA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000385820713 336157617 /nfs/dbraw/zinc/15/76/17/336157617.db2.gz QUERQLQXVGSQLF-LRDDRELGSA-N 1 0 282.343 3.933 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC23CCCC3)cc1[N+](=O)[O-] ZINC000387101053 336185322 /nfs/dbraw/zinc/18/53/22/336185322.db2.gz HGQPYUPNLFIQKP-SWLSCSKDSA-N 1 0 274.364 3.887 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000037668296 522653020 /nfs/dbraw/zinc/65/30/20/522653020.db2.gz STUBNYAFTDNAOD-INIZCTEOSA-N 1 0 270.332 3.836 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000337303981 522936308 /nfs/dbraw/zinc/93/63/08/522936308.db2.gz RBUXHTYKFMRYNF-CXAGYDPISA-N 1 0 299.374 3.662 20 5 CHBDRO Cc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1C ZINC000042243927 524431750 /nfs/dbraw/zinc/43/17/50/524431750.db2.gz PUBKJWYPXBHRJZ-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO C[C@@H](CCc1ccco1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000020526226 524546961 /nfs/dbraw/zinc/54/69/61/524546961.db2.gz JKQIVBLLOXOEFH-STQMWFEESA-N 1 0 288.347 3.860 20 5 CHBDRO C[C@H]([NH2+]CCc1ccsc1)c1ccc([N+](=O)[O-])cc1 ZINC000049153309 525370531 /nfs/dbraw/zinc/37/05/31/525370531.db2.gz ZXKAEXOYXXJDTN-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO C[C@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000126466159 525401603 /nfs/dbraw/zinc/40/16/03/525401603.db2.gz DFKJOHSUNGEICF-SMDDNHRTSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000050344440 525463830 /nfs/dbraw/zinc/46/38/30/525463830.db2.gz VRKPJJMZJKANOK-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO C[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000126466398 525487769 /nfs/dbraw/zinc/48/77/69/525487769.db2.gz DFKJOHSUNGEICF-BXUZGUMPSA-N 1 0 280.393 3.531 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C(C1CC1)C1CC1)CCC2 ZINC000192744819 534883888 /nfs/dbraw/zinc/88/38/88/534883888.db2.gz FYYDBPVZYSFOCL-INIZCTEOSA-N 1 0 286.375 3.750 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1[C@H](C)CC[C@H]1C ZINC000342077865 535021814 /nfs/dbraw/zinc/02/18/14/535021814.db2.gz SWJHHLMFDNFNJH-CHWSQXEVSA-N 1 0 292.379 3.755 20 5 CHBDRO CCCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113311598 1125494364 /nfs/dbraw/zinc/49/43/64/1125494364.db2.gz KZKWJDAHUVJLPT-UHFFFAOYSA-N 1 0 291.376 3.608 20 5 CHBDRO CC1CCC([N@H+](C)Cc2csc([N+](=O)[O-])c2)CC1 ZINC000054153225 1121721180 /nfs/dbraw/zinc/72/11/80/1121721180.db2.gz RPHPWFFRFXVILZ-UHFFFAOYSA-N 1 0 268.382 3.667 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)CC(F)(F)F ZINC000545236197 1123769489 /nfs/dbraw/zinc/76/94/89/1123769489.db2.gz WSQRZKLQXJGGKY-VHSXEESVSA-N 1 0 290.285 3.895 20 5 CHBDRO Cc1c(C[NH2+]CCCCC2CC2)cccc1[N+](=O)[O-] ZINC000716403396 1131889890 /nfs/dbraw/zinc/88/98/90/1131889890.db2.gz JKGLWSXBIQCGII-UHFFFAOYSA-N 1 0 262.353 3.573 20 5 CHBDRO CC(C)=CCC[C@H](C)CCO[C@H](C)C[N+](C)(C)C ZINC001224709452 1135472980 /nfs/dbraw/zinc/47/29/80/1135472980.db2.gz GKWLFVPAAHQCSI-JKSUJKDBSA-N 1 0 256.454 3.870 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000119271351 1125530271 /nfs/dbraw/zinc/53/02/71/1125530271.db2.gz VHSXQGWNFIXUBX-QWHCGFSZSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1occc1CN(C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000138382287 1125539248 /nfs/dbraw/zinc/53/92/48/1125539248.db2.gz LLABEYLNTKSJTK-NSHDSACASA-N 1 0 274.320 3.689 20 5 CHBDRO CC(C)C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC000886104619 1125650533 /nfs/dbraw/zinc/65/05/33/1125650533.db2.gz HALHOMNMWDADFY-MRXNPFEDSA-N 1 0 299.374 3.867 20 5 CHBDRO CC(C)C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC000886104618 1125650633 /nfs/dbraw/zinc/65/06/33/1125650633.db2.gz HALHOMNMWDADFY-INIZCTEOSA-N 1 0 299.374 3.867 20 5 CHBDRO C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886205088 1125661417 /nfs/dbraw/zinc/66/14/17/1125661417.db2.gz ZLNNMXKYECYVTL-CJNGLKHVSA-N 1 0 297.358 3.573 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000348388418 1125684541 /nfs/dbraw/zinc/68/45/41/1125684541.db2.gz GSJOONBDQCLZIK-SCRDCRAPSA-N 1 0 266.316 3.526 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000886540830 1125686939 /nfs/dbraw/zinc/68/69/39/1125686939.db2.gz LNABQOLEXMUDMI-CZUORRHYSA-N 1 0 297.358 3.573 20 5 CHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1(C2CC2)CCC1 ZINC000886824554 1125721172 /nfs/dbraw/zinc/72/11/72/1125721172.db2.gz BODRMJQUNNEMSW-NSHDSACASA-N 1 0 292.354 3.587 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000159927145 1126758494 /nfs/dbraw/zinc/75/84/94/1126758494.db2.gz ZXBUVPUVBVOARA-OCCSQVGLSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000159945581 1126759372 /nfs/dbraw/zinc/75/93/72/1126759372.db2.gz QAMOILVOCULAON-DZGCQCFKSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1cccc2c1CC[C@@H]2[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000482512117 1126763675 /nfs/dbraw/zinc/76/36/75/1126763675.db2.gz QYYMTQHPYOHAEN-SFHVURJKSA-N 1 0 296.370 3.723 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000138894115 1126793397 /nfs/dbraw/zinc/79/33/97/1126793397.db2.gz IKPKJXOOVXHJJT-QGZVFWFLSA-N 1 0 298.342 3.638 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000036721101 1126799019 /nfs/dbraw/zinc/79/90/19/1126799019.db2.gz GBXDHSYNOSPRDY-INIZCTEOSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000036721120 1126799569 /nfs/dbraw/zinc/79/95/69/1126799569.db2.gz WAPWTQJKPZLZHW-BLLLJJGKSA-N 1 0 285.347 3.792 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](C)C(C)C)cccc1[N+](=O)[O-] ZINC000484183357 1126811990 /nfs/dbraw/zinc/81/19/90/1126811990.db2.gz ZVAPDWYKELRFHE-WCQYABFASA-N 1 0 264.369 3.846 20 5 CHBDRO CC[C@H](C[C@@](C)(O)CC)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000924798365 1126852699 /nfs/dbraw/zinc/85/26/99/1126852699.db2.gz NIGKRIXGJQJSPH-BJJXKVORSA-N 1 0 294.395 3.575 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000037176951 1126923541 /nfs/dbraw/zinc/92/35/41/1126923541.db2.gz KCQYIGXVCWPTAP-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000037176852 1126923638 /nfs/dbraw/zinc/92/36/38/1126923638.db2.gz OSXUTKZKHIHZJL-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000266872755 1126989104 /nfs/dbraw/zinc/98/91/04/1126989104.db2.gz NLYRZICWBWTLBV-ZDUSSCGKSA-N 1 0 299.374 3.512 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000271438999 1127082113 /nfs/dbraw/zinc/08/21/13/1127082113.db2.gz DAYIAHHGKDPASV-ZDUSSCGKSA-N 1 0 299.374 3.512 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cncs2)cc1[N+](=O)[O-] ZINC000271474706 1127084881 /nfs/dbraw/zinc/08/48/81/1127084881.db2.gz JLIMABLZHMFNPD-QWRGUYRKSA-N 1 0 291.376 3.772 20 5 CHBDRO Cc1cncc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000274360542 1127114466 /nfs/dbraw/zinc/11/44/66/1127114466.db2.gz IFPPIXHECATJFA-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO O=[N+]([O-])c1cc(F)c(CN2CCC3(CCC3)CC2)c(F)c1 ZINC000586783207 1127140213 /nfs/dbraw/zinc/14/02/13/1127140213.db2.gz FQWJSNDOBFEQAI-UHFFFAOYSA-N 1 0 296.317 3.639 20 5 CHBDRO CCC[C@H](N[C@@H](C)c1ccon1)c1cccc([N+](=O)[O-])c1 ZINC000349832915 1127164131 /nfs/dbraw/zinc/16/41/31/1127164131.db2.gz KDNURFWQJZHECT-NHYWBVRUSA-N 1 0 289.335 3.775 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2C2CCCC2)cs1 ZINC000055927214 1127183159 /nfs/dbraw/zinc/18/31/59/1127183159.db2.gz LEUSZEUDAUMYJE-CYBMUJFWSA-N 1 0 280.393 3.811 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@H](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000588977835 1127208992 /nfs/dbraw/zinc/20/89/92/1127208992.db2.gz AMUOMXYLAJVBSR-HNNXBMFYSA-N 1 0 274.364 3.525 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(C2CC2)CC1 ZINC000590006629 1127242404 /nfs/dbraw/zinc/24/24/04/1127242404.db2.gz LESUHKXQHREXGO-GFCCVEGCSA-N 1 0 274.364 3.778 20 5 CHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353896214 1127276729 /nfs/dbraw/zinc/27/67/29/1127276729.db2.gz HBRMQERBLZRUJP-GFCCVEGCSA-N 1 0 268.382 3.667 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000591255939 1127290127 /nfs/dbraw/zinc/29/01/27/1127290127.db2.gz KEMDHVQUNGDQMT-JBLDHEPKSA-N 1 0 284.306 3.598 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000591255941 1127290208 /nfs/dbraw/zinc/29/02/08/1127290208.db2.gz KEMDHVQUNGDQMT-UMNHJUIQSA-N 1 0 284.306 3.598 20 5 CHBDRO Cc1ccc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC001168400614 1127298521 /nfs/dbraw/zinc/29/85/21/1127298521.db2.gz BZSOBHUPGSWDDL-BPUTZDHNSA-N 1 0 288.391 3.914 20 5 CHBDRO [NH3+]CCCCCCCOc1c(Cl)cccc1[N+](=O)[O-] ZINC000818619368 1131218420 /nfs/dbraw/zinc/21/84/20/1131218420.db2.gz AAFMSEBGKIZQIO-UHFFFAOYSA-N 1 0 286.759 3.536 20 5 CHBDRO [NH3+]CCCCCCCOc1cccc(Cl)c1[N+](=O)[O-] ZINC000818618916 1131218446 /nfs/dbraw/zinc/21/84/46/1131218446.db2.gz VLQNATVZLDXWQC-UHFFFAOYSA-N 1 0 286.759 3.536 20 5 CHBDRO CC[C@H]([NH2+]CC1=CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000592099870 1127333460 /nfs/dbraw/zinc/33/34/60/1127333460.db2.gz VYOAZSDYGVVDGH-HNNXBMFYSA-N 1 0 260.337 3.746 20 5 CHBDRO C[C@H]([NH2+]C1(C2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000593082886 1127372474 /nfs/dbraw/zinc/37/24/74/1127372474.db2.gz YJFPWOQJNKUZCR-NSHDSACASA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594515838 1127420266 /nfs/dbraw/zinc/42/02/66/1127420266.db2.gz SUUHSGWAZSPBJV-UONOGXRCSA-N 1 0 299.374 3.580 20 5 CHBDRO COC[C@@H](CC(C)(C)C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000594519150 1127420945 /nfs/dbraw/zinc/42/09/45/1127420945.db2.gz DWIONFKWJZWFLM-GXTWGEPZSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)Cc1ccccn1 ZINC000594516570 1127421018 /nfs/dbraw/zinc/42/10/18/1127421018.db2.gz XKXXRBGNKWVBAI-UONOGXRCSA-N 1 0 299.374 3.580 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000594516961 1127421158 /nfs/dbraw/zinc/42/11/58/1127421158.db2.gz ZRRMQHANBHGQGQ-GUYCJALGSA-N 1 0 299.374 3.662 20 5 CHBDRO CCC1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000226784231 1127425687 /nfs/dbraw/zinc/42/56/87/1127425687.db2.gz GYXHSXBFOPLTJT-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CCC2(C)CC2)cc1[N+](=O)[O-] ZINC000359009274 1127444151 /nfs/dbraw/zinc/44/41/51/1127444151.db2.gz YUDXCYAFJOEEEV-LBPRGKRZSA-N 1 0 292.379 3.834 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCC2(C)CC2)cc1[N+](=O)[O-] ZINC000359008333 1127444325 /nfs/dbraw/zinc/44/43/25/1127444325.db2.gz WQRKCOTXLCLULT-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCC1(F)CCC1 ZINC000595050008 1127451280 /nfs/dbraw/zinc/45/12/80/1127451280.db2.gz LIDPFWURAMABGT-LLVKDONJSA-N 1 0 296.342 3.536 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000595076781 1127452909 /nfs/dbraw/zinc/45/29/09/1127452909.db2.gz JXXVIMHVSBTYFA-AEIGPULVSA-N 1 0 274.364 3.682 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])C1CC1 ZINC000595107385 1127453184 /nfs/dbraw/zinc/45/31/84/1127453184.db2.gz XXWCNXNUEMLESL-GOEBONIOSA-N 1 0 274.364 3.606 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000595079100 1127453700 /nfs/dbraw/zinc/45/37/00/1127453700.db2.gz CVWHLXXWLMHQOH-FZMZJTMJSA-N 1 0 298.333 3.989 20 5 CHBDRO CC[C@H]([NH2+]CCCc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000595093430 1127454668 /nfs/dbraw/zinc/45/46/68/1127454668.db2.gz JKHMEYWXXUQQHZ-INIZCTEOSA-N 1 0 288.347 3.861 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000595093886 1127454830 /nfs/dbraw/zinc/45/48/30/1127454830.db2.gz PTFQHGBLAGMESF-CABZTGNLSA-N 1 0 284.306 3.537 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1=CCCC1 ZINC000595097609 1127455873 /nfs/dbraw/zinc/45/58/73/1127455873.db2.gz ZYOLTQWPQHMNRM-CYBMUJFWSA-N 1 0 274.364 3.616 20 5 CHBDRO CC[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CC(F)F ZINC000595413702 1127461685 /nfs/dbraw/zinc/46/16/85/1127461685.db2.gz GBQMSDZJDJOAJQ-GHMZBOCLSA-N 1 0 286.322 3.927 20 5 CHBDRO Cc1noc(C[N@H+]2CC[C@@H](C(C)(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC000595497497 1127464383 /nfs/dbraw/zinc/46/43/83/1127464383.db2.gz OOMVEWZUAQBGFU-ZYHUDNBSSA-N 1 0 295.383 3.538 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CC1=CCSC1 ZINC000595889687 1127480054 /nfs/dbraw/zinc/48/00/54/1127480054.db2.gz VKNHAMRTMAKPEY-GFCCVEGCSA-N 1 0 292.404 3.569 20 5 CHBDRO Cc1cnccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000294545040 1127581703 /nfs/dbraw/zinc/58/17/03/1127581703.db2.gz JPLDFFRPNWYSGI-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccoc2)cc1[N+](=O)[O-] ZINC000361918859 1127599395 /nfs/dbraw/zinc/59/93/95/1127599395.db2.gz LZFIUMRLZMAALL-QWHCGFSZSA-N 1 0 288.347 3.778 20 5 CHBDRO CSC1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000602924392 1127622448 /nfs/dbraw/zinc/62/24/48/1127622448.db2.gz VRYKBBMYHYEGAB-GFCCVEGCSA-N 1 0 294.420 3.792 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC2(CCC2)C1 ZINC000593688384 1127658983 /nfs/dbraw/zinc/65/89/83/1127658983.db2.gz QCASGOYOEYYJSR-JYRVWZFOSA-N 1 0 286.375 3.920 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2(C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000593717707 1127665023 /nfs/dbraw/zinc/66/50/23/1127665023.db2.gz GWEHTEWDTQKRKQ-LBPRGKRZSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CC2(CCC2)C1 ZINC000593721570 1127665898 /nfs/dbraw/zinc/66/58/98/1127665898.db2.gz PTUIVQYERFLMIJ-LBPRGKRZSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1cccnc1CCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000296464448 1127672601 /nfs/dbraw/zinc/67/26/01/1127672601.db2.gz NLSJSMSKRFKVLS-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1ccccc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000603838173 1127673803 /nfs/dbraw/zinc/67/38/03/1127673803.db2.gz DEKRQQRXPIZMHJ-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]12 ZINC000603847293 1127676135 /nfs/dbraw/zinc/67/61/35/1127676135.db2.gz PDUKWLZXSQMMHV-FRFSOERESA-N 1 0 288.391 3.995 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000296582944 1127676744 /nfs/dbraw/zinc/67/67/44/1127676744.db2.gz DYDJSFLCUHZVJE-QWRGUYRKSA-N 1 0 289.310 3.541 20 5 CHBDRO Cc1nsc(C)c1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000593996347 1127768103 /nfs/dbraw/zinc/76/81/03/1127768103.db2.gz QAJAYHIIOBWBPH-VIFPVBQESA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC2(CCCC2)C1 ZINC000174268320 1127885044 /nfs/dbraw/zinc/88/50/44/1127885044.db2.gz KESVQBRSDTWGOA-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C2(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000540753031 1127993313 /nfs/dbraw/zinc/99/33/13/1127993313.db2.gz KRJLFVOJGDVOEK-NSHDSACASA-N 1 0 290.363 3.587 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000324061628 1128005661 /nfs/dbraw/zinc/00/56/61/1128005661.db2.gz BVPCYXPBWQOHJU-IAQYHMDHSA-N 1 0 262.353 3.680 20 5 CHBDRO CCCC[C@H](CC)C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000545517337 1128018415 /nfs/dbraw/zinc/01/84/15/1128018415.db2.gz LFGBOJYMVIYUCD-ZDUSSCGKSA-N 1 0 291.395 3.564 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)CC1(C)C ZINC000541771859 1128038746 /nfs/dbraw/zinc/03/87/46/1128038746.db2.gz RWMASAPNIZTRPO-NSHDSACASA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1cc(N[C@H](C)c2ccccc2[N+](=O)[O-])nc(C2CC2)n1 ZINC000271755847 1128053511 /nfs/dbraw/zinc/05/35/11/1128053511.db2.gz ZQIHRJKGDNKQSC-LLVKDONJSA-N 1 0 298.346 3.744 20 5 CHBDRO Cc1ccc([C@@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000542315456 1128062812 /nfs/dbraw/zinc/06/28/12/1128062812.db2.gz HTLJJXOBEHAVDP-QGZVFWFLSA-N 1 0 296.370 3.893 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1C[C@H](C)[C@@H](C)C1 ZINC000470182430 1128065181 /nfs/dbraw/zinc/06/51/81/1128065181.db2.gz LFLQSCROYNBAGZ-OBFMZJQYSA-N 1 0 274.364 3.586 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000470179225 1128065234 /nfs/dbraw/zinc/06/52/34/1128065234.db2.gz URHSLBGGJUBKFZ-OVHOFWQVSA-N 1 0 286.375 3.730 20 5 CHBDRO CCOc1cc(C[N@H+](CC(C)C)C(C)C)ccc1[N+](=O)[O-] ZINC000492534867 1128101415 /nfs/dbraw/zinc/10/14/15/1128101415.db2.gz KUGJWPRRVCSHGT-UHFFFAOYSA-N 1 0 294.395 3.860 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](CC)C2)ccc1[N+](=O)[O-] ZINC000492542638 1128102611 /nfs/dbraw/zinc/10/26/11/1128102611.db2.gz XGEUFIOKWUQPGQ-ZDUSSCGKSA-N 1 0 292.379 3.616 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1)C(C)(C)C ZINC000492785464 1128112960 /nfs/dbraw/zinc/11/29/60/1128112960.db2.gz TYZLMISTCUOMQT-AWEZNQCLSA-N 1 0 280.368 3.518 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@H](C)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000492788326 1128112974 /nfs/dbraw/zinc/11/29/74/1128112974.db2.gz IFNVYXNOICICCG-CHWSQXEVSA-N 1 0 292.379 3.614 20 5 CHBDRO CCOc1cc(C[N@@H+]2CC[C@H](C)[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492816884 1128113992 /nfs/dbraw/zinc/11/39/92/1128113992.db2.gz JKZRDAPAURMGMC-GXTWGEPZSA-N 1 0 292.379 3.614 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000492819596 1128114036 /nfs/dbraw/zinc/11/40/36/1128114036.db2.gz SUCSYSFSGVQXCY-CYBMUJFWSA-N 1 0 292.379 3.616 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)cc1Cl ZINC000761510153 1128132589 /nfs/dbraw/zinc/13/25/89/1128132589.db2.gz DSFLXQNLKFODEV-STQMWFEESA-N 1 0 294.782 3.870 20 5 CHBDRO C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519541 1128133214 /nfs/dbraw/zinc/13/32/14/1128133214.db2.gz BILLYDYJKVYZNX-SKDRFNHKSA-N 1 0 268.744 3.526 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCC2CCC2)cc1Cl ZINC000761528323 1128133590 /nfs/dbraw/zinc/13/35/90/1128133590.db2.gz QOWLSPCGBNCUQO-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CCC1 ZINC000761527993 1128133877 /nfs/dbraw/zinc/13/38/77/1128133877.db2.gz VMVMQMBCWKLKSQ-SECBINFHSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[C@@H](C[C@](C)(O)CC)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000926834573 1128196842 /nfs/dbraw/zinc/19/68/42/1128196842.db2.gz HBPLJNYLLCKQLZ-HEHGZKQESA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1cscc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000094877616 1128249150 /nfs/dbraw/zinc/24/91/50/1128249150.db2.gz QWFCHIWAJJOZNH-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@]2(C)CCCCO2)cccc1[N+](=O)[O-] ZINC000927025709 1128209025 /nfs/dbraw/zinc/20/90/25/1128209025.db2.gz YKAUQMYKUOMONI-XJKSGUPXSA-N 1 0 292.379 3.513 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCS[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000927029880 1128209848 /nfs/dbraw/zinc/20/98/48/1128209848.db2.gz GFKYWKZEGRVYOG-MDZLAQPJSA-N 1 0 280.393 3.530 20 5 CHBDRO CC(C)=CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193351383 1128280620 /nfs/dbraw/zinc/28/06/20/1128280620.db2.gz OBXFOPIEHFZFET-OAHLLOKOSA-N 1 0 260.337 3.528 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)nc1 ZINC000930208261 1128307483 /nfs/dbraw/zinc/30/74/83/1128307483.db2.gz LJLNXYHFSLZNSD-GHMZBOCLSA-N 1 0 289.310 3.541 20 5 CHBDRO CC1CC[NH+](CCCCNc2ccccc2[N+](=O)[O-])CC1 ZINC000301097315 1128335959 /nfs/dbraw/zinc/33/59/59/1128335959.db2.gz NEYLCICXBQBTGK-UHFFFAOYSA-N 1 0 291.395 3.519 20 5 CHBDRO CCOCC(C)(C)C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000561782510 1128353519 /nfs/dbraw/zinc/35/35/19/1128353519.db2.gz NLOKDLRAOGNTOC-ZDUSSCGKSA-N 1 0 294.395 3.617 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C1CC=CC1 ZINC000130506120 1128493684 /nfs/dbraw/zinc/49/36/84/1128493684.db2.gz IHXOKNYQBWPKIY-XJKSGUPXSA-N 1 0 286.375 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000917835794 1128521837 /nfs/dbraw/zinc/52/18/37/1128521837.db2.gz JLFQXDLKBWJPNQ-OAHLLOKOSA-N 1 0 292.354 3.889 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C(C)(C)CC(C)(C)C ZINC000042254642 1128570717 /nfs/dbraw/zinc/57/07/17/1128570717.db2.gz FQKRXGFWEOALCT-UHFFFAOYSA-N 1 0 294.395 3.908 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C2(CF)CCC2)cc1[N+](=O)[O-] ZINC000567898357 1128574027 /nfs/dbraw/zinc/57/40/27/1128574027.db2.gz NGARKCFRAFJARP-UHFFFAOYSA-N 1 0 280.343 3.700 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000037565824 1128623612 /nfs/dbraw/zinc/62/36/12/1128623612.db2.gz GXNOQFMEHLDAMP-DOMZBBRYSA-N 1 0 282.343 3.585 20 5 CHBDRO CC[C@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000072712548 1128628919 /nfs/dbraw/zinc/62/89/19/1128628919.db2.gz OBIUTZVXTJWJNT-NSHDSACASA-N 1 0 250.342 3.606 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000046089168 1128658048 /nfs/dbraw/zinc/65/80/48/1128658048.db2.gz DGXZDEIPHGUYHJ-HNNXBMFYSA-N 1 0 288.372 3.993 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1CCCC12CC2 ZINC000601289367 1128709027 /nfs/dbraw/zinc/70/90/27/1128709027.db2.gz MFZFCWPQSATVRH-HIFRSBDPSA-N 1 0 272.348 3.504 20 5 CHBDRO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609704832 1128723209 /nfs/dbraw/zinc/72/32/09/1128723209.db2.gz QVYWFUWIZAGBRX-PHIMTYICSA-N 1 0 282.771 3.726 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609846148 1128728094 /nfs/dbraw/zinc/72/80/94/1128728094.db2.gz HSTXBMTUANMIFS-TYNCELHUSA-N 1 0 292.354 3.887 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000049525958 1117765242 /nfs/dbraw/zinc/76/52/42/1117765242.db2.gz OTWILQZVXVADTL-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610001921 1128734288 /nfs/dbraw/zinc/73/42/88/1128734288.db2.gz LZHPQYKFSHOUEW-UKRRQHHQSA-N 1 0 276.380 3.995 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215363 1117882230 /nfs/dbraw/zinc/88/22/30/1117882230.db2.gz HJLWBGMZXAOIMM-KGLIPLIRSA-N 1 0 276.380 3.648 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000109133984 1117919912 /nfs/dbraw/zinc/91/99/12/1117919912.db2.gz APHVWMYQUIYDBB-UWVGGRQHSA-N 1 0 270.760 3.772 20 5 CHBDRO Cc1ccsc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000037775536 1118037277 /nfs/dbraw/zinc/03/72/77/1118037277.db2.gz QJTGOESBMWCYHL-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000610369523 1118362009 /nfs/dbraw/zinc/36/20/09/1118362009.db2.gz KUFNWEVDXSFLNZ-STQMWFEESA-N 1 0 286.331 3.738 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(C3CCCC3)CC2)c1 ZINC000610370854 1118363123 /nfs/dbraw/zinc/36/31/23/1118363123.db2.gz QEGFNAMGVAKXBO-UHFFFAOYSA-N 1 0 288.391 3.997 20 5 CHBDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000071117714 1118436617 /nfs/dbraw/zinc/43/66/17/1118436617.db2.gz ACUCVNYASBUGFW-TZMCWYRMSA-N 1 0 262.353 3.653 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C(C2CCC2)C2CCC2)c1 ZINC000380256115 1118508406 /nfs/dbraw/zinc/50/84/06/1118508406.db2.gz QXSKCKAOIJMQDS-UHFFFAOYSA-N 1 0 274.364 3.653 20 5 CHBDRO Cc1cccc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])c1 ZINC000157298176 1118631595 /nfs/dbraw/zinc/63/15/95/1118631595.db2.gz LSGDEJZAVCHZQD-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC=C(c2ccco2)C1 ZINC000348676166 1118644866 /nfs/dbraw/zinc/64/48/66/1118644866.db2.gz RYYVMNHAZIPUOV-UHFFFAOYSA-N 1 0 298.342 3.786 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)(C)C ZINC000610581098 1118777851 /nfs/dbraw/zinc/77/78/51/1118777851.db2.gz IRQSLNXYNYLFOU-SNVBAGLBSA-N 1 0 291.351 3.602 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCC[C@@H]1CCCF ZINC000510671354 1118785613 /nfs/dbraw/zinc/78/56/13/1118785613.db2.gz ZLHCIONWOLPDSG-UKRRQHHQSA-N 1 0 294.370 3.645 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H](C)C2CC2)cccc1[N+](=O)[O-] ZINC000610805338 1118892724 /nfs/dbraw/zinc/89/27/24/1118892724.db2.gz SCFHXBLEWIONPQ-JQWIXIFHSA-N 1 0 262.353 3.600 20 5 CHBDRO CC[C@H](C)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000215663698 1118915852 /nfs/dbraw/zinc/91/58/52/1118915852.db2.gz BCYTUWDFYXRLTQ-LBPRGKRZSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@@H]2CCCF)cccc1[N+](=O)[O-] ZINC000510995241 1118932078 /nfs/dbraw/zinc/93/20/78/1118932078.db2.gz QXICSXNQKYPVIO-UKRRQHHQSA-N 1 0 294.370 3.911 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCCCS1)c1cccc([N+](=O)[O-])c1 ZINC000158086837 1118963379 /nfs/dbraw/zinc/96/33/79/1118963379.db2.gz SGCIIPIZCOGTIL-BXUZGUMPSA-N 1 0 280.393 3.531 20 5 CHBDRO CC1(C)CCC[C@@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000149896349 1119042508 /nfs/dbraw/zinc/04/25/08/1119042508.db2.gz OCZCDRHZMGARFV-CYBMUJFWSA-N 1 0 292.379 3.532 20 5 CHBDRO CC1=CCC[C@H](C)[C@@H]1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000479547358 1119124198 /nfs/dbraw/zinc/12/41/98/1119124198.db2.gz RIQJZNDIILJNQK-DZGCQCFKSA-N 1 0 274.364 3.677 20 5 CHBDRO CC1=CCC[C@H](C)[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000479548407 1119124291 /nfs/dbraw/zinc/12/42/91/1119124291.db2.gz ZGFPLSGEVSTTRX-XJKSGUPXSA-N 1 0 274.364 3.677 20 5 CHBDRO Cc1cc(F)ccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000050576859 1119139892 /nfs/dbraw/zinc/13/98/92/1119139892.db2.gz QWSOGFLQPOJSGY-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1ccccc1)C1CC1 ZINC000479874685 1119144977 /nfs/dbraw/zinc/14/49/77/1119144977.db2.gz POFJSKJHMXZSQA-KRWDZBQOSA-N 1 0 296.370 3.706 20 5 CHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCCF)c2ccccc2)c1 ZINC000180959287 1128824559 /nfs/dbraw/zinc/82/45/59/1128824559.db2.gz QQBZPIHHWLFZLS-INIZCTEOSA-N 1 0 288.322 3.633 20 5 CHBDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000121989410 1119255122 /nfs/dbraw/zinc/25/51/22/1119255122.db2.gz IICBFLLBLDOIKE-OLZOCXBDSA-N 1 0 294.395 3.757 20 5 CHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000248241895 1119336573 /nfs/dbraw/zinc/33/65/73/1119336573.db2.gz HLOCLQHTWUBMNR-UHFFFAOYSA-N 1 0 262.353 3.749 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000219244964 1119402848 /nfs/dbraw/zinc/40/28/48/1119402848.db2.gz KIVNATDPLGMZHB-VHRBIJSZSA-N 1 0 280.393 3.530 20 5 CHBDRO CS[C@H]1CCCC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000349958251 1119436229 /nfs/dbraw/zinc/43/62/29/1119436229.db2.gz ARDJFBYENJDQQY-HNNXBMFYSA-N 1 0 294.420 3.621 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000219697552 1119511192 /nfs/dbraw/zinc/51/11/92/1119511192.db2.gz FINOUWLVCUQVAS-IUODEOHRSA-N 1 0 262.353 3.605 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000310617966 1119783577 /nfs/dbraw/zinc/78/35/77/1119783577.db2.gz ASBGCCZEPDYKDL-LBPRGKRZSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2C[C@@H]2C)cc1[N+](=O)[O-] ZINC000414105065 1119900207 /nfs/dbraw/zinc/90/02/07/1119900207.db2.gz ZRMRXOSITKXOLH-CIQGVGRVSA-N 1 0 262.353 3.598 20 5 CHBDRO C[C@H]([NH2+]CCCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000148937586 1119980403 /nfs/dbraw/zinc/98/04/03/1119980403.db2.gz VJOWHWIYZHAJDI-VIFPVBQESA-N 1 0 276.258 3.588 20 5 CHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CC1 ZINC000122904646 1120028499 /nfs/dbraw/zinc/02/84/99/1120028499.db2.gz PSCHNTPMXMMFCJ-UHFFFAOYSA-N 1 0 286.331 3.697 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CS[C@H](C)C2)cc1[N+](=O)[O-] ZINC000414508015 1120105982 /nfs/dbraw/zinc/10/59/82/1120105982.db2.gz ZTUGVZJNJFQZAE-DGCLKSJQSA-N 1 0 294.420 3.702 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C/C=C\Cl ZINC000903446560 1120107743 /nfs/dbraw/zinc/10/77/43/1120107743.db2.gz YLMORZGXYMFHBG-RWIWAZIYSA-N 1 0 286.784 3.720 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1ccc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000311865464 1120112252 /nfs/dbraw/zinc/11/22/52/1120112252.db2.gz KSIZSJJTDUUPPA-SNVBAGLBSA-N 1 0 268.332 3.600 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)C(C)(C)C ZINC000542703550 1120124300 /nfs/dbraw/zinc/12/43/00/1120124300.db2.gz QKAUCBLUZSTWCQ-GFCCVEGCSA-N 1 0 264.369 3.770 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)CC2CC2)cc1[N+](=O)[O-] ZINC000153764106 1120173077 /nfs/dbraw/zinc/17/30/77/1120173077.db2.gz ICFPZCFQEITOSU-RYUDHWBXSA-N 1 0 292.379 3.833 20 5 CHBDRO CC(C)([NH2+]C/C=C\c1ccncc1)c1ccc([N+](=O)[O-])cc1 ZINC000487335879 1120175921 /nfs/dbraw/zinc/17/59/21/1120175921.db2.gz QTURNNZVJLOHMM-ARJAWSKDSA-N 1 0 297.358 3.528 20 5 CHBDRO Cc1c(C[N@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000051122456 1120216036 /nfs/dbraw/zinc/21/60/36/1120216036.db2.gz JCGNARARQRJODL-UHFFFAOYSA-N 1 0 270.332 3.535 20 5 CHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542882662 1120220593 /nfs/dbraw/zinc/22/05/93/1120220593.db2.gz CENHLVYXYMNLBE-RHSMWYFYSA-N 1 0 288.391 3.649 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000159008753 1120231341 /nfs/dbraw/zinc/23/13/41/1120231341.db2.gz YXQAFXFHHIFQFS-MRXNPFEDSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000104323357 1120289583 /nfs/dbraw/zinc/28/95/83/1120289583.db2.gz JAAOGAJWCBSQSZ-ZWNOBZJWSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1ccc([C@@H]2CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000541392602 1120313511 /nfs/dbraw/zinc/31/35/11/1120313511.db2.gz ISZDOCQVMLCVDW-MRXNPFEDSA-N 1 0 296.370 3.893 20 5 CHBDRO Cc1ccc([C@H]2CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000541392599 1120314323 /nfs/dbraw/zinc/31/43/23/1120314323.db2.gz ISZDOCQVMLCVDW-INIZCTEOSA-N 1 0 296.370 3.893 20 5 CHBDRO CSCC[C@H](C)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255173093 1120340171 /nfs/dbraw/zinc/34/01/71/1120340171.db2.gz JBKZEONLYGMVAS-WOLRVDTOSA-N 1 0 294.420 3.681 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@@H]1C(F)F)CCCC2 ZINC000417324669 1120427479 /nfs/dbraw/zinc/42/74/79/1120427479.db2.gz CWMCKZXMGNYAAV-MJBXVCDLSA-N 1 0 296.317 3.606 20 5 CHBDRO CC1(C)C[C@H]([NH2+]C[C@@H]2CC23CC3)c2cc([N+](=O)[O-])ccc21 ZINC000417334025 1120429629 /nfs/dbraw/zinc/42/96/29/1120429629.db2.gz GQOCTVDSKWDRFP-NHYWBVRUSA-N 1 0 286.375 3.707 20 5 CHBDRO CO[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)CC(C)C ZINC000417357714 1120435478 /nfs/dbraw/zinc/43/54/78/1120435478.db2.gz HDPOLWKYINQZKW-KGLIPLIRSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@H](CC[NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000315522872 1120461407 /nfs/dbraw/zinc/46/14/07/1120461407.db2.gz GGBPCGKJQHPOLU-OAHLLOKOSA-N 1 0 298.386 3.921 20 5 CHBDRO COc1ccc(C[NH2+][C@@H](C)CCC(C)C)cc1[N+](=O)[O-] ZINC000069051805 1120491202 /nfs/dbraw/zinc/49/12/02/1120491202.db2.gz VWILNGRYRBCXMZ-LBPRGKRZSA-N 1 0 280.368 3.518 20 5 CHBDRO Cc1ccc(C[N@@H+](C)C2Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000511650579 1120501433 /nfs/dbraw/zinc/50/14/33/1120501433.db2.gz XJWBHAHRTAKGFH-UHFFFAOYSA-N 1 0 296.370 3.502 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCC(F)(F)C1)CCC2 ZINC000618574961 1128921529 /nfs/dbraw/zinc/92/15/29/1128921529.db2.gz QMPYRXDZRTUKNE-SMDDNHRTSA-N 1 0 296.317 3.750 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000070113437 1120528058 /nfs/dbraw/zinc/52/80/58/1120528058.db2.gz CRBNQPYOPZOHTD-YRGRVCCFSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@@H](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000070112283 1120528446 /nfs/dbraw/zinc/52/84/46/1120528446.db2.gz WSVTZAUYTFNXFE-OSAQELSMSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1ncc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000123699388 1120542028 /nfs/dbraw/zinc/54/20/28/1120542028.db2.gz ABYMLFGUQRGUPE-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000922665291 1120577057 /nfs/dbraw/zinc/57/70/57/1120577057.db2.gz LSCGQBHEDJGKLD-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@@H]1C ZINC000020055204 1120581548 /nfs/dbraw/zinc/58/15/48/1120581548.db2.gz BQVYUJCANMICJI-YRGRVCCFSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1cscc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000094877615 1120584199 /nfs/dbraw/zinc/58/41/99/1120584199.db2.gz QWFCHIWAJJOZNH-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+](C2CCC2)C2CCC2)cc1 ZINC000429126942 1120670967 /nfs/dbraw/zinc/67/09/67/1120670967.db2.gz ALQFBCDNJRBWQC-UHFFFAOYSA-N 1 0 260.337 3.502 20 5 CHBDRO C[C@@H]1CCCCCN1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509141973 1120671666 /nfs/dbraw/zinc/67/16/66/1120671666.db2.gz VTCQGTGPXQRXTK-SNVBAGLBSA-N 1 0 284.306 3.638 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000070113345 1128941422 /nfs/dbraw/zinc/94/14/22/1128941422.db2.gz YJFOYVKQPGHZIF-JTNHKYCSSA-N 1 0 280.343 3.648 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000544612166 1120864168 /nfs/dbraw/zinc/86/41/68/1120864168.db2.gz UJBYBLWDYVKOBA-MRXNPFEDSA-N 1 0 274.364 3.668 20 5 CHBDRO CCSCC[C@@H](C)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000072901279 1120949917 /nfs/dbraw/zinc/94/99/17/1120949917.db2.gz UCPHQSSNNDTBRR-SNVBAGLBSA-N 1 0 288.438 3.620 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493002273 1120965486 /nfs/dbraw/zinc/96/54/86/1120965486.db2.gz IFBOMATWYUKCFZ-SNVBAGLBSA-N 1 0 268.744 3.623 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3ccccc32)c(F)c1 ZINC000313871830 1121004397 /nfs/dbraw/zinc/00/43/97/1121004397.db2.gz ZMSXSNCGQPPOEJ-MRXNPFEDSA-N 1 0 286.306 3.511 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000343979486 1121028383 /nfs/dbraw/zinc/02/83/83/1121028383.db2.gz NHZJAMIEMQLFRY-WFASDCNBSA-N 1 0 285.347 3.792 20 5 CHBDRO C[NH+](C)[C@H](CNc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000058913206 1121045176 /nfs/dbraw/zinc/04/51/76/1121045176.db2.gz BTEGGCJUMRLRPO-MRXNPFEDSA-N 1 0 291.395 3.517 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCC1(F)CCC1 ZINC000702501881 1121200736 /nfs/dbraw/zinc/20/07/36/1121200736.db2.gz GTOOBPHXRYXZNL-UHFFFAOYSA-N 1 0 286.734 3.620 20 5 CHBDRO C[NH+](C)Cc1ccccc1Nc1cc([N+](=O)[O-])ccc1F ZINC001175739139 1121444366 /nfs/dbraw/zinc/44/43/66/1121444366.db2.gz PLZGHUMIRZDRFB-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO CC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@H](C)C(C)C ZINC000509295199 1121518559 /nfs/dbraw/zinc/51/85/59/1121518559.db2.gz UHCPGYAEQMYZDR-SNVBAGLBSA-N 1 0 286.322 3.739 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC1CCCC1 ZINC000512672047 1121521632 /nfs/dbraw/zinc/52/16/32/1121521632.db2.gz FNCOXQVVTJOFJW-POHAHGRESA-N 1 0 274.364 3.730 20 5 CHBDRO C[C@@H]1CC[C@H]([N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000433037398 1121532682 /nfs/dbraw/zinc/53/26/82/1121532682.db2.gz FACAXIAXFLZVDJ-DOMBMUJNSA-N 1 0 274.364 3.728 20 5 CHBDRO C[C@H]([NH2+]C1CCC(F)(F)CC1)c1ccccc1[N+](=O)[O-] ZINC000611181452 1121629431 /nfs/dbraw/zinc/62/94/31/1121629431.db2.gz JTMOWZPHDDIPCT-JTQLQIEISA-N 1 0 284.306 3.823 20 5 CHBDRO CO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000611337059 1121638161 /nfs/dbraw/zinc/63/81/61/1121638161.db2.gz KNYLHSSKJBBKBB-NWANDNLSSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000611475899 1121650997 /nfs/dbraw/zinc/65/09/97/1121650997.db2.gz OOGYUPNFHQFALH-WDEREUQCSA-N 1 0 284.306 3.742 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000619723847 1129009111 /nfs/dbraw/zinc/00/91/11/1129009111.db2.gz OWYCLERAEYBJIA-LSDHHAIUSA-N 1 0 274.364 3.968 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC(C)(C)C1(C)C ZINC001180203376 1121963647 /nfs/dbraw/zinc/96/36/47/1121963647.db2.gz QOKOSMIGVRHGBA-UHFFFAOYSA-N 1 0 276.380 3.832 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001180348744 1121979494 /nfs/dbraw/zinc/97/94/94/1121979494.db2.gz ATMANGCKGAKOGN-LLVKDONJSA-N 1 0 284.787 3.815 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H](c2ccccc2)C2CC2)c1 ZINC000035053160 1122159958 /nfs/dbraw/zinc/15/99/58/1122159958.db2.gz BHMNDUVYPFITKX-KRWDZBQOSA-N 1 0 282.343 3.836 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1CCC1 ZINC000504911983 1122311787 /nfs/dbraw/zinc/31/17/87/1122311787.db2.gz ONFMCDHSXDUNSV-ZDUSSCGKSA-N 1 0 294.420 3.855 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@H]1CC=CCC1 ZINC000506741888 1122819507 /nfs/dbraw/zinc/81/95/07/1122819507.db2.gz CARHOOMEKFPMDU-ZIAGYGMSSA-N 1 0 274.364 3.944 20 5 CHBDRO CC(C)[C@H]1CCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507187522 1122845384 /nfs/dbraw/zinc/84/53/84/1122845384.db2.gz KUCUGMFMZULRPZ-SBJJXXPASA-N 1 0 274.364 3.728 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2CC2)s1 ZINC000102419063 1122919554 /nfs/dbraw/zinc/91/95/54/1122919554.db2.gz NRELVZGGHOUHTL-UHFFFAOYSA-N 1 0 274.345 3.575 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000507026621 1122920160 /nfs/dbraw/zinc/92/01/60/1122920160.db2.gz PFRAGUODDUWZHW-LBPRGKRZSA-N 1 0 250.342 3.524 20 5 CHBDRO Cc1cccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1C ZINC000507146010 1122929566 /nfs/dbraw/zinc/92/95/66/1122929566.db2.gz VCCCGPOQCQQIAQ-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000507672308 1122983143 /nfs/dbraw/zinc/98/31/43/1122983143.db2.gz JZCWEZKCBMAHOO-KRWDZBQOSA-N 1 0 296.370 3.659 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000507673608 1122983774 /nfs/dbraw/zinc/98/37/74/1122983774.db2.gz OZPUWMCMZSKUSQ-KRWDZBQOSA-N 1 0 296.370 3.659 20 5 CHBDRO Cc1cccc2c1CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000729477008 1122992442 /nfs/dbraw/zinc/99/24/42/1122992442.db2.gz JTUGQVSYIGWLTF-UHFFFAOYSA-N 1 0 296.370 3.504 20 5 CHBDRO C[C@@H]1CC=CC[C@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001198604684 1123001437 /nfs/dbraw/zinc/00/14/37/1123001437.db2.gz PQRXWGUSUIUVNB-ZWNOBZJWSA-N 1 0 280.755 3.693 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H]1CCCCC1(F)F ZINC000294119152 1123065020 /nfs/dbraw/zinc/06/50/20/1123065020.db2.gz DLPCDJIWYXTPJN-LBPRGKRZSA-N 1 0 284.306 3.510 20 5 CHBDRO Cc1c(C[N@@H+](C)C2Cc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000141373794 1123080264 /nfs/dbraw/zinc/08/02/64/1123080264.db2.gz VUFNTVLPLRDWJA-UHFFFAOYSA-N 1 0 296.370 3.502 20 5 CHBDRO CC(C)C1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000441467380 1123139028 /nfs/dbraw/zinc/13/90/28/1123139028.db2.gz PEDOMJFIAMRXKV-UHFFFAOYSA-N 1 0 276.380 3.505 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2C=CCC2)o1 ZINC000850359122 1123256864 /nfs/dbraw/zinc/25/68/64/1123256864.db2.gz XHLODILQGVYJTJ-LBPRGKRZSA-N 1 0 284.315 3.663 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCOC1CCCC1 ZINC000163259956 1129116856 /nfs/dbraw/zinc/11/68/56/1129116856.db2.gz KDKMAALIMDKDGD-CYBMUJFWSA-N 1 0 292.379 3.513 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C2(Cl)CC2)cc1[N+](=O)[O-] ZINC000925490892 1123572796 /nfs/dbraw/zinc/57/27/96/1123572796.db2.gz CVDRFDXLZCNDDA-QWRGUYRKSA-N 1 0 282.771 3.714 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CC(F)(F)C1 ZINC000862381509 1123805031 /nfs/dbraw/zinc/80/50/31/1123805031.db2.gz DEGNSOJPOWXWRR-VHSXEESVSA-N 1 0 284.306 3.679 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000025938366 1123843892 /nfs/dbraw/zinc/84/38/92/1123843892.db2.gz RUPVGUYRZFWLAR-QGZVFWFLSA-N 1 0 282.343 3.714 20 5 CHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC1CCC1 ZINC000475547608 1124007523 /nfs/dbraw/zinc/00/75/23/1124007523.db2.gz JYDMIZHYEHUALR-UXBLZVDNSA-N 1 0 274.364 3.730 20 5 CHBDRO Cc1c(C[N@@H+](CC2CCC2)C(C)C)cccc1[N+](=O)[O-] ZINC000444781552 1124059307 /nfs/dbraw/zinc/05/93/07/1124059307.db2.gz IPXOKVGIFAAGAS-UHFFFAOYSA-N 1 0 276.380 3.914 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](CC1CCC1)C(C)C ZINC000444788249 1124065544 /nfs/dbraw/zinc/06/55/44/1124065544.db2.gz ZRZWXKUGMGPKNH-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1ccc([N+](=O)[O-])cc1 ZINC000866449482 1124066027 /nfs/dbraw/zinc/06/60/27/1124066027.db2.gz WHQMYRIULBXXPF-LEWSCRJBSA-N 1 0 266.316 3.526 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)c(C)o1 ZINC000447587802 1124494799 /nfs/dbraw/zinc/49/47/99/1124494799.db2.gz RPANPQGTKBJIKG-LBPRGKRZSA-N 1 0 288.347 3.698 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000447597377 1124496025 /nfs/dbraw/zinc/49/60/25/1124496025.db2.gz FGHLPYCLBCPKIJ-FFSVYQOJSA-N 1 0 274.364 3.750 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCC2CCC2)c1 ZINC000123015682 1124553079 /nfs/dbraw/zinc/55/30/79/1124553079.db2.gz MVYAODXIQCNEIH-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO C[C@@H]([NH2+]C(C1CC1)C1CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027904 1124660070 /nfs/dbraw/zinc/66/00/70/1124660070.db2.gz MZOVRBVSVUQQDB-SECBINFHSA-N 1 0 278.327 3.573 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(F)(F)CC1 ZINC000449214309 1124670745 /nfs/dbraw/zinc/67/07/45/1124670745.db2.gz YCZAWLHGUBWJOF-NSHDSACASA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000872129516 1124690547 /nfs/dbraw/zinc/69/05/47/1124690547.db2.gz GSUZQAHKFKCUCU-VHSXEESVSA-N 1 0 290.285 3.976 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H]3C3CC3)o2)c1 ZINC000449423987 1124730173 /nfs/dbraw/zinc/73/01/73/1124730173.db2.gz ITUJLGZWKNIMLX-MRXNPFEDSA-N 1 0 298.342 3.839 20 5 CHBDRO Cc1c(C[NH2+][C@H]2c3ccccc3O[C@@H]2C)cccc1[N+](=O)[O-] ZINC000873127974 1124739966 /nfs/dbraw/zinc/73/99/66/1124739966.db2.gz YOZQXCRWDSGNDU-SJKOYZFVSA-N 1 0 298.342 3.515 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(C(F)F)CC1 ZINC000530364039 1125145782 /nfs/dbraw/zinc/14/57/82/1125145782.db2.gz KXJIWTKKDAFCGP-JTQLQIEISA-N 1 0 284.306 3.599 20 5 CHBDRO CCC(CC)[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000531344700 1125211011 /nfs/dbraw/zinc/21/10/11/1125211011.db2.gz WKYPDCGLYZBMMV-UHFFFAOYSA-N 1 0 280.343 3.887 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000532269695 1125246260 /nfs/dbraw/zinc/24/62/60/1125246260.db2.gz PDQXTXSAAVSKLH-LBPRGKRZSA-N 1 0 284.306 3.571 20 5 CHBDRO CC1(Nc2nc3ccccc3c3ccccc32)CC[NH2+]CC1 ZINC001168188858 1125365981 /nfs/dbraw/zinc/36/59/81/1125365981.db2.gz FFBCZGXTOZLCMS-UHFFFAOYSA-N 1 0 291.398 3.942 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2(C)CC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000883255210 1125385986 /nfs/dbraw/zinc/38/59/86/1125385986.db2.gz OEEGYXCXUKJVBJ-LLVKDONJSA-N 1 0 298.333 3.989 20 5 CHBDRO CC1(C)CCC[C@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000094324347 1129443329 /nfs/dbraw/zinc/44/33/29/1129443329.db2.gz UHFDSCPCBKHCFU-CYBMUJFWSA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774663 1129451655 /nfs/dbraw/zinc/45/16/55/1129451655.db2.gz NQHNAHCIITZFIK-BXUZGUMPSA-N 1 0 280.343 3.744 20 5 CHBDRO O=[N+]([O-])CC[NH2+][C@H](CC1CCCCC1)c1ccccc1 ZINC001168826413 1129674668 /nfs/dbraw/zinc/67/46/68/1129674668.db2.gz SWMWQUUDPFNPNJ-MRXNPFEDSA-N 1 0 276.380 3.564 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCNc2ccccc2)cccc1[N+](=O)[O-] ZINC000766514947 1129678368 /nfs/dbraw/zinc/67/83/68/1129678368.db2.gz JQDBBZCRIZDJIC-AWEZNQCLSA-N 1 0 299.374 3.666 20 5 CHBDRO CC[C@@H]([NH2+]CCNc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000766515359 1129678777 /nfs/dbraw/zinc/67/87/77/1129678777.db2.gz MPPFFDJKGVPOGB-QGZVFWFLSA-N 1 0 299.374 3.748 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001168980723 1129686845 /nfs/dbraw/zinc/68/68/45/1129686845.db2.gz GACPRARHDJTQGM-RCBQFDQVSA-N 1 0 294.370 3.702 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168979228 1129687038 /nfs/dbraw/zinc/68/70/38/1129687038.db2.gz XGAKLCVGFJQSCQ-ZBFHGGJFSA-N 1 0 298.386 3.683 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168979227 1129687237 /nfs/dbraw/zinc/68/72/37/1129687237.db2.gz XGAKLCVGFJQSCQ-HOCLYGCPSA-N 1 0 298.386 3.683 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cc(C)ccc1C ZINC001169000748 1129688313 /nfs/dbraw/zinc/68/83/13/1129688313.db2.gz BGDHJDOYLPXANI-BFYDXBDKSA-N 1 0 290.407 3.790 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C)cc1 ZINC001169006279 1129689287 /nfs/dbraw/zinc/68/92/87/1129689287.db2.gz XEHWNLJIZFVRSL-BHYGNILZSA-N 1 0 290.407 3.871 20 5 CHBDRO CSc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169004505 1129689310 /nfs/dbraw/zinc/68/93/10/1129689310.db2.gz RCLZMMVXBUPWOT-SCRDCRAPSA-N 1 0 294.420 3.505 20 5 CHBDRO C[C@H](c1ccc(Cl)cc1)[N@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035129 1129690864 /nfs/dbraw/zinc/69/08/64/1129690864.db2.gz AJWRXJWHXMXWQL-LALPHHSUSA-N 1 0 296.798 3.778 20 5 CHBDRO CC(C)CC[NH+](CCC(C)C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046373 1129691485 /nfs/dbraw/zinc/69/14/85/1129691485.db2.gz LIJZMGRHQCIADG-JKSUJKDBSA-N 1 0 284.444 3.826 20 5 CHBDRO Cc1ccccc1[C@H]1CCC[N@@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169055872 1129693409 /nfs/dbraw/zinc/69/34/09/1129693409.db2.gz QXBXTIXSMMUYRF-ZMSDIMECSA-N 1 0 288.391 3.577 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCc3cccc(C)c3C2)cc1[N+](=O)[O-] ZINC001169233320 1129711207 /nfs/dbraw/zinc/71/12/07/1129711207.db2.gz MWLDLMLZNQCFPI-UHFFFAOYSA-N 1 0 296.370 3.770 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]2CCCC[C@H]21 ZINC000801539205 1129925300 /nfs/dbraw/zinc/92/53/00/1129925300.db2.gz CXSQAJBAXYGXFR-OSAQELSMSA-N 1 0 292.354 3.744 20 5 CHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C[C@H]1CC=CCC1 ZINC000801539782 1129925771 /nfs/dbraw/zinc/92/57/71/1129925771.db2.gz PSUGUWRCFNXZNK-LBPRGKRZSA-N 1 0 278.327 3.522 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC3(CCCC3)C2)cc1F ZINC000801544753 1129926353 /nfs/dbraw/zinc/92/63/53/1129926353.db2.gz ACQYHCGUWYRDBP-UHFFFAOYSA-N 1 0 292.354 3.890 20 5 CHBDRO C[C@@H]1CC[C@H](C)[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000749925399 1130127600 /nfs/dbraw/zinc/12/76/00/1130127600.db2.gz VAPWJXFEMGROLI-MSRIBSCDSA-N 1 0 282.771 3.772 20 5 CHBDRO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000746662962 1130139632 /nfs/dbraw/zinc/13/96/32/1130139632.db2.gz IZYYPFFVODKCDS-UHFFFAOYSA-N 1 0 294.782 3.869 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000903286838 1130146452 /nfs/dbraw/zinc/14/64/52/1130146452.db2.gz HYGWSOSUOXUPCS-WBMJQRKESA-N 1 0 297.358 3.718 20 5 CHBDRO CCc1cccnc1[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000903288341 1130146726 /nfs/dbraw/zinc/14/67/26/1130146726.db2.gz YGOUDNUYGWCVDU-CHWSQXEVSA-N 1 0 299.374 3.964 20 5 CHBDRO CCCCC[C@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788499890 1130191279 /nfs/dbraw/zinc/19/12/79/1130191279.db2.gz WZPOHLYVVWNOPY-NWDGAFQWSA-N 1 0 279.384 3.796 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccc[nH]1 ZINC000788593575 1130196110 /nfs/dbraw/zinc/19/61/10/1130196110.db2.gz VAINCIXLCHWPHX-BDJLRTHQSA-N 1 0 299.374 3.996 20 5 CHBDRO CCc1ccccc1C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788602769 1130197060 /nfs/dbraw/zinc/19/70/60/1130197060.db2.gz NZXGOKIEWMKCAN-GFCCVEGCSA-N 1 0 299.374 3.590 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788740262 1130208124 /nfs/dbraw/zinc/20/81/24/1130208124.db2.gz QIHYXZOXGVNQTC-CHWSQXEVSA-N 1 0 299.374 3.631 20 5 CHBDRO CC(C)=CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811496140 1130613028 /nfs/dbraw/zinc/61/30/28/1130613028.db2.gz VQTICDHLFPCPKF-UHFFFAOYSA-N 1 0 289.162 3.957 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cc(Cl)cc(Cl)c1F ZINC001234930680 1130693710 /nfs/dbraw/zinc/69/37/10/1130693710.db2.gz QFKQOBZRDYKEAY-QMMMGPOBSA-N 1 0 281.178 3.606 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC000782502357 1130780578 /nfs/dbraw/zinc/78/05/78/1130780578.db2.gz FQYSQQLOPCQYIP-DJSGYFEHSA-N 1 0 292.354 3.744 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000694469814 1130787854 /nfs/dbraw/zinc/78/78/54/1130787854.db2.gz REKYYNHICJYGLS-CYBMUJFWSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783675808 1130846382 /nfs/dbraw/zinc/84/63/82/1130846382.db2.gz DYPZLGKWAUTUOQ-ZETCQYMHSA-N 1 0 296.676 3.679 20 5 CHBDRO C[NH2+][C@H]1CCN1Cc1c2ccccc2cc2ccccc21 ZINC001236166663 1130877648 /nfs/dbraw/zinc/87/76/48/1130877648.db2.gz IZMJCPAOLLTCAO-LJQANCHMSA-N 1 0 276.383 3.744 20 5 CHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000217229247 1130920351 /nfs/dbraw/zinc/92/03/51/1130920351.db2.gz DEVLHQRZMIDTFA-AWEZNQCLSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H]([NH2+]CCC1=CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815553032 1130998322 /nfs/dbraw/zinc/99/83/22/1130998322.db2.gz QFGAMIGAXPERBF-GFCCVEGCSA-N 1 0 289.379 3.718 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815581011 1131002477 /nfs/dbraw/zinc/00/24/77/1131002477.db2.gz VNZZQLRFENIEHN-GHMZBOCLSA-N 1 0 279.384 3.510 20 5 CHBDRO C[C@@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815620828 1131009229 /nfs/dbraw/zinc/00/92/29/1131009229.db2.gz CJFKZQOZSZZGKC-LLVKDONJSA-N 1 0 289.379 3.550 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2C[C@H]2C2CCC2)c1 ZINC000818231081 1131205905 /nfs/dbraw/zinc/20/59/05/1131205905.db2.gz UWSHLHHYZAKSSN-GXTWGEPZSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@@H](C[NH+](C)C)Oc1cccc2cc3ccccc3nc21 ZINC001228175316 1131823697 /nfs/dbraw/zinc/82/36/97/1131823697.db2.gz BXUTUUIKQXPEEN-ZDUSSCGKSA-N 1 0 280.371 3.717 20 5 CHBDRO C[NH+]1CCC(Oc2cccc3cc4ccccc4nc32)CC1 ZINC001228173684 1131823803 /nfs/dbraw/zinc/82/38/03/1131823803.db2.gz MPDSXAZJIMVJGV-UHFFFAOYSA-N 1 0 292.382 3.861 20 5 CHBDRO CC(=O)c1c(O[C@@H](C)C[N+](C)(C)C)ccc2ccccc21 ZINC001228253925 1131838946 /nfs/dbraw/zinc/83/89/46/1131838946.db2.gz VRGFVDMVPYNTKS-ZDUSSCGKSA-N 1 0 286.395 3.516 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC2(CCC2)C1 ZINC000348191944 1131895196 /nfs/dbraw/zinc/89/51/96/1131895196.db2.gz GIPQHGGUBZJNNX-ZDUSSCGKSA-N 1 0 274.364 3.922 20 5 CHBDRO C[C@H](Cc1cccs1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000036992518 1131985526 /nfs/dbraw/zinc/98/55/26/1131985526.db2.gz RSIQJONBLAXKNS-VXGBXAGGSA-N 1 0 290.388 3.938 20 5 CHBDRO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCC1 ZINC000037092740 1131993591 /nfs/dbraw/zinc/99/35/91/1131993591.db2.gz ANVIKFNANQAGKH-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1ccns1)c1cccc([N+](=O)[O-])c1 ZINC000716059471 1132003733 /nfs/dbraw/zinc/00/37/33/1132003733.db2.gz ZMNKIZSZWCSJSB-ZWNOBZJWSA-N 1 0 291.376 3.853 20 5 CHBDRO CC[C@@H](C)[N@H+](CC)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001171916483 1132110148 /nfs/dbraw/zinc/11/01/48/1132110148.db2.gz MIHFCDRDZBJQEH-GFCCVEGCSA-N 1 0 250.342 3.524 20 5 CHBDRO OC[C@@H]1CCC[N@@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001141722697 1132239500 /nfs/dbraw/zinc/23/95/00/1132239500.db2.gz FJSIXFKFLYAQQT-KRWDZBQOSA-N 1 0 291.394 3.950 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CC=CCC1)CC2 ZINC001172906082 1132348435 /nfs/dbraw/zinc/34/84/35/1132348435.db2.gz WKWJSZKYFLOERP-CVEARBPZSA-N 1 0 286.375 3.541 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CC=CCC1)CC2 ZINC001172906084 1132348736 /nfs/dbraw/zinc/34/87/36/1132348736.db2.gz WKWJSZKYFLOERP-HZPDHXFCSA-N 1 0 286.375 3.541 20 5 CHBDRO C[N@H+](CCC1CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919124 1132362244 /nfs/dbraw/zinc/36/22/44/1132362244.db2.gz DPUMDCJHBBFWAE-INIZCTEOSA-N 1 0 288.391 3.574 20 5 CHBDRO C[N@H+]([C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)(C)C ZINC001172910331 1132372663 /nfs/dbraw/zinc/37/26/63/1132372663.db2.gz LQEKPLULDHCAKC-AWEZNQCLSA-N 1 0 276.380 3.573 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)C(C)(C)C ZINC001173215737 1132411248 /nfs/dbraw/zinc/41/12/48/1132411248.db2.gz ZBVRFRMDAFHESF-NEPJUHHUSA-N 1 0 264.369 3.550 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC1(C)C ZINC001173217757 1132411605 /nfs/dbraw/zinc/41/16/05/1132411605.db2.gz FQWMREAUXIWYOR-SWLSCSKDSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@](C)(F)C1 ZINC001173221384 1132411895 /nfs/dbraw/zinc/41/18/95/1132411895.db2.gz HWZZSYPPQUDEEH-CZUORRHYSA-N 1 0 294.370 3.740 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C2CCCC1CCC2 ZINC001173231644 1132413593 /nfs/dbraw/zinc/41/35/93/1132413593.db2.gz NIYDBSPFEMKLJH-IUDNXUCKSA-N 1 0 288.391 3.933 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001173233715 1132413883 /nfs/dbraw/zinc/41/38/83/1132413883.db2.gz MLBDIBLCQIOCAQ-FRFSOERESA-N 1 0 288.391 3.790 20 5 CHBDRO Cc1cccc(C[N@@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173229189 1132414029 /nfs/dbraw/zinc/41/40/29/1132414029.db2.gz RISAZNYEYFHJRI-HNNXBMFYSA-N 1 0 298.386 3.966 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC001173233594 1132414184 /nfs/dbraw/zinc/41/41/84/1132414184.db2.gz JQVGBYHUUDBPHH-SUMWQHHRSA-N 1 0 299.374 3.662 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC001173233061 1132414403 /nfs/dbraw/zinc/41/44/03/1132414403.db2.gz GVIMSCXHIPLRFB-GUYCJALGSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCCC12CC2 ZINC001173235745 1132415131 /nfs/dbraw/zinc/41/51/31/1132415131.db2.gz ZAZNJTCGPJPMPK-CYBMUJFWSA-N 1 0 274.364 3.544 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(F)CCCCC1 ZINC001173211409 1132416356 /nfs/dbraw/zinc/41/63/56/1132416356.db2.gz RRDWBXDONCHUQO-ZDUSSCGKSA-N 1 0 294.370 3.788 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(C)CCCC1 ZINC001173210379 1132416416 /nfs/dbraw/zinc/41/64/16/1132416416.db2.gz KALMDFVOGVMIBN-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccnc([C@@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173212895 1132416565 /nfs/dbraw/zinc/41/65/65/1132416565.db2.gz CIXKCIOAPSPAHI-UONOGXRCSA-N 1 0 299.374 3.580 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C[NH+]3CC4(CCC4)C3)nc12 ZINC001232219468 1132439460 /nfs/dbraw/zinc/43/94/60/1132439460.db2.gz UPUHBUWNQYNRQV-UHFFFAOYSA-N 1 0 289.382 3.769 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1c(F)cccc1C(C)(C)C ZINC001233826646 1132685217 /nfs/dbraw/zinc/68/52/17/1132685217.db2.gz FWVPBXRGYUSHEK-LBPRGKRZSA-N 1 0 268.396 3.597 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCc1ccccc1-c1ccccc1 ZINC001206602486 1133725329 /nfs/dbraw/zinc/72/53/29/1133725329.db2.gz VBXNMTXJIRUNRP-MRXNPFEDSA-N 1 0 284.423 3.965 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2C[C@H]2C2CCCC2)c(F)c1 ZINC001207837868 1133851909 /nfs/dbraw/zinc/85/19/09/1133851909.db2.gz USUGBZCDBMSGBT-HIFRSBDPSA-N 1 0 292.354 3.650 20 5 CHBDRO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccccc1[N+](=O)[O-] ZINC000403659964 1134829178 /nfs/dbraw/zinc/82/91/78/1134829178.db2.gz XUCWOWAYKPRLJL-ODWCKFRGSA-N 1 0 292.404 3.672 20 5 CHBDRO c1ccc2c(c1)nc(O[C@@H]1CCCC[NH2+]C1)c1ccccc21 ZINC001217972196 1135033803 /nfs/dbraw/zinc/03/38/03/1135033803.db2.gz QMGRSOXSAQDMGQ-CQSZACIVSA-N 1 0 292.382 3.909 20 5 CHBDRO C[C@@H]1C[C@H](Oc2nccc3c4ccccc4ccc32)C[NH2+]1 ZINC001218048207 1135048821 /nfs/dbraw/zinc/04/88/21/1135048821.db2.gz UKVAKJCHLGUYDQ-OCCSQVGLSA-N 1 0 278.355 3.517 20 5 CHBDRO C[C@@H]1CC[NH2+]C[C@H]1Oc1nccc2c3ccccc3ccc21 ZINC001218044259 1135049324 /nfs/dbraw/zinc/04/93/24/1135049324.db2.gz RSTBFNDRWDUFMY-FZKQIMNGSA-N 1 0 292.382 3.765 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2O[C@@H]1C[C@H]2C[NH2+]C[C@@H]21 ZINC001218329316 1135088462 /nfs/dbraw/zinc/08/84/62/1135088462.db2.gz BENSNRHFCDKCJV-ZYSHUDEJSA-N 1 0 289.378 3.980 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2O[C@@H]1C=CC[NH2+]C1 ZINC001218338082 1135091052 /nfs/dbraw/zinc/09/10/52/1135091052.db2.gz SLZQHHSCFZDVNF-MRXNPFEDSA-N 1 0 275.351 3.900 20 5 CHBDRO C[C@H]1C[NH2+]CC[C@H]1Oc1nc2ccccc2c2ccccc21 ZINC001218419254 1135102119 /nfs/dbraw/zinc/10/21/19/1135102119.db2.gz LNTUTKQIDWYWGJ-SCLBCKFNSA-N 1 0 292.382 3.765 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@H]1[C@@H]2CC[C@H]1[NH2+]C2 ZINC001218443947 1135107034 /nfs/dbraw/zinc/10/70/34/1135107034.db2.gz CZPGYIKVYCAEMZ-XWIAVFTESA-N 1 0 290.366 3.517 20 5 CHBDRO CCCCc1ccc(CO[C@@H](C)C[N+](C)(C)C)cc1 ZINC001223848075 1135390466 /nfs/dbraw/zinc/39/04/66/1135390466.db2.gz RVSMVSFRUULGPR-HNNXBMFYSA-N 1 0 264.433 3.641 20 5 CHBDRO COc1ccc2cc([C@H](C)OCC[N+](C)(C)C)ccc2c1 ZINC001224776292 1135481236 /nfs/dbraw/zinc/48/12/36/1135481236.db2.gz UORDKABFHMYYOK-AWEZNQCLSA-N 1 0 288.411 3.632 20 5 CHBDRO CCC(C)(C)c1ccc(O[C@@H](C)C[N+](C)(C)C)cc1 ZINC001225532770 1135585145 /nfs/dbraw/zinc/58/51/45/1135585145.db2.gz AYUJTCREBGPGJY-AWEZNQCLSA-N 1 0 264.433 3.848 20 5 CHBDRO C[NH+]1C(C)(C)CC(Oc2cccc([N+](=O)[O-])c2)CC1(C)C ZINC001226763352 1135739180 /nfs/dbraw/zinc/73/91/80/1135739180.db2.gz QOPXRTHWXZIVLD-UHFFFAOYSA-N 1 0 292.379 3.625 20 5 CHBDRO C[NH+]1C(C)(C)CC(Oc2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC001227524025 1135842931 /nfs/dbraw/zinc/84/29/31/1135842931.db2.gz WEZVJDSKCOZXJG-UHFFFAOYSA-N 1 0 292.379 3.625 20 5 CHBDRO C[C@H]([NH2+]CC1(C)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000104437710 186002367 /nfs/dbraw/zinc/00/23/67/186002367.db2.gz BFTUISJQTKSDBP-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355078911 227376736 /nfs/dbraw/zinc/37/67/36/227376736.db2.gz BVVKVBWRXAHYFW-VWYCJHECSA-N 1 0 268.382 3.523 20 5 CHBDRO C[C@@H]([NH2+]CCCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000148937794 533375751 /nfs/dbraw/zinc/37/57/51/533375751.db2.gz VJOWHWIYZHAJDI-SECBINFHSA-N 1 0 276.258 3.588 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CCCCCF)C1CC1 ZINC000341925872 130129397 /nfs/dbraw/zinc/12/93/97/130129397.db2.gz VEERKPNLLDALDW-UHFFFAOYSA-N 1 0 280.343 3.699 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1 ZINC000020205133 171070871 /nfs/dbraw/zinc/07/08/71/171070871.db2.gz IIPGWCOFQNSIDB-NHYWBVRUSA-N 1 0 286.331 3.916 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000020526105 171239172 /nfs/dbraw/zinc/23/91/72/171239172.db2.gz UUMSSLZWCIPJKF-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@H](CCc1ccco1)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000020526229 171239387 /nfs/dbraw/zinc/23/93/87/171239387.db2.gz JKQIVBLLOXOEFH-CHWSQXEVSA-N 1 0 288.347 3.860 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000034994334 171922325 /nfs/dbraw/zinc/92/23/25/171922325.db2.gz GHBNJPRWGKOQSZ-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cccs1 ZINC000035139635 172008099 /nfs/dbraw/zinc/00/80/99/172008099.db2.gz VTNBHKIRNJGDGO-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO COc1cc[nH+]c(NC/C(C)=C/c2cccc([N+](=O)[O-])c2)c1 ZINC000468585556 225030542 /nfs/dbraw/zinc/03/05/42/225030542.db2.gz BSNOAMAOXXZNMP-XYOKQWHBSA-N 1 0 299.330 3.514 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)cs1 ZINC000344343172 225037623 /nfs/dbraw/zinc/03/76/23/225037623.db2.gz FOOGTPLRCYBBSJ-YNEHKIRRSA-N 1 0 280.393 3.715 20 5 CHBDRO Cc1c(C[NH2+][C@@H](c2cccnc2)C2CC2)cccc1[N+](=O)[O-] ZINC000347356212 226149693 /nfs/dbraw/zinc/14/96/93/226149693.db2.gz IFVSDPWBKYAQGH-QGZVFWFLSA-N 1 0 297.358 3.539 20 5 CHBDRO Cc1cc(N2CCC3(CCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302082807 227784964 /nfs/dbraw/zinc/78/49/64/227784964.db2.gz MDZVHGBTUPNFSB-UHFFFAOYSA-N 1 0 297.358 3.832 20 5 CHBDRO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000353664064 228141670 /nfs/dbraw/zinc/14/16/70/228141670.db2.gz FQXJDRUBFASGTF-ZDUSSCGKSA-N 1 0 282.343 3.542 20 5 CHBDRO Cc1c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000426768930 260279030 /nfs/dbraw/zinc/27/90/30/260279030.db2.gz DKWYRDNHYHUSAV-GJZGRUSLSA-N 1 0 274.364 3.525 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(F)c1 ZINC000518215546 260358664 /nfs/dbraw/zinc/35/86/64/260358664.db2.gz UYGXSUOBYABZAJ-HNNXBMFYSA-N 1 0 286.306 3.511 20 5 CHBDRO C[C@H](CNc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1ccccc1 ZINC000301228835 261331673 /nfs/dbraw/zinc/33/16/73/261331673.db2.gz DIFMNFAWCKRBGC-CQSZACIVSA-N 1 0 299.374 3.527 20 5 CHBDRO CSCCCCC[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000185160263 262043868 /nfs/dbraw/zinc/04/38/68/262043868.db2.gz FOCGTHKBDDJQJZ-VQHVLOKHSA-N 1 0 294.420 3.731 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H](C)CCOC)c1cccc([N+](=O)[O-])c1 ZINC000414194272 262816922 /nfs/dbraw/zinc/81/69/22/262816922.db2.gz IPPTURJLYHIQAZ-BBRMVZONSA-N 1 0 294.395 3.698 20 5 CHBDRO CCOC[C@@H]([NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000189357873 264293801 /nfs/dbraw/zinc/29/38/01/264293801.db2.gz MHEAANUMRMUEAL-JKSUJKDBSA-N 1 0 294.395 3.697 20 5 CHBDRO CCS[C@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000189484144 264302800 /nfs/dbraw/zinc/30/28/00/264302800.db2.gz GFAXIZYSWAETHL-ZFWWWQNUSA-N 1 0 294.420 3.749 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000134230354 264503921 /nfs/dbraw/zinc/50/39/21/264503921.db2.gz IJLIUXAENUIJIM-HNNXBMFYSA-N 1 0 286.306 3.511 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000094279064 265232511 /nfs/dbraw/zinc/23/25/11/265232511.db2.gz FGFIFCRGVIHMAJ-OAHLLOKOSA-N 1 0 276.380 3.696 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000094321450 265236685 /nfs/dbraw/zinc/23/66/85/265236685.db2.gz BSNHDCKWOLLJQD-FZMZJTMJSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000519001672 265289807 /nfs/dbraw/zinc/28/98/07/265289807.db2.gz MOAGPHGKKHPOTJ-GXTWGEPZSA-N 1 0 262.353 3.605 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CCCCF)cc1[N+](=O)[O-] ZINC000361060597 266775932 /nfs/dbraw/zinc/77/59/32/266775932.db2.gz MPHUBWGPFHIVQG-UHFFFAOYSA-N 1 0 268.332 3.558 20 5 CHBDRO COCCCC[N@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000418134140 267359646 /nfs/dbraw/zinc/35/96/46/267359646.db2.gz MBLKCWIFIDADQY-UHFFFAOYSA-N 1 0 294.395 3.577 20 5 CHBDRO CCC1(C)CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000507203838 267984741 /nfs/dbraw/zinc/98/47/41/267984741.db2.gz JWNCXENEKXBGDO-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1C2CCC1CC2 ZINC000527304363 327934209 /nfs/dbraw/zinc/93/42/09/327934209.db2.gz DOUUTVFIIUVFFV-XFXZXTDPSA-N 1 0 272.348 3.625 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1CCSCC1 ZINC000531717827 328028213 /nfs/dbraw/zinc/02/82/13/328028213.db2.gz BDLQMZDYCZICPV-LBPRGKRZSA-N 1 0 294.420 3.697 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)c2ccccc2F)cccc1[N+](=O)[O-] ZINC000048335025 328053166 /nfs/dbraw/zinc/05/31/66/328053166.db2.gz FELYBNHHUAWHCR-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000049127210 328341608 /nfs/dbraw/zinc/34/16/08/328341608.db2.gz FTHMRHNOXBBTCG-OCCSQVGLSA-N 1 0 264.369 3.988 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000049119640 328339971 /nfs/dbraw/zinc/33/99/71/328339971.db2.gz MIODRWHIKCJBCE-GOEBONIOSA-N 1 0 276.380 3.696 20 5 CHBDRO CCC1CCC([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000049120845 328340254 /nfs/dbraw/zinc/34/02/54/328340254.db2.gz AFOAEVATBTWIPB-UHFFFAOYSA-N 1 0 292.379 3.662 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CC=CCC2)c(Cl)c1 ZINC000049963838 328379959 /nfs/dbraw/zinc/37/99/59/328379959.db2.gz FPLNSUYEBJPYCT-LLVKDONJSA-N 1 0 280.755 3.694 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000049963608 328380077 /nfs/dbraw/zinc/38/00/77/328380077.db2.gz ORRBCIZXFJILSS-CYBMUJFWSA-N 1 0 270.760 3.772 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000050015600 328381734 /nfs/dbraw/zinc/38/17/34/328381734.db2.gz DGPQRZLQGKGWTJ-GFCCVEGCSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)Cc1ccncc1 ZINC000531993921 328386223 /nfs/dbraw/zinc/38/62/23/328386223.db2.gz LTGNZJCURDDEPB-UONOGXRCSA-N 1 0 299.374 3.580 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000348304006 328578416 /nfs/dbraw/zinc/57/84/16/328578416.db2.gz NOZZOBZPQRLWFU-CABCVRRESA-N 1 0 274.364 3.750 20 5 CHBDRO CCOc1cc(C[NH2+][C@H](C)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000576349717 327029255 /nfs/dbraw/zinc/02/92/55/327029255.db2.gz KBXRPJJTQMTMMQ-LLVKDONJSA-N 1 0 280.368 3.518 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC=C(c2ccccc2)C1 ZINC000560170682 327288422 /nfs/dbraw/zinc/28/84/22/327288422.db2.gz SFQFYRJPKXIPSD-UHFFFAOYSA-N 1 0 294.354 3.884 20 5 CHBDRO CCC1(C)CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000507185182 332793956 /nfs/dbraw/zinc/79/39/56/332793956.db2.gz YQHLYKYFLRXZCL-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO CCc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000151022966 327411883 /nfs/dbraw/zinc/41/18/83/327411883.db2.gz RXBLCQRTDXJSBF-UHFFFAOYSA-N 1 0 288.347 3.775 20 5 CHBDRO CCC(C)(C)[C@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000570041913 327565197 /nfs/dbraw/zinc/56/51/97/327565197.db2.gz PECVSYVWXHTLOJ-NSHDSACASA-N 1 0 280.368 3.518 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000300306487 332812423 /nfs/dbraw/zinc/81/24/23/332812423.db2.gz GSPMXODWJGTFBA-DYEKYZERSA-N 1 0 262.353 3.682 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]C[C@H]2CC=CCC2)cc1 ZINC000532785787 328810604 /nfs/dbraw/zinc/81/06/04/328810604.db2.gz IZCRSUFDLNDEKF-INIZCTEOSA-N 1 0 288.391 3.863 20 5 CHBDRO Cc1cc(N2C[C@@H](C)[C@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302157996 328831114 /nfs/dbraw/zinc/83/11/14/328831114.db2.gz JCOPGDRXBRTRLN-GHMZBOCLSA-N 1 0 285.347 3.544 20 5 CHBDRO CC1(C2CC2)CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000516606605 332824872 /nfs/dbraw/zinc/82/48/72/332824872.db2.gz PRVIUILHQKBERL-UHFFFAOYSA-N 1 0 292.354 3.746 20 5 CHBDRO CCC1(C)CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000507911003 332829716 /nfs/dbraw/zinc/82/97/16/332829716.db2.gz YQDNESMONLMFIU-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO CSC1(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000193663836 329060680 /nfs/dbraw/zinc/06/06/80/329060680.db2.gz KNOPZVSWGACREY-UHFFFAOYSA-N 1 0 294.420 3.703 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000193733619 329061377 /nfs/dbraw/zinc/06/13/77/329061377.db2.gz QLAKHFWQRJCDAI-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO CCSCC[C@@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000174026228 329157204 /nfs/dbraw/zinc/15/72/04/329157204.db2.gz XMNOANIIGUFVBQ-GFCCVEGCSA-N 1 0 282.409 3.558 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000179705890 329208011 /nfs/dbraw/zinc/20/80/11/329208011.db2.gz BYDKOAOHBCJEBN-MRXNPFEDSA-N 1 0 299.374 3.579 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000508993747 332854412 /nfs/dbraw/zinc/85/44/12/332854412.db2.gz YKMGSKBONIBLLU-YMTOWFKASA-N 1 0 284.306 3.541 20 5 CHBDRO CC(C)(CC[NH2+]Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000392840421 329390922 /nfs/dbraw/zinc/39/09/22/329390922.db2.gz RLNJMHBAPZGFCV-UHFFFAOYSA-N 1 0 262.353 3.511 20 5 CHBDRO C[NH+](C)C1CCC(Nc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000420632121 329780205 /nfs/dbraw/zinc/78/02/05/329780205.db2.gz WJKQKCVWAPAPRG-UHFFFAOYSA-N 1 0 297.786 3.533 20 5 CHBDRO Cc1c(C[N@@H+](C)C2CCC(F)(F)CC2)cccc1[N+](=O)[O-] ZINC000580467330 330143813 /nfs/dbraw/zinc/14/38/13/330143813.db2.gz NQFDBPHHPUTZLX-UHFFFAOYSA-N 1 0 298.333 3.913 20 5 CHBDRO CCC[C@H](NCC([NH3+])(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000423287412 330186250 /nfs/dbraw/zinc/18/62/50/330186250.db2.gz MCSKJYSYYTUELB-HNNXBMFYSA-N 1 0 293.411 3.543 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000396933638 330231634 /nfs/dbraw/zinc/23/16/34/330231634.db2.gz BWIWFHUHNHVNAT-UWVGGRQHSA-N 1 0 290.285 3.834 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000035253367 330244237 /nfs/dbraw/zinc/24/42/37/330244237.db2.gz WVVSUKIIHUTOLR-SMDDNHRTSA-N 1 0 262.353 3.572 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CCCC2CC2)cc1[N+](=O)[O-] ZINC000536856015 330252165 /nfs/dbraw/zinc/25/21/65/330252165.db2.gz CFLRIZZCRJVRAT-GFCCVEGCSA-N 1 0 292.379 3.834 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)o1 ZINC000424206551 330327765 /nfs/dbraw/zinc/32/77/65/330327765.db2.gz PEABLWDITCOWLN-CLLJXQQHSA-N 1 0 298.342 3.743 20 5 CHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CC23CC3)c2ccccc2)c1 ZINC000424325728 330341181 /nfs/dbraw/zinc/34/11/81/330341181.db2.gz OIXIOHNIDAMCOF-IRXDYDNUSA-N 1 0 294.354 3.826 20 5 CHBDRO CC(C)(C)CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000536882166 330360955 /nfs/dbraw/zinc/36/09/55/330360955.db2.gz KCAPHFMNHZVQHC-HNNXBMFYSA-N 1 0 290.407 3.942 20 5 CHBDRO C[C@@H]1CC([NH2+]Cc2csc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000084461342 330361818 /nfs/dbraw/zinc/36/18/18/330361818.db2.gz FFLGHMGNKWGZIE-UWVGGRQHSA-N 1 0 268.382 3.571 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(Cl)cs2)cc1 ZINC000093094614 330416985 /nfs/dbraw/zinc/41/69/85/330416985.db2.gz MXWAJNIZPALQNM-UHFFFAOYSA-N 1 0 282.752 3.600 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1 ZINC000123163916 330448690 /nfs/dbraw/zinc/44/86/90/330448690.db2.gz CXFGSGZTGXVRAI-LSDHHAIUSA-N 1 0 298.386 3.919 20 5 CHBDRO Cc1ccc(CC[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000429261022 330541193 /nfs/dbraw/zinc/54/11/93/330541193.db2.gz OLQLCSNHYDEILW-UHFFFAOYSA-N 1 0 298.386 3.971 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000437046226 330691922 /nfs/dbraw/zinc/69/19/22/330691922.db2.gz MNNOSFZGSPDCKJ-DRZSPHRISA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000449065700 330896651 /nfs/dbraw/zinc/89/66/51/330896651.db2.gz VSDSEYNDHIKLIY-NWDGAFQWSA-N 1 0 290.388 3.938 20 5 CHBDRO CCC[C@@H](CC)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449130247 330900804 /nfs/dbraw/zinc/90/08/04/330900804.db2.gz GEQXFXUVBWUNFM-GXTWGEPZSA-N 1 0 264.369 3.694 20 5 CHBDRO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CS1 ZINC000449348650 330917032 /nfs/dbraw/zinc/91/70/32/330917032.db2.gz MRVBBXZJNXNRKF-CORIIIEPSA-N 1 0 294.420 3.776 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449350459 330917369 /nfs/dbraw/zinc/91/73/69/330917369.db2.gz WFKNBVWBLCCYAT-KNXALSJPSA-N 1 0 274.364 3.824 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC(C)(F)F ZINC000449353865 330918023 /nfs/dbraw/zinc/91/80/23/330918023.db2.gz HRCKCJLMDWEQRU-DHZHZOJOSA-N 1 0 284.306 3.633 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470173823 331033431 /nfs/dbraw/zinc/03/34/31/331033431.db2.gz GCONPAXSKGHBMN-VOMSXAGXSA-N 1 0 274.364 3.873 20 5 CHBDRO C[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCCC1 ZINC000451992440 331049636 /nfs/dbraw/zinc/04/96/36/331049636.db2.gz HLNQHXQAVNPLSP-VIFPVBQESA-N 1 0 284.306 3.541 20 5 CHBDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000452029610 331051130 /nfs/dbraw/zinc/05/11/30/331051130.db2.gz DNENUZDUTUCBEI-DAXOMENPSA-N 1 0 292.379 3.593 20 5 CHBDRO CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000453250638 331107459 /nfs/dbraw/zinc/10/74/59/331107459.db2.gz YGOUDNUYGWCVDU-QWHCGFSZSA-N 1 0 299.374 3.964 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCC2CC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000453403870 331129050 /nfs/dbraw/zinc/12/90/50/331129050.db2.gz DFDHZVKMXFQPJB-NSHDSACASA-N 1 0 298.333 3.989 20 5 CHBDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000453409966 331129877 /nfs/dbraw/zinc/12/98/77/331129877.db2.gz RKRHPHSIVPVYMA-XNRPHZJLSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C1CC1)C1CCC1 ZINC000453438101 331131805 /nfs/dbraw/zinc/13/18/05/331131805.db2.gz VOIWSAAJEPKLRE-SJKOYZFVSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C1CC1)C1CCC1 ZINC000453438107 331131808 /nfs/dbraw/zinc/13/18/08/331131808.db2.gz VOIWSAAJEPKLRE-YVEFUNNKSA-N 1 0 288.391 3.694 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H](C1CC1)C1CCC1 ZINC000453627166 331137203 /nfs/dbraw/zinc/13/72/03/331137203.db2.gz UUNYJKIIGDQWHR-IOMDMTNGSA-N 1 0 286.375 3.776 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000164056748 331157405 /nfs/dbraw/zinc/15/74/05/331157405.db2.gz XHLBQDMOXCDDNN-OCCSQVGLSA-N 1 0 282.409 3.777 20 5 CHBDRO Cc1cc(NCc2cccc([N+](=O)[O-])c2)ccc1C[NH+](C)C ZINC000459741781 331297472 /nfs/dbraw/zinc/29/74/72/331297472.db2.gz NTQJYGJSQKYRTC-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO C[C@H]([NH2+]C1(C2CCC2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000459783252 331300720 /nfs/dbraw/zinc/30/07/20/331300720.db2.gz YTMAGIOPHNARNS-LBPRGKRZSA-N 1 0 274.364 3.968 20 5 CHBDRO CC[NH+](CC)CCS[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000461549299 331313898 /nfs/dbraw/zinc/31/38/98/331313898.db2.gz QUZVSZPALGCHFW-LBPRGKRZSA-N 1 0 282.409 3.731 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000464780608 331367810 /nfs/dbraw/zinc/36/78/10/331367810.db2.gz RLXJLTFDZNWUJJ-MRXNPFEDSA-N 1 0 276.380 3.915 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000464780607 331367947 /nfs/dbraw/zinc/36/79/47/331367947.db2.gz RLXJLTFDZNWUJJ-INIZCTEOSA-N 1 0 276.380 3.915 20 5 CHBDRO CCSCC[C@@H](C)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000464856935 331371497 /nfs/dbraw/zinc/37/14/97/331371497.db2.gz MZGSJBROOSATMV-CYBMUJFWSA-N 1 0 296.436 3.601 20 5 CHBDRO CC/C=C/CC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000467454365 331420397 /nfs/dbraw/zinc/42/03/97/331420397.db2.gz PABYFKKGYDUCHK-URWSZGRFSA-N 1 0 262.353 3.910 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[C@H](C)C1 ZINC000468592629 331437405 /nfs/dbraw/zinc/43/74/05/331437405.db2.gz VIDHLQRGWQUVMV-KDUJCLPVSA-N 1 0 274.364 3.776 20 5 CHBDRO Cc1cccc2c1CC[C@@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000478496884 331707509 /nfs/dbraw/zinc/70/75/09/331707509.db2.gz HTSJMRZXBBNRLY-KRWDZBQOSA-N 1 0 296.370 3.989 20 5 CHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C(F)(F)F ZINC000479580006 331738658 /nfs/dbraw/zinc/73/86/58/331738658.db2.gz DDZURYAELBPLPC-SSDOTTSWSA-N 1 0 296.676 3.536 20 5 CHBDRO CC(C)=CCC[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000480301742 331766978 /nfs/dbraw/zinc/76/69/78/331766978.db2.gz QNBPOTKQQLBDFG-TWGQIWQCSA-N 1 0 260.337 3.554 20 5 CHBDRO CC(C)[C@@H](C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000484160487 331893739 /nfs/dbraw/zinc/89/37/39/331893739.db2.gz LJJDYSNLFPPUDW-XJKSGUPXSA-N 1 0 290.407 3.798 20 5 CHBDRO CC[N@H+](Cc1ccccc1C)Cc1ccccc1[N+](=O)[O-] ZINC000488388172 332003397 /nfs/dbraw/zinc/00/33/97/332003397.db2.gz GCSXILUQYZUXGR-UHFFFAOYSA-N 1 0 284.359 3.925 20 5 CHBDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])CS1 ZINC000488420178 332006005 /nfs/dbraw/zinc/00/60/05/332006005.db2.gz PWJJBRDNFOVKFM-TZMCWYRMSA-N 1 0 294.420 3.605 20 5 CHBDRO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CS1 ZINC000488447814 332009869 /nfs/dbraw/zinc/00/98/69/332009869.db2.gz XUFMIGYYXFTNOQ-SLEUVZQESA-N 1 0 294.420 3.776 20 5 CHBDRO CCC1(C)CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000489105333 332041441 /nfs/dbraw/zinc/04/14/41/332041441.db2.gz YSRFINUODHBETR-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO COc1cc(C[N@@H+]2CCC[C@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000489140073 332042394 /nfs/dbraw/zinc/04/23/94/332042394.db2.gz PFTNKWQDCYXVOG-AWEZNQCLSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CC(C)(C)C ZINC000489142077 332042418 /nfs/dbraw/zinc/04/24/18/332042418.db2.gz UVGUAEXOOWXDCC-GFCCVEGCSA-N 1 0 264.369 3.942 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CC1CCC1 ZINC000489233485 332044074 /nfs/dbraw/zinc/04/40/74/332044074.db2.gz PZJPUJJDFUVNPF-LBPRGKRZSA-N 1 0 262.353 3.696 20 5 CHBDRO C[C@@H]1C[C@H]1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000490164320 332083228 /nfs/dbraw/zinc/08/32/28/332083228.db2.gz LKIZKZXANGLYGQ-SKDZVZGDSA-N 1 0 296.370 3.930 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)cc1 ZINC000491575349 332240904 /nfs/dbraw/zinc/24/09/04/332240904.db2.gz ZQVZSTCLQHGUAC-CYBMUJFWSA-N 1 0 298.333 3.900 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H]1CCCCC(F)(F)C1 ZINC000491586695 332241456 /nfs/dbraw/zinc/24/14/56/332241456.db2.gz QBPDRRCROBSJKW-GFCCVEGCSA-N 1 0 298.333 3.900 20 5 CHBDRO CC(C)([NH2+]C[C@H]1CC=CCC1)c1ccccc1[N+](=O)[O-] ZINC000492238295 332388497 /nfs/dbraw/zinc/38/84/97/332388497.db2.gz FGTRWUQMBKXZBM-ZDUSSCGKSA-N 1 0 274.364 3.776 20 5 CHBDRO CCCC[N@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)C1CC1 ZINC000492458408 332398391 /nfs/dbraw/zinc/39/83/91/332398391.db2.gz CKGWJAQNYJJFFZ-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO CCC[NH+](CCC)Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492461292 332398655 /nfs/dbraw/zinc/39/86/55/332398655.db2.gz KGCYYMQUIOMYLR-UHFFFAOYSA-N 1 0 280.368 3.616 20 5 CHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C2CCC2)c2ccccc2)c1 ZINC000494054343 332462269 /nfs/dbraw/zinc/46/22/69/332462269.db2.gz BWXJCWOWCYFTIS-QGZVFWFLSA-N 1 0 282.343 3.826 20 5 CHBDRO C[C@@H]([NH2+]C1CC(OC(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000494988306 332498006 /nfs/dbraw/zinc/49/80/06/332498006.db2.gz NOOIWJIOSYYIKM-PNESKVBLSA-N 1 0 292.379 3.592 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000251978745 334372649 /nfs/dbraw/zinc/37/26/49/334372649.db2.gz YOEAELYWXYIKPF-BZPMIXESSA-N 1 0 262.353 3.509 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2ccc3occc3c2)c1 ZINC000512056417 332952360 /nfs/dbraw/zinc/95/23/60/332952360.db2.gz GIMCMVSPLXUKRP-UHFFFAOYSA-N 1 0 296.326 3.673 20 5 CHBDRO CC(C)(C)C(C)(C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000310496146 333059187 /nfs/dbraw/zinc/05/91/87/333059187.db2.gz IITOMNRCGUJVIC-UHFFFAOYSA-N 1 0 256.371 3.571 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCCCCC2)c(Cl)c1 ZINC000310805549 333061607 /nfs/dbraw/zinc/06/16/07/333061607.db2.gz URETZZKDPODMPA-UHFFFAOYSA-N 1 0 268.744 3.624 20 5 CHBDRO CC[C@H](C)C[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000088295550 333088023 /nfs/dbraw/zinc/08/80/23/333088023.db2.gz XXVPFXLBBSQMQH-NWDGAFQWSA-N 1 0 250.342 3.509 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC[C@@H](F)C1 ZINC000517235846 333095462 /nfs/dbraw/zinc/09/54/62/333095462.db2.gz WTWNQEDJFBPMTH-QMPFAZFSSA-N 1 0 292.354 3.868 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCC[C@H]2F)cc1[N+](=O)[O-] ZINC000521235068 333116025 /nfs/dbraw/zinc/11/60/25/333116025.db2.gz IXQRJXLDRASBDV-KGLIPLIRSA-N 1 0 280.343 3.698 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CCOC(C)(C)C)cc1[N+](=O)[O-] ZINC000521833873 333192188 /nfs/dbraw/zinc/19/21/88/333192188.db2.gz GTXSVKWHYAOLFG-UHFFFAOYSA-N 1 0 294.395 3.623 20 5 CHBDRO COc1ccc(C[NH2+]CC2(C)CCCCC2)cc1[N+](=O)[O-] ZINC000229587580 333306644 /nfs/dbraw/zinc/30/66/44/333306644.db2.gz GMHPLCXFRPOYQU-UHFFFAOYSA-N 1 0 292.379 3.663 20 5 CHBDRO Cc1cc(C)cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000231883996 333331032 /nfs/dbraw/zinc/33/10/32/333331032.db2.gz CMTWUPWRVYCGFO-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO CC[C@@H]1CCC[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000231884372 333331326 /nfs/dbraw/zinc/33/13/26/333331326.db2.gz KCTGGQJFIOUQAA-TZMCWYRMSA-N 1 0 262.353 3.572 20 5 CHBDRO CCC[C@H]([NH2+]CC=C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000233358522 333351828 /nfs/dbraw/zinc/35/18/28/333351828.db2.gz MQYMCQPLIVECEV-HNNXBMFYSA-N 1 0 262.353 3.992 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CSC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000338776874 335138394 /nfs/dbraw/zinc/13/83/94/335138394.db2.gz VUDBJZKDHYECDG-ZIAGYGMSSA-N 1 0 294.420 3.920 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CSC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000338776870 335138404 /nfs/dbraw/zinc/13/84/04/335138404.db2.gz VUDBJZKDHYECDG-KBPBESRZSA-N 1 0 294.420 3.920 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CC1(C)C ZINC000397796432 333428785 /nfs/dbraw/zinc/42/87/85/333428785.db2.gz QWVBWVYPMULKLA-MISXGVKJSA-N 1 0 262.353 3.680 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CS[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000397941649 333431299 /nfs/dbraw/zinc/43/12/99/333431299.db2.gz VAJDLQSAJUHFEL-SUHUHFCYSA-N 1 0 280.393 3.530 20 5 CHBDRO C[C@@H]([NH2+]CCCc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000537950660 333549579 /nfs/dbraw/zinc/54/95/79/333549579.db2.gz HSQXCOVCTPSQNS-GFCCVEGCSA-N 1 0 290.388 3.940 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC(C(F)F)CC1 ZINC000538735808 333620792 /nfs/dbraw/zinc/62/07/92/333620792.db2.gz DWNYLEZHIOELTH-HWKANZROSA-N 1 0 296.317 3.585 20 5 CHBDRO CCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000541771364 333791457 /nfs/dbraw/zinc/79/14/57/333791457.db2.gz YSCGYCLYXNXKPU-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC000078465687 334134218 /nfs/dbraw/zinc/13/42/18/334134218.db2.gz WBOCSCKHXMQRPQ-IOASZLSFSA-N 1 0 276.380 3.552 20 5 CHBDRO CC(C)([NH2+]Cc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000080347410 334170594 /nfs/dbraw/zinc/17/05/94/334170594.db2.gz QEDCWTBSZUMNQA-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO Cc1cccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000080347162 334170641 /nfs/dbraw/zinc/17/06/41/334170641.db2.gz OSFNCBFILWNMIK-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO CC(C)(C)C1CC([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000550257369 334217804 /nfs/dbraw/zinc/21/78/04/334217804.db2.gz YVCFCQFVXUCXBF-UHFFFAOYSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]([NH2+]CC(C1CC1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000088455500 334338755 /nfs/dbraw/zinc/33/87/55/334338755.db2.gz UIEWQFPSZHYAPQ-LLVKDONJSA-N 1 0 274.364 3.682 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2C=CCCC2)cc1[N+](=O)[O-] ZINC000090392827 334360068 /nfs/dbraw/zinc/36/00/68/334360068.db2.gz HXODSMINGVEXJO-TZMCWYRMSA-N 1 0 260.337 3.663 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000554363867 334424795 /nfs/dbraw/zinc/42/47/95/334424795.db2.gz OFLSFNTXIDQSJS-ZIAGYGMSSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000555702934 334487445 /nfs/dbraw/zinc/48/74/45/334487445.db2.gz NEDCAPWVRNZHQG-NEPJUHHUSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)CC2CC2)cccc1[N+](=O)[O-] ZINC000164305213 334880065 /nfs/dbraw/zinc/88/00/65/334880065.db2.gz YYDAKQGVANBHOD-ZYHUDNBSSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC(F)(F)F ZINC000577928033 335421872 /nfs/dbraw/zinc/42/18/72/335421872.db2.gz ZGSZHVZPWCWKNO-SNVBAGLBSA-N 1 0 290.285 3.896 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccoc2)cc1[N+](=O)[O-] ZINC000181235336 335755614 /nfs/dbraw/zinc/75/56/14/335755614.db2.gz QVGHISXTZAMGAX-NEPJUHHUSA-N 1 0 274.320 3.908 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)[C@@H]1CCCO1 ZINC000181739746 335781773 /nfs/dbraw/zinc/78/17/73/335781773.db2.gz MASNXKNYJDSSEK-RCBQFDQVSA-N 1 0 292.379 3.511 20 5 CHBDRO CCC[C@@H]([NH2+]CCC[C@@H](O)CC)c1cccc([N+](=O)[O-])c1 ZINC000358175645 335801457 /nfs/dbraw/zinc/80/14/57/335801457.db2.gz ZBDPIXYBMGIOTC-JKSUJKDBSA-N 1 0 294.395 3.577 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000195670006 336058183 /nfs/dbraw/zinc/05/81/83/336058183.db2.gz OKKHOSUIYOCYDE-CJNGLKHVSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000381386861 336061130 /nfs/dbraw/zinc/06/11/30/336061130.db2.gz LVAUVDLMQIQQPN-ABAIWWIYSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000353657913 534073423 /nfs/dbraw/zinc/07/34/23/534073423.db2.gz VFHYDXQYHKPLFT-CYBMUJFWSA-N 1 0 282.343 3.542 20 5 CHBDRO CCC[C@@H](CC)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000050404150 517596956 /nfs/dbraw/zinc/59/69/56/517596956.db2.gz GHWPFPNOYVPCHQ-CYBMUJFWSA-N 1 0 250.342 3.572 20 5 CHBDRO CC1(C)C[C@H]([NH2+]Cc2ccco2)c2cc([N+](=O)[O-])ccc21 ZINC000279227562 520555427 /nfs/dbraw/zinc/55/54/27/520555427.db2.gz ZRMXHZFVOHNKRC-HNNXBMFYSA-N 1 0 286.331 3.700 20 5 CHBDRO CCC[C@@H]([NH2+]C1CC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000277219443 520768139 /nfs/dbraw/zinc/76/81/39/520768139.db2.gz XMWLFEPEGAOSSS-CYBMUJFWSA-N 1 0 284.306 3.823 20 5 CHBDRO CCc1ccccc1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000084200837 521840170 /nfs/dbraw/zinc/84/01/70/521840170.db2.gz FZADSNALYPCOPC-UHFFFAOYSA-N 1 0 276.361 3.509 20 5 CHBDRO COC1(C[C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CCC1 ZINC000277104424 522637992 /nfs/dbraw/zinc/63/79/92/522637992.db2.gz LXDUAHXAFLMXEK-CHWSQXEVSA-N 1 0 292.379 3.593 20 5 CHBDRO COC1(C[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000277063425 522639654 /nfs/dbraw/zinc/63/96/54/522639654.db2.gz IEXJAJOYUMDBSU-CHWSQXEVSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000037010510 522914065 /nfs/dbraw/zinc/91/40/65/522914065.db2.gz ZBVJFJFYGXWTKP-SWLSCSKDSA-N 1 0 285.347 3.792 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](CC)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000161630066 522920249 /nfs/dbraw/zinc/92/02/49/522920249.db2.gz SHRQPRHNBRZOMX-LSDHHAIUSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000290300083 522965438 /nfs/dbraw/zinc/96/54/38/522965438.db2.gz BEBUIMUQFRQEKG-MRXNPFEDSA-N 1 0 299.374 3.881 20 5 CHBDRO CO[C@@]1(C)CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000280495954 523807377 /nfs/dbraw/zinc/80/73/77/523807377.db2.gz MOKFQNORUOMEGB-BBRMVZONSA-N 1 0 292.379 3.547 20 5 CHBDRO Cc1cccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1C ZINC000048068869 524435285 /nfs/dbraw/zinc/43/52/85/524435285.db2.gz IAOUIDVFIOPMGD-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO C[C@H]([NH2+]CCCC(C)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000297257310 525330576 /nfs/dbraw/zinc/33/05/76/525330576.db2.gz JSGNICJZSYXBIV-JTQLQIEISA-N 1 0 272.295 3.681 20 5 CHBDRO C[C@H]([NH2+]C[C@]1(C)CCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000126465657 525425582 /nfs/dbraw/zinc/42/55/82/525425582.db2.gz DFKJOHSUNGEICF-FZMZJTMJSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@@H]([NH2+]CCCCC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000127223173 525432511 /nfs/dbraw/zinc/43/25/11/525432511.db2.gz KGCVCDIFPPEBLM-SNVBAGLBSA-N 1 0 290.285 3.978 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000156728668 525739445 /nfs/dbraw/zinc/73/94/45/525739445.db2.gz FEHVGBPRKHXJJV-GUTXKFCHSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)C)cc1[N+](=O)[O-] ZINC000040492738 525917717 /nfs/dbraw/zinc/91/77/17/525917717.db2.gz RKROPCKIAGTKFB-NSHDSACASA-N 1 0 250.342 3.600 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@]2(C)CCCS2)cccc1[N+](=O)[O-] ZINC000120444101 525918054 /nfs/dbraw/zinc/91/80/54/525918054.db2.gz RKPIEPPSTSTOHP-SWLSCSKDSA-N 1 0 294.420 3.840 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CC3)o2)c(Cl)c1 ZINC000036823801 527342217 /nfs/dbraw/zinc/34/22/17/527342217.db2.gz ZKJJVXJMCNFSJP-UHFFFAOYSA-N 1 0 292.722 3.760 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000353589529 528091929 /nfs/dbraw/zinc/09/19/29/528091929.db2.gz QFMDYFNDDLYXNH-GFCCVEGCSA-N 1 0 262.353 3.703 20 5 CHBDRO CCCC[NH+]1CCC(Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000301351482 528462099 /nfs/dbraw/zinc/46/20/99/528462099.db2.gz IZNUZTGREKHGGJ-UHFFFAOYSA-N 1 0 291.395 3.580 20 5 CHBDRO CC1(C)CCC[N@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000353666160 528939521 /nfs/dbraw/zinc/93/95/21/528939521.db2.gz NZPMNSGIJNJKMJ-UHFFFAOYSA-N 1 0 268.382 3.668 20 5 CHBDRO CCS[C@@H]1CCCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000353584113 529206246 /nfs/dbraw/zinc/20/62/46/529206246.db2.gz FACQWLHKDUCVDV-OAHLLOKOSA-N 1 0 294.420 3.702 20 5 CHBDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000042857652 1121318008 /nfs/dbraw/zinc/31/80/08/1121318008.db2.gz JVHYJTFUOJQSRF-OCCSQVGLSA-N 1 0 262.353 3.511 20 5 CHBDRO CC(C)[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000886215060 1125660978 /nfs/dbraw/zinc/66/09/78/1125660978.db2.gz CQWNYGWDGAMZFB-AWEZNQCLSA-N 1 0 299.374 3.961 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[NH2+][C@H]1CCCC12CCCCC2 ZINC000886274566 1125665584 /nfs/dbraw/zinc/66/55/84/1125665584.db2.gz WFWXXXOXAUHAAA-AWEZNQCLSA-N 1 0 289.379 3.582 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000886540828 1125687404 /nfs/dbraw/zinc/68/74/04/1125687404.db2.gz LNABQOLEXMUDMI-BBRMVZONSA-N 1 0 297.358 3.573 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C1(C2CC2)CCC1 ZINC000886825410 1125721399 /nfs/dbraw/zinc/72/13/99/1125721399.db2.gz SGRMRSVEYRWCIW-AWEZNQCLSA-N 1 0 272.348 3.504 20 5 CHBDRO CC(C)C(C)(C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000697945995 1126733182 /nfs/dbraw/zinc/73/31/82/1126733182.db2.gz QUQSQUINIPWYOY-UHFFFAOYSA-N 1 0 270.760 3.772 20 5 CHBDRO O=[N+]([O-])c1ccc(COc2ccc([C@H]3CCC[NH2+]3)cc2)cc1 ZINC000905616087 1126909751 /nfs/dbraw/zinc/90/97/51/1126909751.db2.gz CQIOJEVYXNSTHV-QGZVFWFLSA-N 1 0 298.342 3.598 20 5 CHBDRO COc1cc(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000485733617 1126948303 /nfs/dbraw/zinc/94/83/03/1126948303.db2.gz BMBCJBQFKPEEOI-TZMCWYRMSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCNc2ccccc21 ZINC000192971765 1126965478 /nfs/dbraw/zinc/96/54/78/1126965478.db2.gz JXKWUAUOKIRPTR-INIZCTEOSA-N 1 0 297.358 3.631 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000037260529 1126984225 /nfs/dbraw/zinc/98/42/25/1126984225.db2.gz GARYVBMJXARMEN-RYUDHWBXSA-N 1 0 250.342 3.680 20 5 CHBDRO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000266806013 1126988482 /nfs/dbraw/zinc/98/84/82/1126988482.db2.gz UBRTZMGRMPVCCT-ZDUSSCGKSA-N 1 0 282.343 3.935 20 5 CHBDRO C[N@H+](CCCCC(F)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC000269913404 1127048459 /nfs/dbraw/zinc/04/84/59/1127048459.db2.gz WHIBJDCWXKKGDB-UHFFFAOYSA-N 1 0 290.285 3.759 20 5 CHBDRO Cc1cccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000571297469 1127159128 /nfs/dbraw/zinc/15/91/28/1127159128.db2.gz NDXBCUYJVGNIBI-MRXNPFEDSA-N 1 0 282.343 3.680 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C)CC1 ZINC000349975658 1127170000 /nfs/dbraw/zinc/17/00/00/1127170000.db2.gz OETHAEFBJSJAFY-GFCCVEGCSA-N 1 0 262.353 3.525 20 5 CHBDRO CC[C@@H]1CC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000588230223 1127182165 /nfs/dbraw/zinc/18/21/65/1127182165.db2.gz JFQMPYZVKQLUPR-MFKMUULPSA-N 1 0 282.771 3.569 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2C2CCCC2)cs1 ZINC000055927215 1127183205 /nfs/dbraw/zinc/18/32/05/1127183205.db2.gz LEUSZEUDAUMYJE-ZDUSSCGKSA-N 1 0 280.393 3.811 20 5 CHBDRO CC(C)[N@H+](CC[C@H](C)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000351843772 1127211068 /nfs/dbraw/zinc/21/10/68/1127211068.db2.gz HQFQTUAUNKCUES-LBPRGKRZSA-N 1 0 268.332 3.553 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC2(CCC2)CC1 ZINC000589188236 1127215376 /nfs/dbraw/zinc/21/53/76/1127215376.db2.gz OHWWGGIOVGUYTL-UHFFFAOYSA-N 1 0 274.364 3.669 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000589209375 1127216005 /nfs/dbraw/zinc/21/60/05/1127216005.db2.gz IZSDTPAKBZIXLF-OAHLLOKOSA-N 1 0 274.364 3.525 20 5 CHBDRO Cc1ccc(C[NH+]2CCC(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000590052719 1127246565 /nfs/dbraw/zinc/24/65/65/1127246565.db2.gz HXTMPQFYQPFPDG-UHFFFAOYSA-N 1 0 274.364 3.525 20 5 CHBDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573046309 1127281331 /nfs/dbraw/zinc/28/13/31/1127281331.db2.gz XFKRKANPCKCJCA-OCCSQVGLSA-N 1 0 262.353 3.666 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2c3ccccc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000288574743 1127348244 /nfs/dbraw/zinc/34/82/44/1127348244.db2.gz NIIPCCVUXFFHEH-SJKOYZFVSA-N 1 0 298.342 3.515 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)CC(F)F ZINC000592373100 1127343666 /nfs/dbraw/zinc/34/36/66/1127343666.db2.gz UBWAUBABKISEDW-DSDFTUOUSA-N 1 0 298.333 3.879 20 5 CHBDRO C[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)CC(F)F ZINC000592392224 1127344334 /nfs/dbraw/zinc/34/43/34/1127344334.db2.gz IUNBSYISDLBDAL-QMTHXVAHSA-N 1 0 298.333 3.853 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000226182210 1127380562 /nfs/dbraw/zinc/38/05/62/1127380562.db2.gz YJFOYVKQPGHZIF-UHIISALHSA-N 1 0 280.343 3.648 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761053948 1127413311 /nfs/dbraw/zinc/41/33/11/1127413311.db2.gz IFKIOJYXSLACPQ-GXSJLCMTSA-N 1 0 288.269 3.540 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H]1Cc2ccccc21 ZINC000594493905 1127418485 /nfs/dbraw/zinc/41/84/85/1127418485.db2.gz AMLDXSLTFDKGBA-CXAGYDPISA-N 1 0 294.354 3.512 20 5 CHBDRO COC[C@H](CC(C)(C)C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000594519153 1127421175 /nfs/dbraw/zinc/42/11/75/1127421175.db2.gz DWIONFKWJZWFLM-JSGCOSHPSA-N 1 0 294.395 3.697 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000594516960 1127421203 /nfs/dbraw/zinc/42/12/03/1127421203.db2.gz ZRRMQHANBHGQGQ-DYVFJYSZSA-N 1 0 299.374 3.662 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000138894238 1127429795 /nfs/dbraw/zinc/42/97/95/1127429795.db2.gz IKPKJXOOVXHJJT-KRWDZBQOSA-N 1 0 298.342 3.638 20 5 CHBDRO Cc1cc[nH+]c(NCc2ccc([N+](=O)[O-])cc2)c1C1CC1 ZINC000594744359 1127431471 /nfs/dbraw/zinc/43/14/71/1127431471.db2.gz YUERJHDWFWZLBK-UHFFFAOYSA-N 1 0 283.331 3.788 20 5 CHBDRO CCc1ccc(C)[nH+]c1NCc1csc([N+](=O)[O-])c1 ZINC000594969315 1127437379 /nfs/dbraw/zinc/43/73/79/1127437379.db2.gz PEQPHJPKZZQYBO-UHFFFAOYSA-N 1 0 277.349 3.534 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCc2ccccc21 ZINC000594973134 1127438182 /nfs/dbraw/zinc/43/81/82/1127438182.db2.gz NEVBGPUOQIISQP-QGZVFWFLSA-N 1 0 282.343 3.680 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1=CCCC1 ZINC000594988652 1127444549 /nfs/dbraw/zinc/44/45/49/1127444549.db2.gz AOXGYDOBCLRUCU-UKTHLTGXSA-N 1 0 272.348 3.698 20 5 CHBDRO Cc1cc(C)cc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000595072388 1127448843 /nfs/dbraw/zinc/44/88/43/1127448843.db2.gz FOOSLIBNUCWMLR-KRWDZBQOSA-N 1 0 296.370 3.989 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1(C2CCC2)CC1 ZINC000595045839 1127451339 /nfs/dbraw/zinc/45/13/39/1127451339.db2.gz HWAFWMGYGYTJLB-LLVKDONJSA-N 1 0 290.363 3.587 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])C1CC1 ZINC000595107383 1127452866 /nfs/dbraw/zinc/45/28/66/1127452866.db2.gz XXWCNXNUEMLESL-GDBMZVCRSA-N 1 0 274.364 3.606 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@@]1(C)CC1(F)F ZINC000595081569 1127453734 /nfs/dbraw/zinc/45/37/34/1127453734.db2.gz SDLSIFDAGSEGRF-RISCZKNCSA-N 1 0 298.333 3.989 20 5 CHBDRO CC(C)(F)CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000595087696 1127454361 /nfs/dbraw/zinc/45/43/61/1127454361.db2.gz OFQYBEATKAEYNV-CQSZACIVSA-N 1 0 294.370 3.644 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCc1ccco1 ZINC000595094602 1127455432 /nfs/dbraw/zinc/45/54/32/1127455432.db2.gz ZJEJBWHAIUYTHB-CYBMUJFWSA-N 1 0 288.347 3.780 20 5 CHBDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000359303811 1127457628 /nfs/dbraw/zinc/45/76/28/1127457628.db2.gz PTNWVJMWCGBYRL-SMDDNHRTSA-N 1 0 280.393 3.668 20 5 CHBDRO Cc1noc(C[N@H+]2CCCC[C@@H]2CCC(C)C)c1[N+](=O)[O-] ZINC000595385401 1127461780 /nfs/dbraw/zinc/46/17/80/1127461780.db2.gz VGSDTMUKGGVWGO-CYBMUJFWSA-N 1 0 295.383 3.682 20 5 CHBDRO CC(C)=CCC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000595508589 1127464996 /nfs/dbraw/zinc/46/49/96/1127464996.db2.gz BZDSCHKSLYBLNO-UHFFFAOYSA-N 1 0 262.353 3.776 20 5 CHBDRO Cc1noc(C[N@@H+](C)[C@H]2CCC[C@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595553258 1127466825 /nfs/dbraw/zinc/46/68/25/1127466825.db2.gz WKWBBUIYEFISAH-NEPJUHHUSA-N 1 0 295.383 3.538 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](CCF)C1 ZINC000595754355 1127474827 /nfs/dbraw/zinc/47/48/27/1127474827.db2.gz ACKRLZNFXOEFEI-STQMWFEESA-N 1 0 280.343 3.727 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]4C[C@@H]4C3)o2)cc1 ZINC000597222449 1127536006 /nfs/dbraw/zinc/53/60/06/1127536006.db2.gz CMZYBDVSSKRDQH-ZIAGYGMSSA-N 1 0 298.342 3.697 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2ccccc2O1 ZINC000294987867 1127612404 /nfs/dbraw/zinc/61/24/04/1127612404.db2.gz HGIWSPIOYOAWCI-MLGOLLRUSA-N 1 0 298.342 3.597 20 5 CHBDRO CC(C)(C)C[C@@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000060890060 1127614347 /nfs/dbraw/zinc/61/43/47/1127614347.db2.gz KTFZIIKVUCQOLE-AWEZNQCLSA-N 1 0 276.380 3.995 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CC1(F)F ZINC000598677585 1127631213 /nfs/dbraw/zinc/63/12/13/1127631213.db2.gz PLLBRNXBXSIEBM-YPMHNXCESA-N 1 0 298.333 3.551 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC[C@@H]1CC1(F)F)CCC2 ZINC000598680351 1127632136 /nfs/dbraw/zinc/63/21/36/1127632136.db2.gz XQAGTHYPLMWPCZ-RISCZKNCSA-N 1 0 296.317 3.607 20 5 CHBDRO CC[C@@H](C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000061002385 1127633063 /nfs/dbraw/zinc/63/30/63/1127633063.db2.gz OBIUTZVXTJWJNT-LLVKDONJSA-N 1 0 250.342 3.606 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000598954693 1127647931 /nfs/dbraw/zinc/64/79/31/1127647931.db2.gz FCKFHYGUVLMAAL-GREKMHCPSA-N 1 0 274.364 3.680 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccc(Cl)s2)cc1 ZINC000061114758 1127650589 /nfs/dbraw/zinc/65/05/89/1127650589.db2.gz YPPROBCOHJBUBF-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC2(CCC2)C1 ZINC000593695228 1127661969 /nfs/dbraw/zinc/66/19/69/1127661969.db2.gz YWAOMWMSCOYHIT-ZDUSSCGKSA-N 1 0 288.391 3.838 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000599512461 1127676764 /nfs/dbraw/zinc/67/67/64/1127676764.db2.gz JXJIOGIIIKFJHS-PHIMTYICSA-N 1 0 298.333 3.626 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1cccc(F)c1 ZINC000061780716 1127716752 /nfs/dbraw/zinc/71/67/52/1127716752.db2.gz GGIHEFFQJHUVPN-LBPRGKRZSA-N 1 0 288.322 3.927 20 5 CHBDRO C[C@@H](c1ccccc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000061801545 1127718189 /nfs/dbraw/zinc/71/81/89/1127718189.db2.gz NQAGGXPVHFOEDK-ZDUSSCGKSA-N 1 0 270.332 3.788 20 5 CHBDRO CC[N@H+](Cc1cccc(F)c1)Cc1cccc([N+](=O)[O-])c1 ZINC000061799802 1127718499 /nfs/dbraw/zinc/71/84/99/1127718499.db2.gz DCGPSSBCDJTDIH-UHFFFAOYSA-N 1 0 288.322 3.756 20 5 CHBDRO CSCCCCCC[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000230149124 1127743826 /nfs/dbraw/zinc/74/38/26/1127743826.db2.gz FIBZGALIGRLEHB-UHFFFAOYSA-N 1 0 282.409 3.608 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000251774970 1127901827 /nfs/dbraw/zinc/90/18/27/1127901827.db2.gz FFLGHMGNKWGZIE-IAZYJMLFSA-N 1 0 268.382 3.571 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094773913 1127930612 /nfs/dbraw/zinc/93/06/12/1127930612.db2.gz LGVDYCYCIZTCMH-CQSZACIVSA-N 1 0 280.343 3.792 20 5 CHBDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539827556 1127943970 /nfs/dbraw/zinc/94/39/70/1127943970.db2.gz IKYAZRWARYTEQS-BXUZGUMPSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000539826809 1127944327 /nfs/dbraw/zinc/94/43/27/1127944327.db2.gz ZBVOIPDTGWRQGG-CFNZNRNTSA-N 1 0 274.364 3.728 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c(Cl)c1 ZINC000543859678 1127950359 /nfs/dbraw/zinc/95/03/59/1127950359.db2.gz RTIRHSSILIJWAQ-TXEJJXNPSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000462733806 1127952376 /nfs/dbraw/zinc/95/23/76/1127952376.db2.gz KNHQZUXBHDVKDC-OWCLPIDISA-N 1 0 288.391 3.962 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]12 ZINC000543897984 1127952748 /nfs/dbraw/zinc/95/27/48/1127952748.db2.gz GHBHNVSRHPIAHA-WQVCFCJDSA-N 1 0 274.364 3.605 20 5 CHBDRO Cc1ccc(C[N@H+](C)C[C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000544368199 1127970830 /nfs/dbraw/zinc/97/08/30/1127970830.db2.gz IZOFTHMRDMUWNE-AWEZNQCLSA-N 1 0 274.364 3.691 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000544612165 1127979120 /nfs/dbraw/zinc/97/91/20/1127979120.db2.gz UJBYBLWDYVKOBA-INIZCTEOSA-N 1 0 274.364 3.668 20 5 CHBDRO CC[C@@]1(C)CC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000468136754 1127994725 /nfs/dbraw/zinc/99/47/25/1127994725.db2.gz AMWIOQOJAWDAGU-DOMZBBRYSA-N 1 0 262.353 3.778 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)C ZINC000468630014 1128014219 /nfs/dbraw/zinc/01/42/19/1128014219.db2.gz KJGWWQXFEFZEML-WQLSENKSSA-N 1 0 262.353 3.634 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000545457233 1128016234 /nfs/dbraw/zinc/01/62/34/1128016234.db2.gz ASBWXMJKDXZDBK-ONGXEEELSA-N 1 0 290.285 3.976 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H](C)C(C)C ZINC000470169062 1128063736 /nfs/dbraw/zinc/06/37/36/1128063736.db2.gz BCJHJOKMTWWYTF-XXYUJHKVSA-N 1 0 276.380 3.974 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)CCC1CC1 ZINC000470172510 1128063949 /nfs/dbraw/zinc/06/39/49/1128063949.db2.gz XWDXNXSKROGDGW-RAXLEYEMSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H](C)C1CC1 ZINC000470176945 1128065189 /nfs/dbraw/zinc/06/51/89/1128065189.db2.gz ZFZILGASWFLYQI-CNELAYHGSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1ccc2oc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3)cc2c1 ZINC000152089416 1128096177 /nfs/dbraw/zinc/09/61/77/1128096177.db2.gz FJJLAXGFMJYFMA-UHFFFAOYSA-N 1 0 296.326 3.939 20 5 CHBDRO CCOc1cc(C[N@H+](C)CC2CCCC2)ccc1[N+](=O)[O-] ZINC000492656714 1128107299 /nfs/dbraw/zinc/10/72/99/1128107299.db2.gz RIJVODLBNRCRFR-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO CC1(C)CCC[C@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000492910669 1128116153 /nfs/dbraw/zinc/11/61/53/1128116153.db2.gz GJENYDZSIPWDNS-OAHLLOKOSA-N 1 0 292.379 3.532 20 5 CHBDRO CC1(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCCC1 ZINC000761522357 1128132469 /nfs/dbraw/zinc/13/24/69/1128132469.db2.gz XXKUZNGJQSEWDJ-UHFFFAOYSA-N 1 0 282.771 3.918 20 5 CHBDRO CC(C)[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000324187805 1128136300 /nfs/dbraw/zinc/13/63/00/1128136300.db2.gz YODVRDLPJPRBQR-ABAIWWIYSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(CF)cc1)c1ccccc1[N+](=O)[O-] ZINC000777725077 1128254710 /nfs/dbraw/zinc/25/47/10/1128254710.db2.gz GNGSLWKMZUSSFR-GFCCVEGCSA-N 1 0 288.322 3.915 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000562058752 1128374861 /nfs/dbraw/zinc/37/48/61/1128374861.db2.gz QFFGWLMOZZKLGK-GFCCVEGCSA-N 1 0 280.368 3.614 20 5 CHBDRO CSCC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000932594883 1128417036 /nfs/dbraw/zinc/41/70/36/1128417036.db2.gz JPZGWSGLOOBRIE-GFCCVEGCSA-N 1 0 294.420 3.731 20 5 CHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]C3CCCCC3)c2c1 ZINC000563838428 1128481826 /nfs/dbraw/zinc/48/18/26/1128481826.db2.gz ZFPJXAFAVVRCOO-UHFFFAOYSA-N 1 0 287.363 3.541 20 5 CHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C/C=C/Cl)C2)cc1 ZINC000831534527 1128517074 /nfs/dbraw/zinc/51/70/74/1128517074.db2.gz PCRWKCZFSMNRGS-DRQXCOHGSA-N 1 0 280.755 3.527 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000556959517 1128652713 /nfs/dbraw/zinc/65/27/13/1128652713.db2.gz XDECYZPDIWANFE-CQSZACIVSA-N 1 0 274.364 3.525 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000046088100 1128658496 /nfs/dbraw/zinc/65/84/96/1128658496.db2.gz ZFIHAVUDJMZDDQ-CQSZACIVSA-N 1 0 288.372 3.993 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000575010875 1128665932 /nfs/dbraw/zinc/66/59/32/1128665932.db2.gz DXGKCDLXVHPPNF-YPMHNXCESA-N 1 0 292.379 3.690 20 5 CHBDRO C[N@H+](CCCc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000046599286 1128663633 /nfs/dbraw/zinc/66/36/33/1128663633.db2.gz ODBHVYHEJJBBLX-UHFFFAOYSA-N 1 0 284.359 3.659 20 5 CHBDRO CCC(CC)[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CC1 ZINC000920409842 1128680516 /nfs/dbraw/zinc/68/05/16/1128680516.db2.gz OJADDAUVBIZYMJ-UHFFFAOYSA-N 1 0 280.343 3.887 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(C)ccn1 ZINC000601268437 1128707078 /nfs/dbraw/zinc/70/70/78/1128707078.db2.gz QESZBUCMKGWZQJ-INIZCTEOSA-N 1 0 299.374 3.929 20 5 CHBDRO CC(C)(C)C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000578548600 1128721230 /nfs/dbraw/zinc/72/12/30/1128721230.db2.gz FDDGACIVZKGYMI-UHFFFAOYSA-N 1 0 276.380 3.853 20 5 CHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609767166 1128724701 /nfs/dbraw/zinc/72/47/01/1128724701.db2.gz SXTJCVKAIXWRDA-CQSZACIVSA-N 1 0 280.343 3.744 20 5 CHBDRO CC[C@@H](C[NH+]1CCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000609839852 1128729399 /nfs/dbraw/zinc/72/93/99/1128729399.db2.gz CEONDAUPZZLNOL-NSHDSACASA-N 1 0 297.786 3.535 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000035047659 1117766046 /nfs/dbraw/zinc/76/60/46/1117766046.db2.gz KWQCCLSIYRHAAD-INIZCTEOSA-N 1 0 282.343 3.680 20 5 CHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000610215364 1117882121 /nfs/dbraw/zinc/88/21/21/1117882121.db2.gz HJLWBGMZXAOIMM-UONOGXRCSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C(C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000157545496 1117890247 /nfs/dbraw/zinc/89/02/47/1117890247.db2.gz SMJWQOVPYSOAJT-NSHDSACASA-N 1 0 274.364 3.742 20 5 CHBDRO CCCC[C@H](C)[N@H+](CCCC)Cc1c([N+](=O)[O-])ncn1C ZINC000339649858 1117946509 /nfs/dbraw/zinc/94/65/09/1117946509.db2.gz HEXYUPPXGWTEER-ZDUSSCGKSA-N 1 0 296.415 3.509 20 5 CHBDRO CC[N@H+](CCc1ccccn1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000764313242 1118082816 /nfs/dbraw/zinc/08/28/16/1118082816.db2.gz FKDAWPGONQTTPG-AWEZNQCLSA-N 1 0 299.374 3.615 20 5 CHBDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000112675825 1118084636 /nfs/dbraw/zinc/08/46/36/1118084636.db2.gz VCPGGAXAKODDNL-QWHCGFSZSA-N 1 0 282.409 3.961 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1coc2ccccc12 ZINC000083601934 1118456042 /nfs/dbraw/zinc/45/60/42/1118456042.db2.gz PDNHCLFSBMBBOP-UHFFFAOYSA-N 1 0 282.299 3.631 20 5 CHBDRO CC[C@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000083640389 1118462435 /nfs/dbraw/zinc/46/24/35/1118462435.db2.gz PZLYJUXHSNOMTN-JSGCOSHPSA-N 1 0 262.353 3.653 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000579749220 1118484979 /nfs/dbraw/zinc/48/49/79/1118484979.db2.gz MCRBMKIBUBVCOA-HUUCEWRRSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000253071543 1118499792 /nfs/dbraw/zinc/49/97/92/1118499792.db2.gz NHHIOFMDTWPWQK-GHMZBOCLSA-N 1 0 282.771 3.726 20 5 CHBDRO CC(C)[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)CC1CCC1 ZINC000510765662 1118810881 /nfs/dbraw/zinc/81/08/81/1118810881.db2.gz ODVFUVUGZZXRTL-UHFFFAOYSA-N 1 0 298.333 3.884 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H](OC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000361815864 1118816142 /nfs/dbraw/zinc/81/61/42/1118816142.db2.gz VSDOHWHDAFEPEE-JKSUJKDBSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1occc1C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000610805289 1118893690 /nfs/dbraw/zinc/89/36/90/1118893690.db2.gz SSBLZGDDSHIXFB-LBPRGKRZSA-N 1 0 288.347 3.607 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)C1CC1 ZINC000610805131 1118894003 /nfs/dbraw/zinc/89/40/03/1118894003.db2.gz AORNDYQWXYASFV-VXGBXAGGSA-N 1 0 262.353 3.600 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)C1CC1 ZINC000610805129 1118894129 /nfs/dbraw/zinc/89/41/29/1118894129.db2.gz AORNDYQWXYASFV-NWDGAFQWSA-N 1 0 262.353 3.600 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000135462659 1118929688 /nfs/dbraw/zinc/92/96/88/1118929688.db2.gz JDGNWUKNDNPNIG-WDEREUQCSA-N 1 0 250.342 3.680 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000033394617 1118965063 /nfs/dbraw/zinc/96/50/63/1118965063.db2.gz POPOFVNWGIWNGF-VIHMKRCTSA-N 1 0 274.364 3.873 20 5 CHBDRO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000539214285 1118983848 /nfs/dbraw/zinc/98/38/48/1118983848.db2.gz GVETVSRWTAAWNS-CHWSQXEVSA-N 1 0 299.374 3.964 20 5 CHBDRO Cc1ccccc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511128045 1119084357 /nfs/dbraw/zinc/08/43/57/1119084357.db2.gz WHOQIOQKLPPNJQ-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000479565361 1119124605 /nfs/dbraw/zinc/12/46/05/1119124605.db2.gz IMWFCADLAXTKBE-INIZCTEOSA-N 1 0 282.343 3.584 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CC[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000583254487 1119327672 /nfs/dbraw/zinc/32/76/72/1119327672.db2.gz NJUYSIFMHDRJLT-OLZOCXBDSA-N 1 0 292.379 3.518 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCCC1(F)F ZINC000583510699 1119370751 /nfs/dbraw/zinc/37/07/51/1119370751.db2.gz ZXNYAOHOTNTMRT-GXFFZTMASA-N 1 0 296.317 3.607 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@H]1C ZINC000414150600 1119918896 /nfs/dbraw/zinc/91/88/96/1119918896.db2.gz VTHRRZFPZWPYIX-GVARAGBVSA-N 1 0 262.353 3.680 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC000414208945 1119939638 /nfs/dbraw/zinc/93/96/38/1119939638.db2.gz MANZMERTQLFBRT-MEYUZBJRSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@H](C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000472587312 1119986730 /nfs/dbraw/zinc/98/67/30/1119986730.db2.gz WUCGXPWFSYREAT-CQSZACIVSA-N 1 0 296.370 3.757 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccoc2)cc1[N+](=O)[O-] ZINC000181235585 1120031985 /nfs/dbraw/zinc/03/19/85/1120031985.db2.gz QVGHISXTZAMGAX-NWDGAFQWSA-N 1 0 274.320 3.908 20 5 CHBDRO C[C@H](c1ccccc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000066696204 1120047705 /nfs/dbraw/zinc/04/77/05/1120047705.db2.gz DTGIMHMPQKWEKB-CYBMUJFWSA-N 1 0 270.332 3.788 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCCC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000695068406 1120100696 /nfs/dbraw/zinc/10/06/96/1120100696.db2.gz YWCKTILDHHWMEN-LBPRGKRZSA-N 1 0 284.306 3.571 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CS[C@H](C)C2)cc1[N+](=O)[O-] ZINC000414508017 1120105745 /nfs/dbraw/zinc/10/57/45/1120105745.db2.gz ZTUGVZJNJFQZAE-YPMHNXCESA-N 1 0 294.420 3.702 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000062726570 1120205470 /nfs/dbraw/zinc/20/54/70/1120205470.db2.gz CJWIHUPINXUILK-INIZCTEOSA-N 1 0 284.359 3.878 20 5 CHBDRO CC(C)C(C[NH2+]CCc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000229549566 1120262169 /nfs/dbraw/zinc/26/21/69/1120262169.db2.gz ZZDRIPOKLSQXLO-UHFFFAOYSA-N 1 0 278.396 3.655 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC000113310578 1120318277 /nfs/dbraw/zinc/31/82/77/1120318277.db2.gz VSOYMHVBYDUSOP-KRWDZBQOSA-N 1 0 282.343 3.680 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@@H]1C(F)F)CCCC2 ZINC000417324666 1120428046 /nfs/dbraw/zinc/42/80/46/1120428046.db2.gz CWMCKZXMGNYAAV-IHRRRGAJSA-N 1 0 296.317 3.606 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccoc1)CCCC2 ZINC000417336800 1120430023 /nfs/dbraw/zinc/43/00/23/1120430023.db2.gz IGUBZXDRVAUQDP-MRXNPFEDSA-N 1 0 286.331 3.745 20 5 CHBDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC(C)C ZINC000417358502 1120435682 /nfs/dbraw/zinc/43/56/82/1120435682.db2.gz HZHZXVWWNNAWOE-DZGCQCFKSA-N 1 0 294.395 3.615 20 5 CHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CC=CCC1 ZINC000543179074 1120452495 /nfs/dbraw/zinc/45/24/95/1120452495.db2.gz WICLCHQMHWGXCR-LBPRGKRZSA-N 1 0 278.327 3.522 20 5 CHBDRO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000053422731 1120494871 /nfs/dbraw/zinc/49/48/71/1120494871.db2.gz MRLRDXSVHVYIKY-GFCCVEGCSA-N 1 0 288.322 3.927 20 5 CHBDRO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000053422364 1120495131 /nfs/dbraw/zinc/49/51/31/1120495131.db2.gz PFFMAAJDSWBYGE-GFCCVEGCSA-N 1 0 288.322 3.927 20 5 CHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000543448306 1120525237 /nfs/dbraw/zinc/52/52/37/1120525237.db2.gz KJYQSYJTGWFKMH-CQSZACIVSA-N 1 0 284.359 3.563 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(Cl)cs1 ZINC000093094968 1120553261 /nfs/dbraw/zinc/55/32/61/1120553261.db2.gz UJGPXZUHCKMGPF-UHFFFAOYSA-N 1 0 282.752 3.600 20 5 CHBDRO C/C(=C/c1ccccc1)C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000236699560 1120578018 /nfs/dbraw/zinc/57/80/18/1120578018.db2.gz GTKIEAKGKNWOMG-SQFISAMPSA-N 1 0 296.370 3.830 20 5 CHBDRO CC[C@@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555417159 1120596224 /nfs/dbraw/zinc/59/62/24/1120596224.db2.gz YKAHFQGFPUQCKR-SECBINFHSA-N 1 0 290.285 3.844 20 5 CHBDRO C[C@@H](C[N@H+](C)Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000066853533 1120596292 /nfs/dbraw/zinc/59/62/92/1120596292.db2.gz HSAQBXUTDARBIR-LBPRGKRZSA-N 1 0 290.388 3.892 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000500380293 1120600440 /nfs/dbraw/zinc/60/04/40/1120600440.db2.gz XLEKNMWFILMLEL-GFCCVEGCSA-N 1 0 298.333 3.818 20 5 CHBDRO C[NH+](C)CCc1ccc(Nc2sccc2[N+](=O)[O-])cc1 ZINC000302004231 1120646165 /nfs/dbraw/zinc/64/61/65/1120646165.db2.gz KCSAEPKFYIWYRJ-UHFFFAOYSA-N 1 0 291.376 3.504 20 5 CHBDRO C[C@@H](C[NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000131242253 1120652758 /nfs/dbraw/zinc/65/27/58/1120652758.db2.gz HYWGTKZRPGFLBE-AWEZNQCLSA-N 1 0 284.359 3.531 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(F)c1 ZINC000124308606 1120657468 /nfs/dbraw/zinc/65/74/68/1120657468.db2.gz CWOGDRXFGISZKS-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCC(C)C ZINC000303174269 1120666405 /nfs/dbraw/zinc/66/64/05/1120666405.db2.gz WFEKBKRICCWHBD-UHFFFAOYSA-N 1 0 280.368 3.519 20 5 CHBDRO CC1(C)CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000162720742 1120691539 /nfs/dbraw/zinc/69/15/39/1120691539.db2.gz SULDFVSYKZWMSN-NSHDSACASA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)C2CCC2)cccc1[N+](=O)[O-] ZINC000090856200 1128934761 /nfs/dbraw/zinc/93/47/61/1128934761.db2.gz SZRWMHFOBWTOAN-NWDGAFQWSA-N 1 0 262.353 3.742 20 5 CHBDRO CS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000300409488 1120936965 /nfs/dbraw/zinc/93/69/65/1120936965.db2.gz APPGJCCYEMTLIO-KCPJHIHWSA-N 1 0 294.420 3.920 20 5 CHBDRO CCSCC[C@@H](C)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000072900555 1120950226 /nfs/dbraw/zinc/95/02/26/1120950226.db2.gz GFTBKYSVRLRXCX-GFCCVEGCSA-N 1 0 282.409 3.558 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)c1 ZINC000133828645 1121044211 /nfs/dbraw/zinc/04/42/11/1121044211.db2.gz JDDSQEKLVTURJI-MRXNPFEDSA-N 1 0 286.306 3.511 20 5 CHBDRO CC(C)(C)CC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429227124 1121125943 /nfs/dbraw/zinc/12/59/43/1121125943.db2.gz NABHPIVILNJLMI-UHFFFAOYSA-N 1 0 264.369 3.856 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CCSC2)cc1[N+](=O)[O-] ZINC000704771536 1121368533 /nfs/dbraw/zinc/36/85/33/1121368533.db2.gz MTIVPAPWYGPPKW-OLZOCXBDSA-N 1 0 294.420 3.697 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000512653361 1121510271 /nfs/dbraw/zinc/51/02/71/1121510271.db2.gz WNNFKPHLMQHFSS-SGNXQUTQSA-N 1 0 286.375 3.873 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000433145183 1121595207 /nfs/dbraw/zinc/59/52/07/1121595207.db2.gz FVJWLCMYYWPASW-BMIGLBTASA-N 1 0 274.364 3.705 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CSC[C@H]2C)cc1[N+](=O)[O-] ZINC000512863085 1121624058 /nfs/dbraw/zinc/62/40/58/1121624058.db2.gz ZIYVCGBLVMDEBI-RISCZKNCSA-N 1 0 294.420 3.559 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC=CC1 ZINC000611248537 1121632491 /nfs/dbraw/zinc/63/24/91/1121632491.db2.gz JCDBYOJWOSHKTC-LBPRGKRZSA-N 1 0 292.404 3.774 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000611248256 1121632762 /nfs/dbraw/zinc/63/27/62/1121632762.db2.gz ZTORTDQRXXYLCP-NWDGAFQWSA-N 1 0 292.379 3.690 20 5 CHBDRO CC1(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433290279 1121639546 /nfs/dbraw/zinc/63/95/46/1121639546.db2.gz RDERVTOILHIWPY-AWEZNQCLSA-N 1 0 274.364 3.707 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CCOC(C)(C)C ZINC000611516523 1121654105 /nfs/dbraw/zinc/65/41/05/1121654105.db2.gz OPJNZHWQIOILQP-ZDUSSCGKSA-N 1 0 294.395 3.711 20 5 CHBDRO CC1(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3Cl)CC2)CC1 ZINC000398205225 1121713025 /nfs/dbraw/zinc/71/30/25/1121713025.db2.gz CEGDTWRQXFMMSX-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO Cc1cc(C)c(C[NH2+]CCc2ccccc2[N+](=O)[O-])cc1C ZINC001178608968 1121800059 /nfs/dbraw/zinc/80/00/59/1121800059.db2.gz CJJFUXFYAHJRIL-UHFFFAOYSA-N 1 0 298.386 3.852 20 5 CHBDRO Cc1cc(C(C)C)ccc1O[C@@H](C)C[N+](C)(C)C ZINC001230211618 1121846138 /nfs/dbraw/zinc/84/61/38/1121846138.db2.gz OFWLOCBHCFFSTC-AWEZNQCLSA-N 1 0 250.406 3.592 20 5 CHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[Si](C)(C)C ZINC000731211899 1121853994 /nfs/dbraw/zinc/85/39/94/1121853994.db2.gz HLAZWUDANWKAAK-UHFFFAOYSA-N 1 0 280.444 3.683 20 5 CHBDRO Cc1ccccc1C[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037777188 1129014300 /nfs/dbraw/zinc/01/43/00/1129014300.db2.gz HZXIURACCIROBD-LBPRGKRZSA-N 1 0 290.388 3.686 20 5 CHBDRO C[N@H+](CCCCNc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000413346160 1122013456 /nfs/dbraw/zinc/01/34/56/1122013456.db2.gz HOSLQPVLPMFSRF-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)c1 ZINC000501871519 1122019251 /nfs/dbraw/zinc/01/92/51/1122019251.db2.gz PKBRQVOIVRKTHQ-QGZVFWFLSA-N 1 0 296.370 3.802 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccs2)cc1[N+](=O)[O-] ZINC000034996389 1122136838 /nfs/dbraw/zinc/13/68/38/1122136838.db2.gz OIYRABXTESNNLE-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CC[C@H](C)C1 ZINC000429591127 1122142880 /nfs/dbraw/zinc/14/28/80/1122142880.db2.gz QQQSEONJPUQIDO-GXTWGEPZSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001182396495 1122151465 /nfs/dbraw/zinc/15/14/65/1122151465.db2.gz IDACLUPCMJUWPA-SNVBAGLBSA-N 1 0 282.771 3.869 20 5 CHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC001184034990 1122253018 /nfs/dbraw/zinc/25/30/18/1122253018.db2.gz LHIWVYKNVJBSKO-UHFFFAOYSA-N 1 0 282.771 3.774 20 5 CHBDRO Cc1ccc(C[N@@H+]([C@@H](C)C(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000505256304 1122352178 /nfs/dbraw/zinc/35/21/78/1122352178.db2.gz ZHURRNIXHTUBAI-ZDUSSCGKSA-N 1 0 276.380 3.912 20 5 CHBDRO C[C@H]([NH2+]C1CCC2(CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000434633599 1122385739 /nfs/dbraw/zinc/38/57/39/1122385739.db2.gz JOHUSDQFBIWJNT-LBPRGKRZSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCSC(C)(C)CC1 ZINC000434683732 1122396174 /nfs/dbraw/zinc/39/61/74/1122396174.db2.gz FOJRIOSABQBCEF-GFCCVEGCSA-N 1 0 294.420 3.873 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@H](F)C1 ZINC000515059399 1122473308 /nfs/dbraw/zinc/47/33/08/1122473308.db2.gz NLKFMKROESKHEV-RWMBFGLXSA-N 1 0 280.343 3.835 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000515433678 1122499430 /nfs/dbraw/zinc/49/94/30/1122499430.db2.gz XLCAUIHHHJTAOA-WDMOLILDSA-N 1 0 262.353 3.606 20 5 CHBDRO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000516301047 1122585555 /nfs/dbraw/zinc/58/55/55/1122585555.db2.gz ICQPNXHDHZZPOT-VIIAAUOXSA-N 1 0 282.343 3.959 20 5 CHBDRO CC(C)[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000775450713 1122591876 /nfs/dbraw/zinc/59/18/76/1122591876.db2.gz VNAKDONIPSULPL-KRWDZBQOSA-N 1 0 299.374 3.519 20 5 CHBDRO CC[C@H](C)C[N@H+](CC)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001191374866 1122598010 /nfs/dbraw/zinc/59/80/10/1122598010.db2.gz KJNLVGKPXUDXFP-AWEZNQCLSA-N 1 0 294.395 3.732 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001191986091 1122623165 /nfs/dbraw/zinc/62/31/65/1122623165.db2.gz IWDNXXQUHHNSJR-OAHLLOKOSA-N 1 0 276.380 3.649 20 5 CHBDRO CCCCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194466964 1122776449 /nfs/dbraw/zinc/77/64/49/1122776449.db2.gz MIFZRDSAPFCRGM-HNNXBMFYSA-N 1 0 276.380 3.964 20 5 CHBDRO C[C@H](c1cccs1)N(C)Cc1csc([N+](=O)[O-])c1 ZINC000054173022 1122801768 /nfs/dbraw/zinc/80/17/68/1122801768.db2.gz JSADUCVIHREJER-SECBINFHSA-N 1 0 282.390 3.911 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@H]2CCC[C@H]21 ZINC000426488826 1122804312 /nfs/dbraw/zinc/80/43/12/1122804312.db2.gz XYWRPEXWKYCUAJ-ZWNOBZJWSA-N 1 0 280.755 3.623 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1(C)CCCC1 ZINC000426513380 1122811543 /nfs/dbraw/zinc/81/15/43/1122811543.db2.gz IIJWHJZXVGDJLQ-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H]1CC1(C)C ZINC000426569506 1122823205 /nfs/dbraw/zinc/82/32/05/1122823205.db2.gz AVTREXFKFFIJSA-JQVXPOPVSA-N 1 0 274.364 3.728 20 5 CHBDRO CC(C)[C@@H]1CCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507187521 1122845252 /nfs/dbraw/zinc/84/52/52/1122845252.db2.gz KUCUGMFMZULRPZ-PXTSUWAFSA-N 1 0 274.364 3.728 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001195269471 1122858691 /nfs/dbraw/zinc/85/86/91/1122858691.db2.gz MGCUIUSSHILYCZ-CHWSQXEVSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000426822129 1122918491 /nfs/dbraw/zinc/91/84/91/1122918491.db2.gz ZZFLYCVNWQJXRZ-VXGBXAGGSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1ccc(C)c(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000507166953 1122932158 /nfs/dbraw/zinc/93/21/58/1122932158.db2.gz GKFQQAULIOWZIB-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](C[C@H]1CC=CCC1)C1CC1 ZINC000507168992 1122935251 /nfs/dbraw/zinc/93/52/51/1122935251.db2.gz GQVZZYLZHZYZKK-AWEZNQCLSA-N 1 0 286.375 3.916 20 5 CHBDRO CCC1(C)CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000507206260 1122937651 /nfs/dbraw/zinc/93/76/51/1122937651.db2.gz NHSZCVVAXORODO-UHFFFAOYSA-N 1 0 276.380 3.915 20 5 CHBDRO CCc1cccnc1[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000507462270 1122956451 /nfs/dbraw/zinc/95/64/51/1122956451.db2.gz OOTVSPFBEFMCQT-CHWSQXEVSA-N 1 0 299.374 3.964 20 5 CHBDRO O=[N+]([O-])c1cccc(CNc2cc[nH+]c3ccccc23)c1 ZINC000052942801 1123074263 /nfs/dbraw/zinc/07/42/63/1123074263.db2.gz RMTIMDGXBVDELE-UHFFFAOYSA-N 1 0 279.299 3.755 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]21 ZINC000543897981 1123108725 /nfs/dbraw/zinc/10/87/25/1123108725.db2.gz GHBHNVSRHPIAHA-DAXOMENPSA-N 1 0 274.364 3.605 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@H]3CCC[C@H]32)cccc1[N+](=O)[O-] ZINC000441432671 1123116559 /nfs/dbraw/zinc/11/65/59/1123116559.db2.gz FBGVBRHDFBIHML-CZUORRHYSA-N 1 0 274.364 3.668 20 5 CHBDRO CC[C@@H](C[NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC001201822959 1123153239 /nfs/dbraw/zinc/15/32/39/1123153239.db2.gz SRVZMESBDLPSLH-INIZCTEOSA-N 1 0 298.386 3.921 20 5 CHBDRO Cc1scc(C[NH2+]CCc2cccc([N+](=O)[O-])c2)c1C ZINC001201821914 1123153345 /nfs/dbraw/zinc/15/33/45/1123153345.db2.gz CHVVRRSYVIBDBT-UHFFFAOYSA-N 1 0 290.388 3.605 20 5 CHBDRO COC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000184673632 1123159436 /nfs/dbraw/zinc/15/94/36/1123159436.db2.gz UMADIHZCGDWCKL-CYBMUJFWSA-N 1 0 292.379 3.595 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CCC2(C)CC2)cc1[N+](=O)[O-] ZINC001202271210 1123190999 /nfs/dbraw/zinc/19/09/99/1123190999.db2.gz UENWKMBNWAZTFK-UHFFFAOYSA-N 1 0 276.380 3.998 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1C=CCC1 ZINC000850509693 1123277913 /nfs/dbraw/zinc/27/79/13/1123277913.db2.gz PYVFRBBUMNXBOR-BPUTZDHNSA-N 1 0 286.375 3.614 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)c2ccns2)cccc1[N+](=O)[O-] ZINC000858577111 1123665037 /nfs/dbraw/zinc/66/50/37/1123665037.db2.gz PCNFXMZOTXPZFV-QWRGUYRKSA-N 1 0 291.376 3.772 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccncc1 ZINC000173441053 1123786899 /nfs/dbraw/zinc/78/68/99/1123786899.db2.gz HCTCFVKZDHBPDJ-WBMJQRKESA-N 1 0 285.347 3.792 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(C2CC2)CC1 ZINC000794894537 1124032497 /nfs/dbraw/zinc/03/24/97/1124032497.db2.gz YVLSQUYBLCWFOS-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO C[C@@H](CCc1cccnc1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000866243519 1124040248 /nfs/dbraw/zinc/04/02/48/1124040248.db2.gz RSTPATGNTQODLG-KBPBESRZSA-N 1 0 299.374 3.662 20 5 CHBDRO CC(C)[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000866312586 1124051289 /nfs/dbraw/zinc/05/12/89/1124051289.db2.gz OMOMKJBCHMTUIG-QGZVFWFLSA-N 1 0 299.374 3.519 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2ncccc21)c1ccc([N+](=O)[O-])cc1 ZINC000866363140 1124057363 /nfs/dbraw/zinc/05/73/63/1124057363.db2.gz JQNYPPLNLDOWKN-YVEFUNNKSA-N 1 0 297.358 3.718 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1cccnc1 ZINC000866539988 1124080185 /nfs/dbraw/zinc/08/01/85/1124080185.db2.gz IVSKYBJMAGVLCF-INIZCTEOSA-N 1 0 299.374 3.929 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2ccccc2C1 ZINC000144085559 1124095443 /nfs/dbraw/zinc/09/54/43/1124095443.db2.gz YXZHQEQJPNYHOV-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000088747819 1124097161 /nfs/dbraw/zinc/09/71/61/1124097161.db2.gz BMRXYPVWDAORTB-GXTWGEPZSA-N 1 0 260.337 3.663 20 5 CHBDRO C[C@H]1Cc2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000525637702 1124451559 /nfs/dbraw/zinc/45/15/59/1124451559.db2.gz ZEELYSGWZMDDDP-AWEZNQCLSA-N 1 0 296.370 3.584 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CCCCC1)CCC2 ZINC000447518478 1124480020 /nfs/dbraw/zinc/48/00/20/1124480020.db2.gz WHLUWYYWYKAXPK-MRXNPFEDSA-N 1 0 274.364 3.895 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC3(CCC3)C2)c1 ZINC000123301964 1124583740 /nfs/dbraw/zinc/58/37/40/1124583740.db2.gz VWHUPGLXVVNHRK-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000053422728 1124609737 /nfs/dbraw/zinc/60/97/37/1124609737.db2.gz MRLRDXSVHVYIKY-LBPRGKRZSA-N 1 0 288.322 3.927 20 5 CHBDRO C[C@@H](C[NH2+]Cc1cccn1C1CC1)c1ccccc1[N+](=O)[O-] ZINC001120248994 1131272527 /nfs/dbraw/zinc/27/25/27/1131272527.db2.gz DHUWWDKXSYBCOK-ZDUSSCGKSA-N 1 0 299.374 3.625 20 5 CHBDRO CCSCC[C@@H](C)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449170152 1124659039 /nfs/dbraw/zinc/65/90/39/1124659039.db2.gz QHSAFPZLWSVBOY-CHWSQXEVSA-N 1 0 296.436 3.647 20 5 CHBDRO CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCO1 ZINC000449169741 1124659609 /nfs/dbraw/zinc/65/96/09/1124659609.db2.gz HLSMAMHTLUSYMX-NWANDNLSSA-N 1 0 292.379 3.511 20 5 CHBDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872038074 1124662393 /nfs/dbraw/zinc/66/23/93/1124662393.db2.gz HRWJKGBFZMNZFS-MNOVXSKESA-N 1 0 298.358 3.588 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872051801 1124666799 /nfs/dbraw/zinc/66/67/99/1124666799.db2.gz NKOMDNBLZNYDSN-VHSXEESVSA-N 1 0 266.316 3.573 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC(F)(F)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872057984 1124669298 /nfs/dbraw/zinc/66/92/98/1124669298.db2.gz LTBROGDPBZFILL-DTWKUNHWSA-N 1 0 288.269 3.572 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCCCS1)c1c(F)cccc1[N+](=O)[O-] ZINC000872060269 1124670241 /nfs/dbraw/zinc/67/02/41/1124670241.db2.gz OLJZAYBIJBKOHI-WDEREUQCSA-N 1 0 298.383 3.670 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCCF ZINC000872072088 1124674134 /nfs/dbraw/zinc/67/41/34/1124674134.db2.gz DPEUQHXKIGTXKR-SNVBAGLBSA-N 1 0 286.372 3.717 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])C1CC1 ZINC000872084058 1124678248 /nfs/dbraw/zinc/67/82/48/1124678248.db2.gz DJQZGFYNQVBNLU-CABZTGNLSA-N 1 0 266.316 3.573 20 5 CHBDRO CC[C@@H]([NH2+]CCC(C)(C)COC)c1cccc([N+](=O)[O-])c1 ZINC000872105164 1124684078 /nfs/dbraw/zinc/68/40/78/1124684078.db2.gz BNMZUQALTNNVFC-OAHLLOKOSA-N 1 0 294.395 3.698 20 5 CHBDRO C[C@H](CCC(F)(F)F)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872128253 1124690672 /nfs/dbraw/zinc/69/06/72/1124690672.db2.gz GSUZQAHKFKCUCU-ZJUUUORDSA-N 1 0 290.285 3.976 20 5 CHBDRO O=[N+]([O-])c1ccccc1CN1CC2(CCC2)[C@H]1c1ccco1 ZINC000449633771 1124832073 /nfs/dbraw/zinc/83/20/73/1124832073.db2.gz QDPDCXMUGDQNMK-MRXNPFEDSA-N 1 0 298.342 3.915 20 5 CHBDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678032 1125181528 /nfs/dbraw/zinc/18/15/28/1125181528.db2.gz BCZSWMOMLCIVPU-ZWNOBZJWSA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000531441468 1125218938 /nfs/dbraw/zinc/21/89/38/1125218938.db2.gz NOXYHJJFFXODIL-KDOFPFPSSA-N 1 0 296.370 3.973 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NC1(c2ccccn2)CC1 ZINC001168151255 1125269272 /nfs/dbraw/zinc/26/92/72/1125269272.db2.gz OLGPXONWBWLLPU-UHFFFAOYSA-N 1 0 296.438 3.779 20 5 CHBDRO CC[C@H]([NH2+]CC(C)(C)SC)c1cccc([N+](=O)[O-])c1 ZINC000132414421 1125417839 /nfs/dbraw/zinc/41/78/39/1125417839.db2.gz MLBZARSCOGVONL-ZDUSSCGKSA-N 1 0 282.409 3.777 20 5 CHBDRO C[C@@H](C[NH2+][C@@H]1CCCSCC1)c1ccccc1[N+](=O)[O-] ZINC000897461446 1125423987 /nfs/dbraw/zinc/42/39/87/1125423987.db2.gz PCIKGUMDMGEHAE-QWHCGFSZSA-N 1 0 294.420 3.574 20 5 CHBDRO C[C@H](CSC(C)(C)C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089511902 1129238411 /nfs/dbraw/zinc/23/84/11/1129238411.db2.gz CMBIXBWWMZXMIA-LLVKDONJSA-N 1 0 282.409 3.605 20 5 CHBDRO Cc1c(C[NH2+]CCC2CCCCC2)cccc1[N+](=O)[O-] ZINC000037741821 1129258489 /nfs/dbraw/zinc/25/84/89/1129258489.db2.gz VSQLTLOCUDFHDU-UHFFFAOYSA-N 1 0 276.380 3.963 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCC[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000742377582 1129475923 /nfs/dbraw/zinc/47/59/23/1129475923.db2.gz WBZYHIOVONKDBO-HOTGVXAUSA-N 1 0 288.391 3.962 20 5 CHBDRO CC(C)=CCC/C(C)=C/C[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168979520 1129687231 /nfs/dbraw/zinc/68/72/31/1129687231.db2.gz YXWKEQNLMYOYAM-MMJTVPDGSA-N 1 0 280.412 3.714 20 5 CHBDRO CC(C)(C)c1ccc(C[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001168966498 1129687626 /nfs/dbraw/zinc/68/76/26/1129687626.db2.gz IQSOYAMVCPYXCS-HOCLYGCPSA-N 1 0 290.407 3.519 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(Cl)c1 ZINC001168986103 1129687774 /nfs/dbraw/zinc/68/77/74/1129687774.db2.gz VWHAZHXHGDTPCC-KCPJHIHWSA-N 1 0 296.798 3.826 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cc(C)ccc1C ZINC001169000750 1129688499 /nfs/dbraw/zinc/68/84/99/1129688499.db2.gz BGDHJDOYLPXANI-YQQAZPJKSA-N 1 0 290.407 3.790 20 5 CHBDRO CSc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169004502 1129689212 /nfs/dbraw/zinc/68/92/12/1129689212.db2.gz RCLZMMVXBUPWOT-OUCADQQQSA-N 1 0 294.420 3.505 20 5 CHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]CCCCC2CCCCC2)C1 ZINC001169004576 1129689215 /nfs/dbraw/zinc/68/92/15/1129689215.db2.gz RFPKPABPXIAIFQ-HOTGVXAUSA-N 1 0 282.428 3.772 20 5 CHBDRO CC(C)(C)[N@H+](Cc1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169005755 1129689356 /nfs/dbraw/zinc/68/93/56/1129689356.db2.gz CSMCRMXTEJMECB-JKSUJKDBSA-N 1 0 290.407 3.733 20 5 CHBDRO C[C@H](c1ccccc1Cl)[N@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169049592 1129691878 /nfs/dbraw/zinc/69/18/78/1129691878.db2.gz WQKLLLDQLUOGOR-JHJVBQTASA-N 1 0 296.798 3.778 20 5 CHBDRO CC1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC(F)(F)C1 ZINC000720902190 1129718918 /nfs/dbraw/zinc/71/89/18/1129718918.db2.gz DUXPVSWXGFAGQO-UHFFFAOYSA-N 1 0 290.697 3.526 20 5 CHBDRO C[C@@H]([NH2+]CC1(C)CC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000720911136 1129721047 /nfs/dbraw/zinc/72/10/47/1129721047.db2.gz GAWIBIHPJPBCTM-SNVBAGLBSA-N 1 0 284.306 3.681 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC2(CCCC2)C1 ZINC000769395143 1129909755 /nfs/dbraw/zinc/90/97/55/1129909755.db2.gz NDVCJDBGXSGDJL-FNORWQNLSA-N 1 0 286.375 3.874 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801518480 1129923731 /nfs/dbraw/zinc/92/37/31/1129923731.db2.gz JLATUTWSMUQJOQ-OAHLLOKOSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]2CCCC[C@@H]12 ZINC000801539207 1129925782 /nfs/dbraw/zinc/92/57/82/1129925782.db2.gz CXSQAJBAXYGXFR-ZLDLUXBVSA-N 1 0 292.354 3.744 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]2CCCC[C@@H]21 ZINC000801539206 1129925794 /nfs/dbraw/zinc/92/57/94/1129925794.db2.gz CXSQAJBAXYGXFR-UXIGCNINSA-N 1 0 292.354 3.744 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1C ZINC000050564682 1129971714 /nfs/dbraw/zinc/97/17/14/1129971714.db2.gz XVKOUWJXNCMXHX-GHMZBOCLSA-N 1 0 282.771 3.869 20 5 CHBDRO CCO[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000902893915 1130080689 /nfs/dbraw/zinc/08/06/89/1130080689.db2.gz FRPXFOOLEKAFMI-HZSPNIEDSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1cncc([C@@H](C)[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000903245181 1130135886 /nfs/dbraw/zinc/13/58/86/1130135886.db2.gz JRZRMCTWXKQFIV-ZIAGYGMSSA-N 1 0 299.374 3.753 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1cncs1)c1ccccc1[N+](=O)[O-] ZINC000903244972 1130136050 /nfs/dbraw/zinc/13/60/50/1130136050.db2.gz HFTOESBHJFADTR-MNOVXSKESA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903282337 1130144841 /nfs/dbraw/zinc/14/48/41/1130144841.db2.gz CQNDJWGAGDPHLU-AAEUAGOBSA-N 1 0 294.420 3.920 20 5 CHBDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000790697315 1130326849 /nfs/dbraw/zinc/32/68/49/1130326849.db2.gz ZBAVWCLDVSUWIG-KRWDZBQOSA-N 1 0 296.370 3.989 20 5 CHBDRO CC[NH+](CC)CCSc1cc(Cl)ccc1[N+](=O)[O-] ZINC000791413439 1130372270 /nfs/dbraw/zinc/37/22/70/1130372270.db2.gz OGJONQOXBJQGSW-UHFFFAOYSA-N 1 0 288.800 3.682 20 5 CHBDRO CCC(C)(C)CC[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001170196058 1130461012 /nfs/dbraw/zinc/46/10/12/1130461012.db2.gz XWDDCZGHJQQQCQ-UHFFFAOYSA-N 1 0 278.396 3.895 20 5 CHBDRO CC(C)Oc1ccc(O[C@@H](C)C[N+](C)(C)C)cc1Cl ZINC001234210761 1130616578 /nfs/dbraw/zinc/61/65/78/1130616578.db2.gz OCNJEIAJUGAOLG-LBPRGKRZSA-N 1 0 286.823 3.601 20 5 CHBDRO C[C@H]1CC[C@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811505769 1130617774 /nfs/dbraw/zinc/61/77/74/1130617774.db2.gz HSWYTNOMLNOHPP-WRWORJQWSA-N 1 0 289.162 3.790 20 5 CHBDRO N[C@]12C[C@H]1C[N@H+](Cc1c3ccccc3cc3ccccc31)C2 ZINC001235146522 1130714155 /nfs/dbraw/zinc/71/41/55/1130714155.db2.gz MVZANKXCFWNNDN-JXFKEZNVSA-N 1 0 288.394 3.526 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000781982671 1130750912 /nfs/dbraw/zinc/75/09/12/1130750912.db2.gz PQWDDMHULVXSIT-LBPRGKRZSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000782107227 1130755220 /nfs/dbraw/zinc/75/52/20/1130755220.db2.gz LFQHECREIDQWIP-BLLLJJGKSA-N 1 0 292.354 3.746 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[N@@H+]([C@@H]1CCc3ccccc31)C2 ZINC000782181903 1130757638 /nfs/dbraw/zinc/75/76/38/1130757638.db2.gz JMMJKVYXTNHYHC-QGZVFWFLSA-N 1 0 294.354 3.640 20 5 CHBDRO CN(Cc1c2ccccc2cc2ccccc21)C[C@@H]1CC[NH2+]1 ZINC001235962454 1130817798 /nfs/dbraw/zinc/81/77/98/1130817798.db2.gz KPIHYOHDAFSWEL-KRWDZBQOSA-N 1 0 290.410 3.787 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2CCCCC2)cc1Cl ZINC000783592607 1130842165 /nfs/dbraw/zinc/84/21/65/1130842165.db2.gz KGVYNVNVEQAWOB-UHFFFAOYSA-N 1 0 282.771 3.918 20 5 CHBDRO C[NH2+][C@@H]1CCN1Cc1c2ccccc2cc2ccccc21 ZINC001236166661 1130878969 /nfs/dbraw/zinc/87/89/69/1130878969.db2.gz IZMJCPAOLLTCAO-IBGZPJMESA-N 1 0 276.383 3.744 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C12CCC(CC1)C2 ZINC000784644305 1130914846 /nfs/dbraw/zinc/91/48/46/1130914846.db2.gz VVQGHZIJDZLKDV-HYXAFXHYSA-N 1 0 272.348 3.530 20 5 CHBDRO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000815591032 1131004740 /nfs/dbraw/zinc/00/47/40/1131004740.db2.gz SXZDNTXFXWDREZ-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C/C=C\C1CC1)CCC2 ZINC001117713146 1131193405 /nfs/dbraw/zinc/19/34/05/1131193405.db2.gz NBRPOFKWFUOUIY-YPQKKHBXSA-N 1 0 272.348 3.528 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(Cl)cc1C(F)(F)F ZINC001228936702 1131980796 /nfs/dbraw/zinc/98/07/96/1131980796.db2.gz XSHKMILZFJMYFQ-VIFPVBQESA-N 1 0 296.740 3.832 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccns1)c1cccc([N+](=O)[O-])c1 ZINC000716059470 1132003908 /nfs/dbraw/zinc/00/39/08/1132003908.db2.gz ZMNKIZSZWCSJSB-MFKMUULPSA-N 1 0 291.376 3.853 20 5 CHBDRO CCCCCC(=O)c1ccc(O[C@H](C)C[N+](C)(C)C)cc1 ZINC001231259043 1132276403 /nfs/dbraw/zinc/27/64/03/1132276403.db2.gz DNPBMQCUKINSJF-OAHLLOKOSA-N 1 0 292.443 3.923 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CCC2)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000840812292 1132290036 /nfs/dbraw/zinc/29/00/36/1132290036.db2.gz XZPCPRAVXIEROL-LLVKDONJSA-N 1 0 289.379 3.550 20 5 CHBDRO CC1(C)CCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172904950 1132347320 /nfs/dbraw/zinc/34/73/20/1132347320.db2.gz BNJQLJKHROIINF-HNNXBMFYSA-N 1 0 288.391 3.717 20 5 CHBDRO CCC(CC)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899442 1132347776 /nfs/dbraw/zinc/34/77/76/1132347776.db2.gz XYQZVGKPQUSAJE-HNNXBMFYSA-N 1 0 276.380 3.620 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CC=CCC1)CC2 ZINC001172906083 1132348813 /nfs/dbraw/zinc/34/88/13/1132348813.db2.gz WKWJSZKYFLOERP-HOTGVXAUSA-N 1 0 286.375 3.541 20 5 CHBDRO C[N@H+](CC(C)(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914198 1132359856 /nfs/dbraw/zinc/35/98/56/1132359856.db2.gz DYYKJMWZVPHMCK-OAHLLOKOSA-N 1 0 290.407 3.820 20 5 CHBDRO C[N@H+](CC(C)(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914197 1132359905 /nfs/dbraw/zinc/35/99/05/1132359905.db2.gz DYYKJMWZVPHMCK-HNNXBMFYSA-N 1 0 290.407 3.820 20 5 CHBDRO C[C@H]1CCC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909385 1132371899 /nfs/dbraw/zinc/37/18/99/1132371899.db2.gz RJXKRMMNARCDSE-XJKSGUPXSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC001173232684 1132414222 /nfs/dbraw/zinc/41/42/22/1132414222.db2.gz SMLROWCUTQZBTF-BPUTZDHNSA-N 1 0 288.391 3.648 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1C[C@H]1c1ccccc1 ZINC001173236289 1132416486 /nfs/dbraw/zinc/41/64/86/1132416486.db2.gz ZSWQWTNTKWSNAQ-DOPJRALCSA-N 1 0 296.370 3.672 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001173213033 1132416777 /nfs/dbraw/zinc/41/67/77/1132416777.db2.gz CXILCUVGOGLZST-GJZGRUSLSA-N 1 0 298.386 3.919 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1CCCCC1 ZINC001173213069 1132416873 /nfs/dbraw/zinc/41/68/73/1132416873.db2.gz DKOOAJAYBGEMNX-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO CC(C)(C[NH3+])c1ccc(Nc2ccccc2[N+](=O)[O-])cc1 ZINC001159579559 1132866886 /nfs/dbraw/zinc/86/68/86/1132866886.db2.gz FVEAEPZVTQNHLJ-UHFFFAOYSA-N 1 0 285.347 3.575 20 5 CHBDRO [NH3+]C1(c2ccc(Nc3ccc([N+](=O)[O-])cc3)cc2)CCC1 ZINC001159720479 1132899180 /nfs/dbraw/zinc/89/91/80/1132899180.db2.gz BJBHBDHHTZFPBX-UHFFFAOYSA-N 1 0 283.331 3.676 20 5 CHBDRO CC[NH2+]Cc1cccc(Nc2ccc(F)c([N+](=O)[O-])c2)c1 ZINC001159956011 1132928503 /nfs/dbraw/zinc/92/85/03/1132928503.db2.gz CSRUAJORAPKLQV-UHFFFAOYSA-N 1 0 289.310 3.587 20 5 CHBDRO CC(C)(C)C(=[NH2+])Nc1cc2cccnc2c([N+](=O)[O-])c1 ZINC001162664460 1133102570 /nfs/dbraw/zinc/10/25/70/1133102570.db2.gz GPTVYHJGVAEZIH-UHFFFAOYSA-N 1 0 272.308 3.578 20 5 CHBDRO CC1(C)CCC[N@@H+]1CCNc1ccc(Cl)cc1[N+](=O)[O-] ZINC001163480709 1133152031 /nfs/dbraw/zinc/15/20/31/1133152031.db2.gz LZHXJAOOPWNPLE-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC001206248155 1133675752 /nfs/dbraw/zinc/67/57/52/1133675752.db2.gz RTONEEKDSLYHOS-HZPDHXFCSA-N 1 0 290.407 3.942 20 5 CHBDRO Nc1cc(Nc2cc3cccnc3c3ncccc23)cc[nH+]1 ZINC001206568604 1133719459 /nfs/dbraw/zinc/71/94/59/1133719459.db2.gz OSJILXJZOPGOBF-UHFFFAOYSA-N 1 0 287.326 3.504 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403713396 1134842996 /nfs/dbraw/zinc/84/29/96/1134842996.db2.gz XYGVRGYLJBOCFW-OUJBWJOFSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@@H]1C[C@H](OCc2c3ccccc3nc3ccccc32)C[NH2+]1 ZINC001217790275 1135001441 /nfs/dbraw/zinc/00/14/41/1135001441.db2.gz VJRCVDLQPDBVFF-KGLIPLIRSA-N 1 0 292.382 3.655 20 5 CHBDRO C[C@H]1[NH2+]C[C@H]1OCc1c2ccccc2cc2ccccc21 ZINC001217905619 1135021252 /nfs/dbraw/zinc/02/12/52/1135021252.db2.gz AIDNLYLAJPTRBU-BFUOFWGJSA-N 1 0 277.367 3.870 20 5 CHBDRO C[NH2+][C@H]1C[C@H](Oc2c3ccccc3c(O)c3ccccc32)C1 ZINC001217952801 1135030653 /nfs/dbraw/zinc/03/06/53/1135030653.db2.gz GKWUCOHTBDJWMB-JOCQHMNTSA-N 1 0 293.366 3.828 20 5 CHBDRO C[C@@H]1C[NH2+]C[C@@H]1Oc1c2ccccc2cc2ccccc21 ZINC001217969209 1135033715 /nfs/dbraw/zinc/03/37/15/1135033715.db2.gz YENKRPCZSMJUJK-ACJLOTCBSA-N 1 0 277.367 3.980 20 5 CHBDRO F[C@H]1C[NH2+]C[C@@H]1Oc1ccc2cc3ccccc3cc2c1 ZINC001218016405 1135042904 /nfs/dbraw/zinc/04/29/04/1135042904.db2.gz FBXYJGFYOGRWPW-ROUUACIJSA-N 1 0 281.330 3.682 20 5 CHBDRO F[C@H]1C[NH2+]C[C@@H]1Oc1c2ccccc2cc2ccccc21 ZINC001218016493 1135043376 /nfs/dbraw/zinc/04/33/76/1135043376.db2.gz GWNPUTOORCYSRA-IRXDYDNUSA-N 1 0 281.330 3.682 20 5 CHBDRO C[C@@H]1CC[NH2+]C[C@H]1Oc1nc2ccccc2c2ccccc21 ZINC001218044220 1135048902 /nfs/dbraw/zinc/04/89/02/1135048902.db2.gz RJSGCYACKUOACX-FZKQIMNGSA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@H]1C[C@H](Oc2cccc3ccc4cccnc4c32)CC[NH2+]1 ZINC001218058005 1135051380 /nfs/dbraw/zinc/05/13/80/1135051380.db2.gz VJDVLLIJOKJNOD-XJKSGUPXSA-N 1 0 292.382 3.907 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@H]1C[C@H]2C[C@@H]1C[NH2+]2 ZINC001218143848 1135063046 /nfs/dbraw/zinc/06/30/46/1135063046.db2.gz YOOMRGFIRNZBIA-LBTNJELSSA-N 1 0 290.366 3.517 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@H]1CCC12C[NH2+]C2 ZINC001218242957 1135072520 /nfs/dbraw/zinc/07/25/20/1135072520.db2.gz VNXCCTKPDSJIGZ-KRWDZBQOSA-N 1 0 290.366 3.519 20 5 CHBDRO C[C@@H]1CC[C@H](Oc2cccc3ccc4cccnc4c32)C[NH2+]1 ZINC001218399378 1135099611 /nfs/dbraw/zinc/09/96/11/1135099611.db2.gz PQYCIXSSVHKXIV-CJNGLKHVSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H]1C[NH2+]CC[C@@H]1Oc1nc2ccccc2c2ccccc21 ZINC001218419255 1135102038 /nfs/dbraw/zinc/10/20/38/1135102038.db2.gz LNTUTKQIDWYWGJ-UGSOOPFHSA-N 1 0 292.382 3.765 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@@H]3C[C@H]4C[NH2+][C@@H]3C4)cc2c1 ZINC001218487755 1135115698 /nfs/dbraw/zinc/11/56/98/1135115698.db2.gz AAXAESWWRZGUEM-BJOOFOGMSA-N 1 0 290.366 3.517 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000313447413 1135138467 /nfs/dbraw/zinc/13/84/67/1135138467.db2.gz BMRBAIILUZIXMG-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OC1c2ccccc2-c2ccccc21 ZINC001222942753 1135287807 /nfs/dbraw/zinc/28/78/07/1135287807.db2.gz WWERONYBZVAOQQ-AWEZNQCLSA-N 1 0 282.407 3.868 20 5 CHBDRO C[C@H](C[NH+](C)C)OCc1c2ccccc2nc2ccccc21 ZINC001223334041 1135329402 /nfs/dbraw/zinc/32/94/02/1135329402.db2.gz GLCMVAMIXIHKFP-CQSZACIVSA-N 1 0 294.398 3.855 20 5 CHBDRO CC(C)[N@@H+]1CCC[C@H](O[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC001223428016 1135344595 /nfs/dbraw/zinc/34/45/95/1135344595.db2.gz YSSXLPJBVAOMDR-CJNGLKHVSA-N 1 0 292.379 3.545 20 5 CHBDRO C[N+](C)(C)CCO[C@@H]1CCCC[C@@H]1C1CCCCC1 ZINC001224772724 1135480342 /nfs/dbraw/zinc/48/03/42/1135480342.db2.gz BYPDKJSLVSTKIM-IAGOWNOFSA-N 1 0 268.465 3.848 20 5 CHBDRO Cc1cc(O[C@H](C)C[N+](C)(C)C)nc2ccc(Cl)cc12 ZINC001226519686 1135707762 /nfs/dbraw/zinc/70/77/62/1135707762.db2.gz DJHCVJZBQVIVDE-GFCCVEGCSA-N 1 0 293.818 3.670 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(-c2ccc(O)cc2)cc1 ZINC001226861502 1135751409 /nfs/dbraw/zinc/75/14/09/1135751409.db2.gz BVBQBXWIQNYBKV-CQSZACIVSA-O 1 0 286.395 3.533 20 5 CHBDRO C[C@H]1CC[C@H](C)[NH+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000342071544 130234919 /nfs/dbraw/zinc/23/49/19/130234919.db2.gz NFJYRFYTBYVULO-UWVGGRQHSA-N 1 0 268.744 3.621 20 5 CHBDRO Cc1ccccc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000020126329 171010240 /nfs/dbraw/zinc/01/02/40/171010240.db2.gz XIVWGRUMZHPNMY-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO Cc1ccccc1[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000020126327 171010596 /nfs/dbraw/zinc/01/05/96/171010596.db2.gz FPWGGIJDPANVAO-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000020148042 171035081 /nfs/dbraw/zinc/03/50/81/171035081.db2.gz UIYBCFRJLWOKFO-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1cccc([N+](=O)[O-])c1 ZINC000020205131 171070297 /nfs/dbraw/zinc/07/02/97/171070297.db2.gz IIPGWCOFQNSIDB-ABAIWWIYSA-N 1 0 286.331 3.916 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000020522586 171235437 /nfs/dbraw/zinc/23/54/37/171235437.db2.gz JGLKRVQAMWBLOI-VXGBXAGGSA-N 1 0 250.342 3.598 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000020526104 171238818 /nfs/dbraw/zinc/23/88/18/171238818.db2.gz UUMSSLZWCIPJKF-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO CC[C@H]([NH2+]CCCOCC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000036721134 172657806 /nfs/dbraw/zinc/65/78/06/172657806.db2.gz ZDUHTABDSGTJEK-INIZCTEOSA-N 1 0 294.395 3.698 20 5 CHBDRO CC(C)CCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000038093534 174107296 /nfs/dbraw/zinc/10/72/96/174107296.db2.gz OZUIVYYRIMTLLI-LBPRGKRZSA-N 1 0 250.342 3.682 20 5 CHBDRO C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355078908 227377335 /nfs/dbraw/zinc/37/73/35/227377335.db2.gz BVVKVBWRXAHYFW-GMTAPVOTSA-N 1 0 268.382 3.523 20 5 CHBDRO C[NH+](C)[C@@H]1CCC[C@H](Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000301499441 227562537 /nfs/dbraw/zinc/56/25/37/227562537.db2.gz AETCAYNMMMQWAM-NWDGAFQWSA-N 1 0 297.786 3.533 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000330373724 228170577 /nfs/dbraw/zinc/17/05/77/228170577.db2.gz DHORFPWWKZENPN-OSMZGAPFSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1[nH+]ccc(NCCc2ccc([N+](=O)[O-])cc2)c1Cl ZINC000312651531 260187692 /nfs/dbraw/zinc/18/76/92/260187692.db2.gz YPKSAPXPNKHRIT-UHFFFAOYSA-N 1 0 291.738 3.606 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000449096900 260212673 /nfs/dbraw/zinc/21/26/73/260212673.db2.gz KHDUGZGYHPUOKJ-TZMCWYRMSA-N 1 0 264.369 3.550 20 5 CHBDRO CCC[C@H]([NH2+][C@H](CC)[C@@H](O)CC)c1cccc([N+](=O)[O-])c1 ZINC000313163691 260255275 /nfs/dbraw/zinc/25/52/75/260255275.db2.gz RSVVMODHZFYUSR-PMPSAXMXSA-N 1 0 294.395 3.575 20 5 CHBDRO CCC[C@H]([NH2+][C@H](CC)[C@H](O)CC)c1cccc([N+](=O)[O-])c1 ZINC000313163689 260255398 /nfs/dbraw/zinc/25/53/98/260255398.db2.gz RSVVMODHZFYUSR-OWCLPIDISA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1ccccc1C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000517760684 260258146 /nfs/dbraw/zinc/25/81/46/260258146.db2.gz CHLWMMPWYMGSQP-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000090918640 260264193 /nfs/dbraw/zinc/26/41/93/260264193.db2.gz OFDPOFTXEVKADN-ABAIWWIYSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000426768929 260279272 /nfs/dbraw/zinc/27/92/72/260279272.db2.gz DKWYRDNHYHUSAV-GASCZTMLSA-N 1 0 274.364 3.525 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cncs1)c1cccc([N+](=O)[O-])c1 ZINC000161604948 261253656 /nfs/dbraw/zinc/25/36/56/261253656.db2.gz CCSAHKDIIHPGOX-MFKMUULPSA-N 1 0 291.376 3.853 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCC2(F)F)cc1[N+](=O)[O-] ZINC000390592739 262224869 /nfs/dbraw/zinc/22/48/69/262224869.db2.gz SHAOQLGKSXTBGS-YPMHNXCESA-N 1 0 298.333 3.989 20 5 CHBDRO CCOC(C)(C)C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000186541801 262316662 /nfs/dbraw/zinc/31/66/62/262316662.db2.gz UJHPXYMWHRJPPW-UHFFFAOYSA-N 1 0 294.395 3.623 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000228554649 262341661 /nfs/dbraw/zinc/34/16/61/262341661.db2.gz NJZWDARBPLEOTB-WFASDCNBSA-N 1 0 294.420 3.779 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCCC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000390899374 262359873 /nfs/dbraw/zinc/35/98/73/262359873.db2.gz GHNUEXXTXNLDNV-CMPLNLGQSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCCC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000390899375 262359896 /nfs/dbraw/zinc/35/98/96/262359896.db2.gz GHNUEXXTXNLDNV-JQWIXIFHSA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccccc2)cc1[N+](=O)[O-] ZINC000021510170 262389730 /nfs/dbraw/zinc/38/97/30/262389730.db2.gz GYOGOLFHPNTTIJ-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@@H](CC(F)(F)F)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000463732874 262393570 /nfs/dbraw/zinc/39/35/70/262393570.db2.gz YUNXLEWODXFMHI-OAQKJQOQSA-N 1 0 288.269 3.539 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@H](C)CCOC)c1cccc([N+](=O)[O-])c1 ZINC000414194278 262817120 /nfs/dbraw/zinc/81/71/20/262817120.db2.gz IPPTURJLYHIQAZ-CZUORRHYSA-N 1 0 294.395 3.698 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1cccc([N+](=O)[O-])c1 ZINC000187848269 263271756 /nfs/dbraw/zinc/27/17/56/263271756.db2.gz AYOBKFLYDBEJBR-HUUCEWRRSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+][C@H]1COCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000417407319 264224652 /nfs/dbraw/zinc/22/46/52/264224652.db2.gz SIIMDTXZRCDQDQ-SJCJKPOMSA-N 1 0 298.342 3.517 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCCF)o1 ZINC000361062714 266776746 /nfs/dbraw/zinc/77/67/46/266776746.db2.gz WJORDJBJEJPLPC-UHFFFAOYSA-N 1 0 292.310 3.694 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(C2CC2)cc1 ZINC000094519604 327954915 /nfs/dbraw/zinc/95/49/15/327954915.db2.gz FQODFQFJKYTPHI-UHFFFAOYSA-N 1 0 282.343 3.762 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C2(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000531863333 328050594 /nfs/dbraw/zinc/05/05/94/328050594.db2.gz LQKDDXNGNUESGI-UHFFFAOYSA-N 1 0 274.364 3.750 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C2CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000563446114 328066059 /nfs/dbraw/zinc/06/60/59/328066059.db2.gz MVSJTWKKOCQMME-NSHDSACASA-N 1 0 292.379 3.833 20 5 CHBDRO COC1([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CCC1 ZINC000414307097 328154393 /nfs/dbraw/zinc/15/43/93/328154393.db2.gz OSBARWHAJOYEIE-QWHCGFSZSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2CCC[C@H]2C2CC2)cs1 ZINC000414485643 328185780 /nfs/dbraw/zinc/18/57/80/328185780.db2.gz PSRJUWIPQBGHGP-STQMWFEESA-N 1 0 280.393 3.572 20 5 CHBDRO Cc1ccc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC000534530367 328305153 /nfs/dbraw/zinc/30/51/53/328305153.db2.gz BCSWMDNQGFACHJ-MRXNPFEDSA-N 1 0 297.358 3.502 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000395140685 328617038 /nfs/dbraw/zinc/61/70/38/328617038.db2.gz FNULXZYNAVJXJG-KZVDOYCCSA-N 1 0 262.353 3.598 20 5 CHBDRO Cc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000049686709 328378264 /nfs/dbraw/zinc/37/82/64/328378264.db2.gz BDFOIPYKTLQMEQ-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2cccs2)C2CC2)cc1 ZINC000049956673 328379676 /nfs/dbraw/zinc/37/96/76/328379676.db2.gz SMYFIJDWOGFGSJ-HNNXBMFYSA-N 1 0 288.372 3.897 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000050443684 328439634 /nfs/dbraw/zinc/43/96/34/328439634.db2.gz PIUGDZJJVMQCDB-NXEZZACHSA-N 1 0 270.760 3.772 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000050443687 328439816 /nfs/dbraw/zinc/43/98/16/328439816.db2.gz PIUGDZJJVMQCDB-UWVGGRQHSA-N 1 0 270.760 3.772 20 5 CHBDRO CCCC[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000050886720 328450478 /nfs/dbraw/zinc/45/04/78/328450478.db2.gz HJPMDJJGTKJWTL-RYUDHWBXSA-N 1 0 250.342 3.824 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000037010427 326834031 /nfs/dbraw/zinc/83/40/31/326834031.db2.gz RJKHNXIWNYSTLN-KRWDZBQOSA-N 1 0 284.359 3.878 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(Cl)c2)cc1 ZINC000037487005 326853735 /nfs/dbraw/zinc/85/37/35/326853735.db2.gz KBHIACVILBCAMR-UHFFFAOYSA-N 1 0 276.723 3.538 20 5 CHBDRO CCC[NH+](CCC)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000557036265 326990360 /nfs/dbraw/zinc/99/03/60/326990360.db2.gz JWGJHZGLZNOHJK-LBPRGKRZSA-N 1 0 250.342 3.778 20 5 CHBDRO C[C@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000231751164 327010573 /nfs/dbraw/zinc/01/05/73/327010573.db2.gz QNPDQYSTWPICQP-SSDOTTSWSA-N 1 0 296.676 3.679 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]C(C2CCC2)C2CCC2)c1 ZINC000558970574 327135790 /nfs/dbraw/zinc/13/57/90/327135790.db2.gz KKMBTWPBWYDLGC-UHFFFAOYSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089511925 327170836 /nfs/dbraw/zinc/17/08/36/327170836.db2.gz HGSGWBCLDCPKTA-SJKOYZFVSA-N 1 0 282.343 3.618 20 5 CHBDRO C[C@@H](C[NH+]1CCCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000047873374 327216319 /nfs/dbraw/zinc/21/63/19/327216319.db2.gz FPQNLCHOVNYDRS-NSHDSACASA-N 1 0 297.786 3.535 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000574340322 327317390 /nfs/dbraw/zinc/31/73/90/327317390.db2.gz ZDBWFIJARTYFBF-MIFYACCESA-N 1 0 274.364 3.606 20 5 CHBDRO C[C@H]1C[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000583432956 327361809 /nfs/dbraw/zinc/36/18/09/327361809.db2.gz IXBYXEJCCDWZRB-SCLBCKFNSA-N 1 0 296.370 3.975 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCCC[C@H]2C2CC2)cc1 ZINC000507463134 332807181 /nfs/dbraw/zinc/80/71/81/332807181.db2.gz RDFSBPABNJYCBM-DLBZAZTESA-N 1 0 288.391 3.696 20 5 CHBDRO CSC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CCC1 ZINC000193811218 329063205 /nfs/dbraw/zinc/06/32/05/329063205.db2.gz OPIVOXNDKGZPBF-LBPRGKRZSA-N 1 0 294.420 3.840 20 5 CHBDRO COCC[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000508996255 332854819 /nfs/dbraw/zinc/85/48/19/332854819.db2.gz FQMSQTPGUVJFLN-DOMZBBRYSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000188874899 329374057 /nfs/dbraw/zinc/37/40/57/329374057.db2.gz MISZIVPMCZESNI-MRXNPFEDSA-N 1 0 298.342 3.517 20 5 CHBDRO C[C@@H]([NH2+]CC1=CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000379587891 330139490 /nfs/dbraw/zinc/13/94/90/330139490.db2.gz NOWBSDLIAHTPBD-GFCCVEGCSA-N 1 0 260.337 3.746 20 5 CHBDRO CC[C@@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144266 330153615 /nfs/dbraw/zinc/15/36/15/330153615.db2.gz BPPFHBLVBHHZND-YGRLFVJLSA-N 1 0 262.353 3.705 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCC23CCCC3)cc1 ZINC000328070857 330308152 /nfs/dbraw/zinc/30/81/52/330308152.db2.gz DOOKOQXWHUGKQM-OAHLLOKOSA-N 1 0 274.364 3.797 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CC12CCCC2 ZINC000428537072 330527521 /nfs/dbraw/zinc/52/75/21/330527521.db2.gz MQKWMRTVILMBGV-KEDPEKRHSA-N 1 0 272.348 3.530 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)C(C)(C)C ZINC000430225813 330564612 /nfs/dbraw/zinc/56/46/12/330564612.db2.gz ZAHIQZLTWWUFMD-AWEZNQCLSA-N 1 0 280.368 3.518 20 5 CHBDRO CC[C@@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144264 330618141 /nfs/dbraw/zinc/61/81/41/330618141.db2.gz BPPFHBLVBHHZND-QMTHXVAHSA-N 1 0 262.353 3.705 20 5 CHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000438481885 330726036 /nfs/dbraw/zinc/72/60/36/330726036.db2.gz WSBHCMMQHKVYRM-GFCCVEGCSA-N 1 0 290.285 3.661 20 5 CHBDRO CCC(CC)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447519412 330867595 /nfs/dbraw/zinc/86/75/95/330867595.db2.gz YKNSVMVPEZMBTB-HNNXBMFYSA-N 1 0 262.353 3.750 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1cccs1 ZINC000449065702 330896684 /nfs/dbraw/zinc/89/66/84/330896684.db2.gz VSDSEYNDHIKLIY-VXGBXAGGSA-N 1 0 290.388 3.938 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C23CCC(CC2)CC3)c(F)c1 ZINC000449545231 330935206 /nfs/dbraw/zinc/93/52/06/330935206.db2.gz YFWPHEYBGYPVJG-UHFFFAOYSA-N 1 0 278.327 3.546 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000449740034 330947499 /nfs/dbraw/zinc/94/74/99/330947499.db2.gz DFOMSGTYDCVKOY-RCBQFDQVSA-N 1 0 288.391 3.552 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C2CC(C)(F)C2)cc1[N+](=O)[O-] ZINC000453242728 331106428 /nfs/dbraw/zinc/10/64/28/331106428.db2.gz WMSOFTSPANPKCE-CKQAKLJMSA-N 1 0 296.342 3.535 20 5 CHBDRO CCC(C)(C)OCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453410367 331129660 /nfs/dbraw/zinc/12/96/60/331129660.db2.gz PGKQDIBJELUUOT-ZDUSSCGKSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@H]([NH2+]C1CC2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000459383863 331279512 /nfs/dbraw/zinc/27/95/12/331279512.db2.gz GBTUREIHLNYRAZ-NSHDSACASA-N 1 0 260.337 3.578 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CCCCF ZINC000462812919 331330482 /nfs/dbraw/zinc/33/04/82/331330482.db2.gz PCHDRBJOYOIPLI-UKRRQHHQSA-N 1 0 294.370 3.645 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@H](C)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000464815899 331369439 /nfs/dbraw/zinc/36/94/39/331369439.db2.gz VIWAXFUZDCPGQG-NEPJUHHUSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@H]1CC[C@H](C)[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000464822214 331369741 /nfs/dbraw/zinc/36/97/41/331369741.db2.gz KXGIUFYLDKHJPN-QWRGUYRKSA-N 1 0 282.771 3.869 20 5 CHBDRO CCC[C@H](C)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000466463874 331397673 /nfs/dbraw/zinc/39/76/73/331397673.db2.gz PAHCNRSOQSKPPZ-JTQLQIEISA-N 1 0 270.760 3.774 20 5 CHBDRO CC[C@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000402479107 331908877 /nfs/dbraw/zinc/90/88/77/331908877.db2.gz ITVDPBKWKPPTBU-JTQLQIEISA-N 1 0 290.285 3.663 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490551770 332091329 /nfs/dbraw/zinc/09/13/29/332091329.db2.gz ZJQKRJKTPPJZNU-WQGACYEGSA-N 1 0 292.354 3.887 20 5 CHBDRO CC(C)CCC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000492238848 332388531 /nfs/dbraw/zinc/38/85/31/332388531.db2.gz GOUYPTYWLBHQNH-UHFFFAOYSA-N 1 0 264.369 3.856 20 5 CHBDRO CCOc1cc(C[NH+](C(C)C)C(C)C)ccc1[N+](=O)[O-] ZINC000492583717 332404413 /nfs/dbraw/zinc/40/44/13/332404413.db2.gz QVRWEXJJIGMDPF-UHFFFAOYSA-N 1 0 280.368 3.612 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCC12CCC2 ZINC000502412312 332657733 /nfs/dbraw/zinc/65/77/33/332657733.db2.gz CNLNXZYPCJQMMV-AWEZNQCLSA-N 1 0 294.782 3.713 20 5 CHBDRO CC[C@@H](C)[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504925473 332725337 /nfs/dbraw/zinc/72/53/37/332725337.db2.gz CDVKAIDQVCZGQJ-VXGBXAGGSA-N 1 0 282.409 3.854 20 5 CHBDRO CC[C@@H](C)[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504925470 332725361 /nfs/dbraw/zinc/72/53/61/332725361.db2.gz CDVKAIDQVCZGQJ-NEPJUHHUSA-N 1 0 282.409 3.854 20 5 CHBDRO C[C@H]1CC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000513057053 333001864 /nfs/dbraw/zinc/00/18/64/333001864.db2.gz MHDTZXGVNGMCEQ-SMDDNHRTSA-N 1 0 286.331 3.743 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CC[C@H]2C)cc1[N+](=O)[O-] ZINC000513117798 333005183 /nfs/dbraw/zinc/00/51/83/333005183.db2.gz VIBWVHVJJGFEEQ-BXUZGUMPSA-N 1 0 262.353 3.606 20 5 CHBDRO CCC(C)(C)OCC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000308548268 333034675 /nfs/dbraw/zinc/03/46/75/333034675.db2.gz RKKBIQFVRPYSJO-CYBMUJFWSA-N 1 0 294.395 3.759 20 5 CHBDRO CC(C)C[C@@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000311287873 333066670 /nfs/dbraw/zinc/06/66/70/333066670.db2.gz NMDNVDRZUOAKHO-CHWSQXEVSA-N 1 0 264.369 3.928 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000219474053 333150565 /nfs/dbraw/zinc/15/05/65/333150565.db2.gz OFZIRFCCNNPEJZ-OCCSQVGLSA-N 1 0 276.380 3.819 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1ccccc1[N+](=O)[O-] ZINC000222504480 333195050 /nfs/dbraw/zinc/19/50/50/333195050.db2.gz WLQSPYDBGBTBQX-JHJVBQTASA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000230409365 333318176 /nfs/dbraw/zinc/31/81/76/333318176.db2.gz YYWXVBBEJXWATM-FRRDWIJNSA-N 1 0 262.353 3.682 20 5 CHBDRO Cc1ccccc1C[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000523701994 333340207 /nfs/dbraw/zinc/34/02/07/333340207.db2.gz KWWRKWPTGAVPIV-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO CC(C)[C@@H]1N(Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000576010858 335141436 /nfs/dbraw/zinc/14/14/36/335141436.db2.gz RBPQDXWWHXSIHN-LBPRGKRZSA-N 1 0 268.382 3.523 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000036992577 333452328 /nfs/dbraw/zinc/45/23/28/333452328.db2.gz PVZSVWOQLVOOQO-NWDGAFQWSA-N 1 0 290.388 3.938 20 5 CHBDRO CC[C@@H]1CC[C@H](C)[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000576021257 335142437 /nfs/dbraw/zinc/14/24/37/335142437.db2.gz WSYYFIBKHHIYAU-MTENODCZSA-N 1 0 274.364 3.871 20 5 CHBDRO C[C@H]([NH2+]CC1Cc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000539071844 333655074 /nfs/dbraw/zinc/65/50/74/333655074.db2.gz LFJASDYKLVKSGL-ZDUSSCGKSA-N 1 0 296.370 3.660 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(C)CCC1 ZINC000539120135 333659306 /nfs/dbraw/zinc/65/93/06/333659306.db2.gz KQESBAWPAPXJPX-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1CCC(F)(F)CC1 ZINC000539520592 333676017 /nfs/dbraw/zinc/67/60/17/333676017.db2.gz LDNGGKHGRDVMGW-HYXAFXHYSA-N 1 0 296.317 3.776 20 5 CHBDRO Cc1ccc(CC[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000540480314 333731603 /nfs/dbraw/zinc/73/16/03/333731603.db2.gz JIEZFZYUBHKURX-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@H]([NH2+]CCCCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000130403170 333841344 /nfs/dbraw/zinc/84/13/44/333841344.db2.gz PJTIOEUCPXNVQR-JTQLQIEISA-N 1 0 290.285 3.978 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c(Cl)c1 ZINC000543859677 333903690 /nfs/dbraw/zinc/90/36/90/333903690.db2.gz RTIRHSSILIJWAQ-RYUDHWBXSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCOC(C)(C)C1 ZINC000546650154 334043608 /nfs/dbraw/zinc/04/36/08/334043608.db2.gz FAXWGAHRKUAHBN-STQMWFEESA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000081045985 334177357 /nfs/dbraw/zinc/17/73/57/334177357.db2.gz XUTODIQKGJXKIH-STQMWFEESA-N 1 0 264.369 3.846 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+]C1(C(C)C)CC1 ZINC000550274681 334218533 /nfs/dbraw/zinc/21/85/33/334218533.db2.gz QAKDCRWRNJYOEK-UHFFFAOYSA-N 1 0 292.379 3.660 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1CC2CCC1CC2 ZINC000552083806 334287195 /nfs/dbraw/zinc/28/71/95/334287195.db2.gz YZIUKKGGDOCMQN-DQNAWAGBSA-N 1 0 286.375 3.776 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCS[C@H](C)CC1 ZINC000249014157 334324631 /nfs/dbraw/zinc/32/46/31/334324631.db2.gz JXUUGIIWKZZXEB-CHWSQXEVSA-N 1 0 294.420 3.792 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000250926497 334353376 /nfs/dbraw/zinc/35/33/76/334353376.db2.gz WSVTZAUYTFNXFE-NJZAAPMLSA-N 1 0 276.380 3.818 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000251574464 334364731 /nfs/dbraw/zinc/36/47/31/334364731.db2.gz BUMQIQGFRFJRJM-UMVBOHGHSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000252731026 334387642 /nfs/dbraw/zinc/38/76/42/334387642.db2.gz NYXHRVZJLZKHLS-OBJOEFQTSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+]C1CC(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000554404267 334428800 /nfs/dbraw/zinc/42/88/00/334428800.db2.gz TUXWDWVCVOWGRZ-MFAVDMRSSA-N 1 0 288.269 3.586 20 5 CHBDRO COC1(CC[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCC1 ZINC000556225152 334501290 /nfs/dbraw/zinc/50/12/90/334501290.db2.gz ZSJVHYCRYXMVHP-ZDUSSCGKSA-N 1 0 292.379 3.513 20 5 CHBDRO CC1=CC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000556253253 334503817 /nfs/dbraw/zinc/50/38/17/334503817.db2.gz NNYFNGJWSHDARA-CQSZACIVSA-N 1 0 294.782 3.879 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCC1CC(F)(F)C1 ZINC000565217702 334545827 /nfs/dbraw/zinc/54/58/27/334545827.db2.gz IZZCEYNNJXFYPS-CYBMUJFWSA-N 1 0 296.317 3.607 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC2CCC1CC2)c1ccc([N+](=O)[O-])cc1 ZINC000380684437 336016724 /nfs/dbraw/zinc/01/67/24/336016724.db2.gz DCXNTDIHJQWUMR-QXKCDYLGSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@@H](CC(C)(C)C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000384637782 336128401 /nfs/dbraw/zinc/12/84/01/336128401.db2.gz AIIQFJGHVYDZOX-NSHDSACASA-N 1 0 250.342 3.509 20 5 CHBDRO COC1(CC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000294546339 522595745 /nfs/dbraw/zinc/59/57/45/522595745.db2.gz KPMMMEALBYJATM-ZDUSSCGKSA-N 1 0 292.379 3.513 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000037010386 522655474 /nfs/dbraw/zinc/65/54/74/522655474.db2.gz MSKZIQPHYVBHPZ-INIZCTEOSA-N 1 0 270.332 3.836 20 5 CHBDRO CC[C@@H]([NH2+]C[C@]1(C)CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000122012802 522868417 /nfs/dbraw/zinc/86/84/17/522868417.db2.gz WNTSDPHWCZVIAY-CABCVRRESA-N 1 0 294.420 3.921 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000062050650 522875134 /nfs/dbraw/zinc/87/51/34/522875134.db2.gz UXUVVKWOUKIRTR-MRXNPFEDSA-N 1 0 285.347 3.539 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000037010522 522937576 /nfs/dbraw/zinc/93/75/76/522937576.db2.gz SZQFSBDJBGAIMO-MLGOLLRUSA-N 1 0 285.347 3.792 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1coc2ccccc12 ZINC000339408333 525565121 /nfs/dbraw/zinc/56/51/21/525565121.db2.gz ZASFSPNGPUSVLE-UHFFFAOYSA-N 1 0 296.326 3.939 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCC(F)(F)F)cc1[N+](=O)[O-] ZINC000126793471 525724653 /nfs/dbraw/zinc/72/46/53/525724653.db2.gz SHRZLGKDCZEPBK-SNVBAGLBSA-N 1 0 290.285 3.896 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])s1 ZINC000049158844 525734927 /nfs/dbraw/zinc/73/49/27/525734927.db2.gz JSQPXKAICHKXHD-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289687884 526084749 /nfs/dbraw/zinc/08/47/49/526084749.db2.gz GUMNJFRGMQRDEA-GHMZBOCLSA-N 1 0 284.306 3.633 20 5 CHBDRO Cc1sccc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000353360639 526911862 /nfs/dbraw/zinc/91/18/62/526911862.db2.gz JNZACDWLCAZBNY-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCc3sccc32)cc1 ZINC000061328147 527350378 /nfs/dbraw/zinc/35/03/78/527350378.db2.gz YMIQNODRUQVPLQ-AWEZNQCLSA-N 1 0 288.372 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCNc3ccccc32)cc1 ZINC000192972073 527350447 /nfs/dbraw/zinc/35/04/47/527350447.db2.gz FBDNUXARNWDKQT-QGZVFWFLSA-N 1 0 297.358 3.631 20 5 CHBDRO CC1CC[NH+](CCCCNc2ccc([N+](=O)[O-])cc2)CC1 ZINC000301091057 528237821 /nfs/dbraw/zinc/23/78/21/528237821.db2.gz LAPVZHHFBQAPBW-UHFFFAOYSA-N 1 0 291.395 3.519 20 5 CHBDRO CC(C)[NH+](CCCNc1ccccc1[N+](=O)[O-])C(C)C ZINC000348180040 528886130 /nfs/dbraw/zinc/88/61/30/528886130.db2.gz OAIHHKLURCQQMJ-UHFFFAOYSA-N 1 0 279.384 3.516 20 5 CHBDRO Cc1c(C[N@@H+](CC2CC2)C(C)C)cccc1[N+](=O)[O-] ZINC000532665319 1125477223 /nfs/dbraw/zinc/47/72/23/1125477223.db2.gz MIJAAEZJDCBDRS-UHFFFAOYSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000084986798 1119016286 /nfs/dbraw/zinc/01/62/86/1119016286.db2.gz USLCYRYVAJCDAL-DYEKYZERSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000302754087 1120656736 /nfs/dbraw/zinc/65/67/36/1120656736.db2.gz ZNOODGQOSSLVAM-FRRDWIJNSA-N 1 0 262.353 3.634 20 5 CHBDRO CCC1CC([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000585764765 1121033079 /nfs/dbraw/zinc/03/30/79/1121033079.db2.gz DHDJCUDSEATIBB-DCBWTQNWSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@H]([NH2+]CC(C)(C)CC(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000883258858 1125386324 /nfs/dbraw/zinc/38/63/24/1125386324.db2.gz RLPAIGKWFSDWFP-JTQLQIEISA-N 1 0 286.322 3.927 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000037176955 1132006854 /nfs/dbraw/zinc/00/68/54/1132006854.db2.gz IHKCDQQEGUEWQI-XUJVJEKNSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H]([NH2+]CCC1(F)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000348336243 1125593500 /nfs/dbraw/zinc/59/35/00/1125593500.db2.gz SFSMYICEJDVAIE-AWEZNQCLSA-N 1 0 280.343 3.918 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000054080631 1125618514 /nfs/dbraw/zinc/61/85/14/1125618514.db2.gz QVLCLRNKQWUJDU-NWDGAFQWSA-N 1 0 262.353 3.824 20 5 CHBDRO CO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000886512982 1125683008 /nfs/dbraw/zinc/68/30/08/1125683008.db2.gz QXLNFGXRBWKJSQ-JGGQBBKZSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1cccc(SCCC[NH+]2CCCCC2)c1 ZINC000509686037 1125777385 /nfs/dbraw/zinc/77/73/85/1125777385.db2.gz YTDNOPVGCZTPGJ-UHFFFAOYSA-N 1 0 280.393 3.563 20 5 CHBDRO Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000037718968 1129205726 /nfs/dbraw/zinc/20/57/26/1129205726.db2.gz IFXCIKWQCOXACU-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000482507475 1126762116 /nfs/dbraw/zinc/76/21/16/1126762116.db2.gz JNLYCRAWSMKSHQ-GXTWGEPZSA-N 1 0 262.353 3.524 20 5 CHBDRO O=[N+]([O-])c1ccccc1COc1ccc([C@H]2CCC[NH2+]2)cc1 ZINC000905618364 1126909803 /nfs/dbraw/zinc/90/98/03/1126909803.db2.gz XKFBNOZQQOXDEL-MRXNPFEDSA-N 1 0 298.342 3.598 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000037176962 1126923334 /nfs/dbraw/zinc/92/33/34/1126923334.db2.gz SGPQDAVPYKVPGN-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000037260527 1126984612 /nfs/dbraw/zinc/98/46/12/1126984612.db2.gz GARYVBMJXARMEN-NEPJUHHUSA-N 1 0 250.342 3.680 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C/C=C/c2ccncc2)cc1[N+](=O)[O-] ZINC000487279388 1127028457 /nfs/dbraw/zinc/02/84/57/1127028457.db2.gz VSVUIMQWWFOJTM-RDFMZFSFSA-N 1 0 297.358 3.662 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cncs2)cc1[N+](=O)[O-] ZINC000271474703 1127084442 /nfs/dbraw/zinc/08/44/42/1127084442.db2.gz JLIMABLZHMFNPD-GHMZBOCLSA-N 1 0 291.376 3.772 20 5 CHBDRO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)(C)C ZINC000045073473 1127179274 /nfs/dbraw/zinc/17/92/74/1127179274.db2.gz XQHSADDWSFYRBZ-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@H](C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000571890688 1127179457 /nfs/dbraw/zinc/17/94/57/1127179457.db2.gz YPEDMPCVCOIYKL-OAHLLOKOSA-N 1 0 298.386 3.873 20 5 CHBDRO CC[C@H]1CC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000588230221 1127182318 /nfs/dbraw/zinc/18/23/18/1127182318.db2.gz JFQMPYZVKQLUPR-GWCFXTLKSA-N 1 0 282.771 3.569 20 5 CHBDRO CCC[N@@H+](Cc1csc([N+](=O)[O-])c1)CC(C)C ZINC000351604282 1127197346 /nfs/dbraw/zinc/19/73/46/1127197346.db2.gz TVHULYCNVISKFK-UHFFFAOYSA-N 1 0 256.371 3.524 20 5 CHBDRO CC(C)(C)C1CC([NH2+]Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000590193323 1127251568 /nfs/dbraw/zinc/25/15/68/1127251568.db2.gz MEENDBDGMMYRBF-UHFFFAOYSA-N 1 0 280.343 3.648 20 5 CHBDRO CC1(C)C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000590204417 1127251618 /nfs/dbraw/zinc/25/16/18/1127251618.db2.gz IEXOXACGTIRLIE-DOMZBBRYSA-N 1 0 292.354 3.744 20 5 CHBDRO Cc1cc(F)ccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000590745150 1127271051 /nfs/dbraw/zinc/27/10/51/1127271051.db2.gz WJFIQDVGARIORC-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC(C)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000045751704 1127292921 /nfs/dbraw/zinc/29/29/21/1127292921.db2.gz ULLKCBCKUOSJBG-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC1CCC(F)CC1 ZINC000592376629 1127343862 /nfs/dbraw/zinc/34/38/62/1127343862.db2.gz CMURBIKNOWPVTP-UHFFFAOYSA-N 1 0 280.343 3.521 20 5 CHBDRO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCC(C)(C)C1 ZINC000355582364 1127350896 /nfs/dbraw/zinc/35/08/96/1127350896.db2.gz LLNKRPBHJHUDHC-NSHDSACASA-N 1 0 268.382 3.667 20 5 CHBDRO CCC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1cccnc1 ZINC000358327937 1127415738 /nfs/dbraw/zinc/41/57/38/1127415738.db2.gz VDYFFZQQPWKMPG-INIZCTEOSA-N 1 0 299.374 3.929 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCCO1 ZINC000594521282 1127421616 /nfs/dbraw/zinc/42/16/16/1127421616.db2.gz TVYHBQOUYUOKSA-RCBQFDQVSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594503248 1127418828 /nfs/dbraw/zinc/41/88/28/1127418828.db2.gz SVDNQKJPLHIBON-WBMJQRKESA-N 1 0 297.358 3.636 20 5 CHBDRO CCc1cccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594509615 1127420226 /nfs/dbraw/zinc/42/02/26/1127420226.db2.gz XMQOOHMYMCWVEK-KRWDZBQOSA-N 1 0 296.370 3.934 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000594511320 1127420316 /nfs/dbraw/zinc/42/03/16/1127420316.db2.gz FTAKRJOYBMSPTR-UTUOFQBUSA-N 1 0 280.393 3.530 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@]1(C)CC1(F)F ZINC000594976369 1127438127 /nfs/dbraw/zinc/43/81/27/1127438127.db2.gz BGOZHYUJLYOTEL-MUAYPFOZSA-N 1 0 296.317 3.633 20 5 CHBDRO CC1(C)[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000595014088 1127441877 /nfs/dbraw/zinc/44/18/77/1127441877.db2.gz MSVLRFBPWYTQMH-VNHYZAJKSA-N 1 0 274.364 3.509 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)C1CCC(F)CC1 ZINC000594991065 1127444622 /nfs/dbraw/zinc/44/46/22/1127444622.db2.gz YSWAPMIWTASQTI-XGNXJENSSA-N 1 0 280.343 3.601 20 5 CHBDRO CCOC1CCC([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000595029261 1127449388 /nfs/dbraw/zinc/44/93/88/1127449388.db2.gz YEFFKJHPHLMCDH-IYXRBSQSSA-N 1 0 292.379 3.593 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC1(F)CCC1 ZINC000595050011 1127451068 /nfs/dbraw/zinc/45/10/68/1127451068.db2.gz LIDPFWURAMABGT-NSHDSACASA-N 1 0 296.342 3.536 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000595080862 1127453369 /nfs/dbraw/zinc/45/33/69/1127453369.db2.gz OZWPRINGCWGQAT-XHDPSFHLSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000595081159 1127453673 /nfs/dbraw/zinc/45/36/73/1127453673.db2.gz QHKPCSNUKMEWDU-IUODEOHRSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000359224515 1127454735 /nfs/dbraw/zinc/45/47/35/1127454735.db2.gz DYDJSFLCUHZVJE-MNOVXSKESA-N 1 0 289.310 3.541 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CC1=CCCC1)C1CC1 ZINC000595096865 1127455825 /nfs/dbraw/zinc/45/58/25/1127455825.db2.gz NEOIEHJHGYPAOB-MRXNPFEDSA-N 1 0 286.375 3.616 20 5 CHBDRO CC[C@@H](C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])CC(F)F ZINC000595423308 1127462112 /nfs/dbraw/zinc/46/21/12/1127462112.db2.gz NFJHIDPSRXAJST-GHMZBOCLSA-N 1 0 286.322 3.927 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC2(CCC2)CC1 ZINC000595483819 1127462917 /nfs/dbraw/zinc/46/29/17/1127462917.db2.gz MZPQSJMPPLJRDJ-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3CC2(c2ccccc2)C3)cc1 ZINC000595911620 1127479942 /nfs/dbraw/zinc/47/99/42/1127479942.db2.gz QMFZLYPGWBEQMI-UHFFFAOYSA-N 1 0 294.354 3.716 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000595822338 1127476667 /nfs/dbraw/zinc/47/66/67/1127476667.db2.gz RCNRLOYSOTXNIH-LKSINWNRSA-N 1 0 280.343 3.601 20 5 CHBDRO CC(C)(C[NH2+]Cc1csc([N+](=O)[O-])c1)CC(F)(F)F ZINC000596064125 1127481976 /nfs/dbraw/zinc/48/19/76/1127481976.db2.gz SRBRFCYHMKQVFS-UHFFFAOYSA-N 1 0 296.314 3.725 20 5 CHBDRO C[C@H]1CC[C@H](C)[NH+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000360028753 1127486852 /nfs/dbraw/zinc/48/68/52/1127486852.db2.gz XJNHDQXMVKAZBX-UWVGGRQHSA-N 1 0 268.744 3.621 20 5 CHBDRO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294889025 1127606349 /nfs/dbraw/zinc/60/63/49/1127606349.db2.gz VEZHBMKBBYDJJT-LBPRGKRZSA-N 1 0 297.358 3.517 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)c2ccccc2O1 ZINC000295015487 1127614139 /nfs/dbraw/zinc/61/41/39/1127614139.db2.gz JXZJLOYJMJWTNA-MLGOLLRUSA-N 1 0 298.342 3.597 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H]1CC1(F)F ZINC000598648747 1127630668 /nfs/dbraw/zinc/63/06/68/1127630668.db2.gz SAWQREYZOLKUGA-HJTPGIPUSA-N 1 0 296.317 3.633 20 5 CHBDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000598955196 1127647943 /nfs/dbraw/zinc/64/79/43/1127647943.db2.gz JEPMMMLZCACTEE-UHFFFAOYSA-N 1 0 286.322 3.756 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCCC12CC2)c1ccc([N+](=O)[O-])cc1 ZINC000599089806 1127656486 /nfs/dbraw/zinc/65/64/86/1127656486.db2.gz ASZRUPLAYPYRRH-TZMCWYRMSA-N 1 0 274.364 3.826 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000603582124 1127660813 /nfs/dbraw/zinc/66/08/13/1127660813.db2.gz UMHVGIFGUIUMGN-TZMCWYRMSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C2(C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000593717706 1127665060 /nfs/dbraw/zinc/66/50/60/1127665060.db2.gz GWEHTEWDTQKRKQ-GFCCVEGCSA-N 1 0 274.364 3.887 20 5 CHBDRO C[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000296506565 1127673957 /nfs/dbraw/zinc/67/39/57/1127673957.db2.gz PIMLPPGMOZNAEJ-CYBMUJFWSA-N 1 0 299.374 3.618 20 5 CHBDRO C[C@H]([NH2+]CC(C)(C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000296506570 1127673765 /nfs/dbraw/zinc/67/37/65/1127673765.db2.gz PIMLPPGMOZNAEJ-ZDUSSCGKSA-N 1 0 299.374 3.618 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000603836685 1127675109 /nfs/dbraw/zinc/67/51/09/1127675109.db2.gz AKYZTTMVYBCJAE-AWEZNQCLSA-N 1 0 262.353 3.668 20 5 CHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1ccc([N+](=O)[O-])s1 ZINC000604409326 1127703073 /nfs/dbraw/zinc/70/30/73/1127703073.db2.gz ZJPWOZSOIHNDSI-GFCCVEGCSA-N 1 0 297.424 3.723 20 5 CHBDRO CCC(CC)[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000604434793 1127705544 /nfs/dbraw/zinc/70/55/44/1127705544.db2.gz KDZFXPYYRARPGU-UHFFFAOYSA-N 1 0 262.353 3.748 20 5 CHBDRO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539827558 1127944615 /nfs/dbraw/zinc/94/46/15/1127944615.db2.gz IKYAZRWARYTEQS-RISCZKNCSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1=CCCC1 ZINC000595097379 1127954039 /nfs/dbraw/zinc/95/40/39/1127954039.db2.gz UYXGOKXLWFNNIZ-GFCCVEGCSA-N 1 0 260.337 3.664 20 5 CHBDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000540055012 1127959104 /nfs/dbraw/zinc/95/91/04/1127959104.db2.gz AUJZCXUHJYUXAD-BXUZGUMPSA-N 1 0 262.353 3.666 20 5 CHBDRO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000544612066 1127979188 /nfs/dbraw/zinc/97/91/88/1127979188.db2.gz XCLWUGLXMADCNQ-RISCZKNCSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@@]1(C)CC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000468136738 1127994702 /nfs/dbraw/zinc/99/47/02/1127994702.db2.gz AIXQRXXTNGOSSU-HNNXBMFYSA-N 1 0 262.353 3.525 20 5 CHBDRO Cc1noc(C[N@H+]2CC[C@H](C(C)(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC000595497495 1128003074 /nfs/dbraw/zinc/00/30/74/1128003074.db2.gz OOMVEWZUAQBGFU-PWSUYJOCSA-N 1 0 295.383 3.538 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccsc1 ZINC000468635537 1128014415 /nfs/dbraw/zinc/01/44/15/1128014415.db2.gz QKYBBTSMKMWLOR-GHXNOFRVSA-N 1 0 288.372 3.849 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccccc1 ZINC000468635931 1128014645 /nfs/dbraw/zinc/01/46/45/1128014645.db2.gz VIENGEKFRGMDAI-QINSGFPZSA-N 1 0 296.370 3.830 20 5 CHBDRO Cc1cccc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000541388674 1128019910 /nfs/dbraw/zinc/01/99/10/1128019910.db2.gz CMLJBHTZMKEULQ-KRWDZBQOSA-N 1 0 296.370 3.893 20 5 CHBDRO CCC[C@H]([NH2+]C[C@]1(C)CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000094797512 1128058371 /nfs/dbraw/zinc/05/83/71/1128058371.db2.gz YECDNJZWJQUDMG-HOTGVXAUSA-N 1 0 292.379 3.595 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000470182431 1128064844 /nfs/dbraw/zinc/06/48/44/1128064844.db2.gz LFLQSCROYNBAGZ-SOVRZDNNSA-N 1 0 274.364 3.586 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CC(C)C ZINC000470173287 1128065255 /nfs/dbraw/zinc/06/52/55/1128065255.db2.gz AJMIRXTWTXYPOL-JYRVWZFOSA-N 1 0 262.353 3.586 20 5 CHBDRO CC[C@@H]1CC[N@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470182636 1128065409 /nfs/dbraw/zinc/06/54/09/1128065409.db2.gz MHPHNKSZKIWHQU-RNQWEJQRSA-N 1 0 274.364 3.730 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000271941515 1128082020 /nfs/dbraw/zinc/08/20/20/1128082020.db2.gz UGRSRUKOZFMXOK-XEZPLFJOSA-N 1 0 292.379 3.511 20 5 CHBDRO COc1ccc(C[NH2+]C[C@@H]2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000388841126 1128097687 /nfs/dbraw/zinc/09/76/87/1128097687.db2.gz DPPBSTSKUVJYRD-ZDUSSCGKSA-N 1 0 292.379 3.519 20 5 CHBDRO CCOc1cc(C[N@@H+]2[C@H](C)CC[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492603724 1128105995 /nfs/dbraw/zinc/10/59/95/1128105995.db2.gz CGQNTPDDSIPKTK-OCCSQVGLSA-N 1 0 292.379 3.756 20 5 CHBDRO C[C@@H]1CC[C@@H](C)C1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000749925400 1128118200 /nfs/dbraw/zinc/11/82/00/1128118200.db2.gz VAPWJXFEMGROLI-NXEZZACHSA-N 1 0 282.771 3.772 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524283 1128132326 /nfs/dbraw/zinc/13/23/26/1128132326.db2.gz ZNQMZTONZNJEKX-UWVGGRQHSA-N 1 0 270.760 3.772 20 5 CHBDRO CC[C@@H](C[C@](C)(O)CC)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000926834571 1128197269 /nfs/dbraw/zinc/19/72/69/1128197269.db2.gz HBPLJNYLLCKQLZ-DVOMOZLQSA-N 1 0 294.395 3.575 20 5 CHBDRO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000324271702 1128166691 /nfs/dbraw/zinc/16/66/91/1128166691.db2.gz NWGMCUNIMGXZFF-AWEZNQCLSA-N 1 0 282.771 3.772 20 5 CHBDRO CC1CC([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000494464871 1128174434 /nfs/dbraw/zinc/17/44/34/1128174434.db2.gz MDMCURFEKLOVKG-UHFFFAOYSA-N 1 0 288.269 3.502 20 5 CHBDRO CC(C)[NH+](CCSCc1ccccc1[N+](=O)[O-])C(C)C ZINC000762203452 1128280325 /nfs/dbraw/zinc/28/03/25/1128280325.db2.gz CCPBRRGVHITSJR-UHFFFAOYSA-N 1 0 296.436 3.947 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1CF)c1cccc([N+](=O)[O-])c1 ZINC000930208326 1128307290 /nfs/dbraw/zinc/30/72/90/1128307290.db2.gz NCVIWYZPAOINQG-GFCCVEGCSA-N 1 0 288.322 3.915 20 5 CHBDRO CCCc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000609223310 1128331369 /nfs/dbraw/zinc/33/13/69/1128331369.db2.gz FURITHSOKLICNE-UHFFFAOYSA-N 1 0 298.386 3.880 20 5 CHBDRO CC1(C)CCC[C@@H]1C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000388871309 1128336212 /nfs/dbraw/zinc/33/62/12/1128336212.db2.gz INXFTSYAEVDWBS-LLVKDONJSA-N 1 0 268.382 3.572 20 5 CHBDRO C[C@@H]1CC[C@@H](C)[NH+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154218917 1128460130 /nfs/dbraw/zinc/46/01/30/1128460130.db2.gz DYOMXPPFKYKFSU-NXEZZACHSA-N 1 0 268.744 3.621 20 5 CHBDRO C[C@H](F)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000563297199 1128459005 /nfs/dbraw/zinc/45/90/05/1128459005.db2.gz ZEYKKPLWABLIDW-NSHDSACASA-N 1 0 292.310 3.693 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1csc([N+](=O)[O-])c1 ZINC000566701926 1128550017 /nfs/dbraw/zinc/55/00/17/1128550017.db2.gz QGANIVJWJKRINZ-UHFFFAOYSA-N 1 0 256.371 3.667 20 5 CHBDRO Cc1nsc(C)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000567286424 1128561363 /nfs/dbraw/zinc/56/13/63/1128561363.db2.gz KNSXCTHPMLGRIV-VIFPVBQESA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCc2ccccc2C1 ZINC000498921974 1128620841 /nfs/dbraw/zinc/62/08/41/1128620841.db2.gz AGLFAMCWLBMJRY-UHFFFAOYSA-N 1 0 282.343 3.543 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC3(CCCC3)CC2)cc1 ZINC000570974753 1128635249 /nfs/dbraw/zinc/63/52/49/1128635249.db2.gz QSQXUHGPHBGNGY-UHFFFAOYSA-N 1 0 288.391 3.794 20 5 CHBDRO C[C@@H](C[NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000572349569 1128644916 /nfs/dbraw/zinc/64/49/16/1128644916.db2.gz FLXPMHDDFAKTHK-AWEZNQCLSA-N 1 0 284.359 3.531 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000578012740 1128703298 /nfs/dbraw/zinc/70/32/98/1128703298.db2.gz WTJLDCBQLNJBOB-NFAWXSAZSA-N 1 0 280.343 3.916 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)[NH+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609417696 1128714176 /nfs/dbraw/zinc/71/41/76/1128714176.db2.gz ILQYIWABUMYZKQ-ZIAGYGMSSA-N 1 0 292.379 3.627 20 5 CHBDRO CC(C)CC[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705287 1128722544 /nfs/dbraw/zinc/72/25/44/1128722544.db2.gz QYMJQAAFZUGABH-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000609766778 1128724747 /nfs/dbraw/zinc/72/47/47/1128724747.db2.gz PWDOEMJEMXGKRA-ZDUSSCGKSA-N 1 0 262.353 3.607 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609846136 1128728447 /nfs/dbraw/zinc/72/84/47/1128728447.db2.gz DTSJJXCUAUPRRI-XPKDYRNWSA-N 1 0 274.364 3.748 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000609846170 1128728557 /nfs/dbraw/zinc/72/85/57/1128728557.db2.gz NXCFYEYUTALFMI-KGYLQXTDSA-N 1 0 280.393 3.809 20 5 CHBDRO CCC[C@H](C)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000036721079 1117746593 /nfs/dbraw/zinc/74/65/93/1117746593.db2.gz OKIZXDCZWDZXEW-SMDDNHRTSA-N 1 0 250.342 3.824 20 5 CHBDRO CC[C@H](C)C[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000072630850 1117781435 /nfs/dbraw/zinc/78/14/35/1117781435.db2.gz ABDXCMVHHVKULL-RYUDHWBXSA-N 1 0 250.342 3.634 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000610215381 1117882240 /nfs/dbraw/zinc/88/22/40/1117882240.db2.gz JQAJFDHREYJADX-STQMWFEESA-N 1 0 276.380 3.914 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000610215379 1117882756 /nfs/dbraw/zinc/88/27/56/1117882756.db2.gz JQAJFDHREYJADX-OLZOCXBDSA-N 1 0 276.380 3.914 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000336807770 1117938467 /nfs/dbraw/zinc/93/84/67/1117938467.db2.gz ABVUWFXYVBFTEE-GLQYFDAESA-N 1 0 262.353 3.824 20 5 CHBDRO CC1=C[C@H](C)CN(Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000430272078 1117974040 /nfs/dbraw/zinc/97/40/40/1117974040.db2.gz ZOBVCJGMLDAVPL-JTQLQIEISA-N 1 0 280.755 3.646 20 5 CHBDRO CC1=C[C@H](C)C[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000430280757 1117989678 /nfs/dbraw/zinc/98/96/78/1117989678.db2.gz YCORPJFFMDXTRF-WCQYABFASA-N 1 0 260.337 3.554 20 5 CHBDRO CC[N@H+](CCc1ccccn1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000764313244 1118082699 /nfs/dbraw/zinc/08/26/99/1118082699.db2.gz FKDAWPGONQTTPG-CQSZACIVSA-N 1 0 299.374 3.615 20 5 CHBDRO CC1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000229587716 1118128517 /nfs/dbraw/zinc/12/85/17/1118128517.db2.gz ZEKSFBRZGXOEPH-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO CC1(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCC1 ZINC000340288976 1118132191 /nfs/dbraw/zinc/13/21/91/1118132191.db2.gz DSKFLMHHBJRIGA-UHFFFAOYSA-N 1 0 274.364 3.749 20 5 CHBDRO C[C@@H](c1ccccc1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536000683 1118271959 /nfs/dbraw/zinc/27/19/59/1118271959.db2.gz HVBYUIVZNXIOTC-ZDUSSCGKSA-N 1 0 282.343 3.714 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000253060989 1118288784 /nfs/dbraw/zinc/28/87/84/1118288784.db2.gz DPQGGDZLHAZHML-WDEREUQCSA-N 1 0 282.771 3.726 20 5 CHBDRO CCC[C@H](C)C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000579458370 1118379541 /nfs/dbraw/zinc/37/95/41/1118379541.db2.gz FLQMKMZSNOGHIO-ZDUSSCGKSA-N 1 0 264.369 3.505 20 5 CHBDRO CC[C@@H]1CCCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000004612448 1118436977 /nfs/dbraw/zinc/43/69/77/1118436977.db2.gz POPOFVNWGIWNGF-SOIVGHGOSA-N 1 0 274.364 3.873 20 5 CHBDRO C[C@@H](c1ccccc1)N(C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394943965 1118563096 /nfs/dbraw/zinc/56/30/96/1118563096.db2.gz HNSFGQBOUVXDPS-LBPRGKRZSA-N 1 0 288.322 3.927 20 5 CHBDRO Cc1ccccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000038956078 1118611920 /nfs/dbraw/zinc/61/19/20/1118611920.db2.gz QHMZROXSBLJJOC-UHFFFAOYSA-N 1 0 270.332 3.535 20 5 CHBDRO C[NH+](C)C1(CNc2ccc(Cl)cc2[N+](=O)[O-])CCCC1 ZINC000097173639 1118671175 /nfs/dbraw/zinc/67/11/75/1118671175.db2.gz JCDUCCFCHHORQZ-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000610796080 1118872385 /nfs/dbraw/zinc/87/23/85/1118872385.db2.gz DYNVJEWWPMYOMR-VXGBXAGGSA-N 1 0 250.342 3.742 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H](C)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000610831187 1118897346 /nfs/dbraw/zinc/89/73/46/1118897346.db2.gz JLBPUGGAOWQIGW-DYVFJYSZSA-N 1 0 299.374 3.834 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)c1ccncc1 ZINC000610830963 1118898549 /nfs/dbraw/zinc/89/85/49/1118898549.db2.gz PBYZFOIYDOBOCA-UONOGXRCSA-N 1 0 299.374 3.753 20 5 CHBDRO C[C@@H]1C[C@@H](C)C[NH+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000033394650 1118965362 /nfs/dbraw/zinc/96/53/62/1118965362.db2.gz MLIFNSQYMKISJW-KMVAXQJASA-N 1 0 274.364 3.586 20 5 CHBDRO Cc1c(C[N@H+](C)Cc2cccs2)cccc1[N+](=O)[O-] ZINC000051383021 1118989679 /nfs/dbraw/zinc/98/96/79/1118989679.db2.gz MDWZDRUIXNTUKY-UHFFFAOYSA-N 1 0 276.361 3.597 20 5 CHBDRO C[C@@H](c1cccs1)N(C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051501841 1119031873 /nfs/dbraw/zinc/03/18/73/1119031873.db2.gz ANKAUJSOCBOZTF-JTQLQIEISA-N 1 0 294.351 3.988 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000051686149 1119084595 /nfs/dbraw/zinc/08/45/95/1119084595.db2.gz LXZRLEBZHDDOHK-NSHDSACASA-N 1 0 250.342 3.524 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000562066866 1119101285 /nfs/dbraw/zinc/10/12/85/1119101285.db2.gz XZUNCBGQDXPBBG-NHYWBVRUSA-N 1 0 292.379 3.833 20 5 CHBDRO [NH3+]Cc1cccn1-c1nc2ccccc2c2ccccc21 ZINC001167600257 1119155259 /nfs/dbraw/zinc/15/52/59/1119155259.db2.gz NXDSLBQAVTXLJY-UHFFFAOYSA-N 1 0 273.339 3.637 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2C2CC2)c(Cl)c1 ZINC000611780492 1119191606 /nfs/dbraw/zinc/19/16/06/1119191606.db2.gz IGYXWLLTRIMGDF-CQSZACIVSA-N 1 0 280.755 3.623 20 5 CHBDRO CCC[C@@H]([NH2+]C1CC=CC1)c1cccc([N+](=O)[O-])c1 ZINC000122060618 1119292059 /nfs/dbraw/zinc/29/20/59/1119292059.db2.gz KHXZQNKECDLLKT-OAHLLOKOSA-N 1 0 260.337 3.744 20 5 CHBDRO Cc1cc(N[C@@H]2C[N@@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000536021136 1119357339 /nfs/dbraw/zinc/35/73/39/1119357339.db2.gz BBHQKJBIJVHULZ-MRXNPFEDSA-N 1 0 297.358 3.502 20 5 CHBDRO C/C(=C/c1ccccc1)C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000536163254 1119436005 /nfs/dbraw/zinc/43/60/05/1119436005.db2.gz OXCVJYODUNGRER-QINSGFPZSA-N 1 0 296.370 3.830 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCC[C@@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000340521608 1119492723 /nfs/dbraw/zinc/49/27/23/1119492723.db2.gz ARSKLKJTAZNXCQ-KKUMJFAQSA-N 1 0 280.343 3.916 20 5 CHBDRO CC[C@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000102419436 1119664017 /nfs/dbraw/zinc/66/40/17/1119664017.db2.gz NJOKKHMAKDTNDO-NSHDSACASA-N 1 0 274.320 3.743 20 5 CHBDRO Cc1ncccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000179320594 1119710099 /nfs/dbraw/zinc/71/00/99/1119710099.db2.gz ZWJLCALLODQCDH-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO CC(C)(C)[C@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000612177725 1119744379 /nfs/dbraw/zinc/74/43/79/1119744379.db2.gz WOECVAQDCSOWES-NSHDSACASA-N 1 0 280.343 3.602 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(C)CCC(F)(F)CC1 ZINC000612582136 1119801512 /nfs/dbraw/zinc/80/15/12/1119801512.db2.gz YAFROTXXYGQXNZ-UHFFFAOYSA-N 1 0 298.333 3.961 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)cc1[N+](=O)[O-] ZINC000414213377 1119942132 /nfs/dbraw/zinc/94/21/32/1119942132.db2.gz QZAOTOJYNAISNL-RZFFKMDDSA-N 1 0 274.364 3.742 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC[C@@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000180260420 1119964512 /nfs/dbraw/zinc/96/45/12/1119964512.db2.gz KNSXTKUCTLYNTF-KGLIPLIRSA-N 1 0 292.379 3.513 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@@H]12 ZINC000541111791 1120147549 /nfs/dbraw/zinc/14/75/49/1120147549.db2.gz SLLAIUKFRXSVJR-KCXAZCMYSA-N 1 0 274.364 3.605 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000123164130 1120171059 /nfs/dbraw/zinc/17/10/59/1120171059.db2.gz CXFGSGZTGXVRAI-CABCVRRESA-N 1 0 298.386 3.919 20 5 CHBDRO Cc1cc(N2CC[C@@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543048490 1120389105 /nfs/dbraw/zinc/38/91/05/1120389105.db2.gz OZWBFFYPIZKSNO-CYBMUJFWSA-N 1 0 297.358 3.688 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cccnc1)CCCC2 ZINC000417305671 1120422447 /nfs/dbraw/zinc/42/24/47/1120422447.db2.gz WZNZMVVCOIEUPW-KRWDZBQOSA-N 1 0 297.358 3.547 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000692682392 1120437724 /nfs/dbraw/zinc/43/77/24/1120437724.db2.gz YBBBTAWZGOKHIZ-JTQLQIEISA-N 1 0 294.351 3.955 20 5 CHBDRO CCOC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000315194865 1120451513 /nfs/dbraw/zinc/45/15/13/1120451513.db2.gz LGQMJTDXLKYBBM-CYBMUJFWSA-N 1 0 292.379 3.595 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+][C@@H]1CCOC1 ZINC000181992480 1128917704 /nfs/dbraw/zinc/91/77/04/1128917704.db2.gz LGTOSWNJEIGWRO-MRXNPFEDSA-N 1 0 277.367 3.872 20 5 CHBDRO CC[C@@H]1CCC[C@@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000068592700 1120479448 /nfs/dbraw/zinc/47/94/48/1120479448.db2.gz KPSYZCCMFUONGN-ZIAGYGMSSA-N 1 0 292.379 3.532 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CCC1 ZINC000618572283 1128919218 /nfs/dbraw/zinc/91/92/18/1128919218.db2.gz GZQVJVYMUQCZMJ-BZNIZROVSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000618567144 1128919552 /nfs/dbraw/zinc/91/95/52/1128919552.db2.gz ZBERBSMEWSANEA-BDJLRTHQSA-N 1 0 274.364 3.608 20 5 CHBDRO C[C@H](c1cccs1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000053428449 1120497437 /nfs/dbraw/zinc/49/74/37/1120497437.db2.gz CLWIUNZMVOCVIC-LLVKDONJSA-N 1 0 276.361 3.849 20 5 CHBDRO C[C@H](c1cccs1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000053428465 1120497717 /nfs/dbraw/zinc/49/77/17/1120497717.db2.gz IYFGTEMPODXBFK-LLVKDONJSA-N 1 0 276.361 3.849 20 5 CHBDRO C[C@]1(c2ccccc2)CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532293346 1120499245 /nfs/dbraw/zinc/49/92/45/1120499245.db2.gz UWIDGHRFABLGNF-SFHVURJKSA-N 1 0 296.370 3.758 20 5 CHBDRO Cc1c(C[NH2+][C@H](c2ccccn2)C2CC2)cccc1[N+](=O)[O-] ZINC000922582764 1120555450 /nfs/dbraw/zinc/55/54/50/1120555450.db2.gz RRSCCPNAKBVZQY-KRWDZBQOSA-N 1 0 297.358 3.539 20 5 CHBDRO COCC[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000508996256 1120580940 /nfs/dbraw/zinc/58/09/40/1120580940.db2.gz FQMSQTPGUVJFLN-IUODEOHRSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCS[C@@H](C)C1 ZINC000922833410 1120606675 /nfs/dbraw/zinc/60/66/75/1120606675.db2.gz GQVMSCHVBLXWCB-WCQYABFASA-N 1 0 294.420 3.585 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)c1 ZINC000282094272 1120629735 /nfs/dbraw/zinc/62/97/35/1120629735.db2.gz SAXMPFDZLBBVPU-LBPRGKRZSA-N 1 0 284.306 3.510 20 5 CHBDRO Cc1cc(N2C[C@@H]3CCC[C@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302107832 1120648052 /nfs/dbraw/zinc/64/80/52/1120648052.db2.gz YFIVIYKWPYGDRI-STQMWFEESA-N 1 0 297.358 3.688 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000313457386 1120730250 /nfs/dbraw/zinc/73/02/50/1120730250.db2.gz CNYTULXQNDTNGV-JQWIXIFHSA-N 1 0 284.306 3.742 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCS[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000313502735 1120739252 /nfs/dbraw/zinc/73/92/52/1120739252.db2.gz JGCITYDAXMIDAQ-DFBGVHRSSA-N 1 0 294.420 3.920 20 5 CHBDRO COc1ccc(C[N@H+](C(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000108365474 1120748393 /nfs/dbraw/zinc/74/83/93/1120748393.db2.gz MLMMWPAMHKWXLG-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO C[N@H+](CCNc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000109406860 1120779417 /nfs/dbraw/zinc/77/94/17/1120779417.db2.gz JDCKMJQYYUUDLL-UHFFFAOYSA-N 1 0 297.786 3.535 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000048068648 1120800490 /nfs/dbraw/zinc/80/04/90/1120800490.db2.gz ANJJLPSPQMCYQE-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000511911043 1120844818 /nfs/dbraw/zinc/84/48/18/1120844818.db2.gz ODMHXBHJYORKLP-LBPRGKRZSA-N 1 0 286.331 3.697 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)Cc2ccsc2)cccc1[N+](=O)[O-] ZINC000049181930 1120852699 /nfs/dbraw/zinc/85/26/99/1120852699.db2.gz DYDJTPCNKAPQDQ-NSHDSACASA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCCOCC(C)C)cccc1[N+](=O)[O-] ZINC000163295595 1120901294 /nfs/dbraw/zinc/90/12/94/1120901294.db2.gz DMNVZMJMPOTIIK-AWEZNQCLSA-N 1 0 294.395 3.617 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000300404386 1120915636 /nfs/dbraw/zinc/91/56/36/1120915636.db2.gz QNDNBXCGNJERNT-SCDSUCTJSA-N 1 0 280.393 3.530 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H]1CC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000222055362 1120966177 /nfs/dbraw/zinc/96/61/77/1120966177.db2.gz GXYGJKUMRNVODP-TZMCWYRMSA-N 1 0 262.353 3.682 20 5 CHBDRO CCc1ccccc1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000584665530 1120971028 /nfs/dbraw/zinc/97/10/28/1120971028.db2.gz PRNIDHXJYIPKTN-KRWDZBQOSA-N 1 0 296.370 3.934 20 5 CHBDRO CC(C)[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541999807 1121013091 /nfs/dbraw/zinc/01/30/91/1121013091.db2.gz ATYAABMWIOZASY-JTQLQIEISA-N 1 0 270.760 3.725 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C(C)(C)c1ccccc1 ZINC000585754594 1121030788 /nfs/dbraw/zinc/03/07/88/1121030788.db2.gz RMELDYPDKPEEJE-UHFFFAOYSA-N 1 0 284.359 3.962 20 5 CHBDRO CCCCC[N@H+](Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000059385020 1121062240 /nfs/dbraw/zinc/06/22/40/1121062240.db2.gz ZLBOUKKJPLZSJH-UHFFFAOYSA-N 1 0 264.369 3.995 20 5 CHBDRO Nc1c[nH+]cn1-c1cc2ccccc2c2ccccc21 ZINC001175111551 1121170117 /nfs/dbraw/zinc/17/01/17/1121170117.db2.gz BPIUTYCBMOZQKA-UHFFFAOYSA-N 1 0 259.312 3.761 20 5 CHBDRO Cc1cccc2c1C[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000429583205 1121341320 /nfs/dbraw/zinc/34/13/20/1121341320.db2.gz ABWYLXPCQNRIFA-UHFFFAOYSA-N 1 0 296.370 3.504 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCSC2)cc1[N+](=O)[O-] ZINC000704771538 1121368578 /nfs/dbraw/zinc/36/85/78/1121368578.db2.gz MTIVPAPWYGPPKW-STQMWFEESA-N 1 0 294.420 3.697 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCC2)C[C@H]1C ZINC000432814561 1121379010 /nfs/dbraw/zinc/37/90/10/1121379010.db2.gz AUVUOYHLPDVQGE-CYBMUJFWSA-N 1 0 274.364 3.668 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)C(C)C ZINC000706418028 1121428890 /nfs/dbraw/zinc/42/88/90/1121428890.db2.gz DZPJOOZBOSXJKZ-NSHDSACASA-N 1 0 268.332 3.600 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)C1(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000706956638 1121446358 /nfs/dbraw/zinc/44/63/58/1121446358.db2.gz LZPQLZGAEXGROA-BXUZGUMPSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C(C)C ZINC000509388878 1121565325 /nfs/dbraw/zinc/56/53/25/1121565325.db2.gz SINNEDCIQVTCQN-CLFYSBASSA-N 1 0 276.380 3.974 20 5 CHBDRO Cc1ccoc1C[N@@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000429409177 1121567024 /nfs/dbraw/zinc/56/70/24/1121567024.db2.gz QYRZACOKYKCVKW-ZDUSSCGKSA-N 1 0 288.347 3.998 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CC23CCCC3)cccc1[N+](=O)[O-] ZINC000429433676 1121578425 /nfs/dbraw/zinc/57/84/25/1121578425.db2.gz WEJWWUDXRYSRGR-WFASDCNBSA-N 1 0 274.364 3.887 20 5 CHBDRO CCN(Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000047264395 1121618301 /nfs/dbraw/zinc/61/83/01/1121618301.db2.gz LVCQBCDGZJCRDD-UHFFFAOYSA-N 1 0 276.361 3.678 20 5 CHBDRO CC(C)C([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000611336902 1121637967 /nfs/dbraw/zinc/63/79/67/1121637967.db2.gz DCXCGELTJUYRPP-LBPRGKRZSA-N 1 0 264.369 3.926 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC1CC1 ZINC000611336528 1121638146 /nfs/dbraw/zinc/63/81/46/1121638146.db2.gz WAJBCEDDQQTDMA-CYBMUJFWSA-N 1 0 294.420 3.855 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCCCO1 ZINC000611477471 1121651490 /nfs/dbraw/zinc/65/14/90/1121651490.db2.gz QGUYONXMLLYDIE-HEHGZKQESA-N 1 0 292.379 3.511 20 5 CHBDRO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CCc2ccccc21 ZINC000611549756 1121655572 /nfs/dbraw/zinc/65/55/72/1121655572.db2.gz RXGZPHFRTLZJGI-MRXNPFEDSA-N 1 0 296.370 3.757 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)CCC2CC2)cc1[N+](=O)[O-] ZINC000398193331 1121713430 /nfs/dbraw/zinc/71/34/30/1121713430.db2.gz BJGSCGZDYDCWKO-GFCCVEGCSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000182627437 1121815979 /nfs/dbraw/zinc/81/59/79/1121815979.db2.gz YCIUGFOQFYADAR-ZDUSSCGKSA-N 1 0 288.347 3.998 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC001179768167 1121906169 /nfs/dbraw/zinc/90/61/69/1121906169.db2.gz LPIZNFUFHRIFBC-CLFJRNRBSA-N 1 0 286.375 3.776 20 5 CHBDRO COC(C)(C)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000345724120 1121910967 /nfs/dbraw/zinc/91/09/67/1121910967.db2.gz OVAYSUSNUGZFEF-UHFFFAOYSA-N 1 0 294.395 3.620 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180261872 1121970193 /nfs/dbraw/zinc/97/01/93/1121970193.db2.gz CBWTYKFGXPJLBK-LLVKDONJSA-N 1 0 264.369 3.690 20 5 CHBDRO CCC(CC)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000168127650 1121993533 /nfs/dbraw/zinc/99/35/33/1121993533.db2.gz MOZJYTIGRIXPFA-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000501787996 1122007485 /nfs/dbraw/zinc/00/74/85/1122007485.db2.gz BWMXTCVJPCFJPS-AGIUHOORSA-N 1 0 262.353 3.634 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C1(C)CC1 ZINC000774282304 1122153489 /nfs/dbraw/zinc/15/34/89/1122153489.db2.gz DBUQJLIWPULVSK-IAQYHMDHSA-N 1 0 274.364 3.750 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](C2CC2)C2CCCCC2)c1 ZINC000047903720 1122167296 /nfs/dbraw/zinc/16/72/96/1122167296.db2.gz WAZUGSJVGWCJHJ-UHFFFAOYSA-N 1 0 274.364 3.892 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000505605132 1122434932 /nfs/dbraw/zinc/43/49/32/1122434932.db2.gz GDCZOMLDKNLAKD-DAXSKMNVSA-N 1 0 288.372 3.802 20 5 CHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505629602 1122443085 /nfs/dbraw/zinc/44/30/85/1122443085.db2.gz BGZQURSKWCLZKL-SMDDNHRTSA-N 1 0 280.343 3.744 20 5 CHBDRO CCC(CC)C[N@H+](CC)Cc1csc([N+](=O)[O-])c1 ZINC000515781038 1122538689 /nfs/dbraw/zinc/53/86/89/1122538689.db2.gz JEBNDVICWQEJHM-UHFFFAOYSA-N 1 0 270.398 3.914 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)CCC[C@@H]1C ZINC001191070303 1122568349 /nfs/dbraw/zinc/56/83/49/1122568349.db2.gz KCQGVHJGDCZCOV-STQMWFEESA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000601289568 1122616624 /nfs/dbraw/zinc/61/66/24/1122616624.db2.gz PBIVQAXKBWZEGM-RISCZKNCSA-N 1 0 260.337 3.578 20 5 CHBDRO CC(C)C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC001192198577 1122632082 /nfs/dbraw/zinc/63/20/82/1122632082.db2.gz LFDKOCBJIKHOHQ-CYBMUJFWSA-N 1 0 294.370 3.992 20 5 CHBDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000438479336 1122702673 /nfs/dbraw/zinc/70/26/73/1122702673.db2.gz BVDWHKGJBIWPNN-LBPRGKRZSA-N 1 0 290.285 3.661 20 5 CHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1(C)CCCC1 ZINC000426496173 1122805842 /nfs/dbraw/zinc/80/58/42/1122805842.db2.gz JIHHUDNGXPKLMZ-VQHVLOKHSA-N 1 0 274.364 3.873 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000775617590 1122818046 /nfs/dbraw/zinc/81/80/46/1122818046.db2.gz ISBWJOBKQUIEBA-GHMZBOCLSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](C3CCC3)C2)c(F)c1 ZINC001196253850 1122912815 /nfs/dbraw/zinc/91/28/15/1122912815.db2.gz HZFSBRDHRLEYQD-ZDUSSCGKSA-N 1 0 292.354 3.746 20 5 CHBDRO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC000507146699 1122929367 /nfs/dbraw/zinc/92/93/67/1122929367.db2.gz WZPOLTKWBTVEET-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000507166139 1122932812 /nfs/dbraw/zinc/93/28/12/1122932812.db2.gz CYEXJMQMZOSDSO-AWEZNQCLSA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1ccccc1[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000507182057 1122935230 /nfs/dbraw/zinc/93/52/30/1122935230.db2.gz PCRCTOJLEZHZGU-MRXNPFEDSA-N 1 0 296.370 3.893 20 5 CHBDRO CCCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000507243287 1122943815 /nfs/dbraw/zinc/94/38/15/1122943815.db2.gz LDTDITTXIWMOCT-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO O=[N+]([O-])c1cc(O)cc(Nc2cc[nH+]c(C3CCC3)c2)c1 ZINC001199828159 1123043915 /nfs/dbraw/zinc/04/39/15/1123043915.db2.gz BKLOECPFUCJXRP-UHFFFAOYSA-N 1 0 285.303 3.707 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000049119599 1123110593 /nfs/dbraw/zinc/11/05/93/1123110593.db2.gz COWRLAULRHFUEZ-FZMZJTMJSA-N 1 0 280.343 3.792 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000049119602 1123110627 /nfs/dbraw/zinc/11/06/27/1123110627.db2.gz COWRLAULRHFUEZ-BXUZGUMPSA-N 1 0 280.343 3.792 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCOC1CCCC1 ZINC000163260079 1129116367 /nfs/dbraw/zinc/11/63/67/1129116367.db2.gz KDKMAALIMDKDGD-ZDUSSCGKSA-N 1 0 292.379 3.513 20 5 CHBDRO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCC1CC1 ZINC000544940783 1123506651 /nfs/dbraw/zinc/50/66/51/1123506651.db2.gz UAPYKTQHRZWBPE-ALCCZGGFSA-N 1 0 274.364 3.730 20 5 CHBDRO CC[NH+](CC)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000149904728 1123508492 /nfs/dbraw/zinc/50/84/92/1123508492.db2.gz JJDDMOGRELZVGH-UHFFFAOYSA-N 1 0 274.320 3.697 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000281957424 1123758366 /nfs/dbraw/zinc/75/83/66/1123758366.db2.gz MQKRKGSCNMURER-UHFFFAOYSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(F)c1 ZINC000865787840 1124014260 /nfs/dbraw/zinc/01/42/60/1124014260.db2.gz TZYOCCUDHXUXRY-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2ncccc21)c1ccc([N+](=O)[O-])cc1 ZINC000866363139 1124057301 /nfs/dbraw/zinc/05/73/01/1124057301.db2.gz JQNYPPLNLDOWKN-SJCJKPOMSA-N 1 0 297.358 3.718 20 5 CHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1(C2CCC2)CC1 ZINC000866384405 1124059915 /nfs/dbraw/zinc/05/99/15/1124059915.db2.gz YGKHDOMRPUXQOT-NSHDSACASA-N 1 0 292.354 3.587 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)CCC(F)(F)F)cc1[N+](=O)[O-] ZINC000866540364 1124080048 /nfs/dbraw/zinc/08/00/48/1124080048.db2.gz MSCGWKQIWREHFJ-SNVBAGLBSA-N 1 0 290.285 3.724 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)n1 ZINC000866541089 1124080537 /nfs/dbraw/zinc/08/05/37/1124080537.db2.gz VZJRHKBSJVCELC-ZDUSSCGKSA-N 1 0 299.374 3.766 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1cccnc1 ZINC000866539989 1124080575 /nfs/dbraw/zinc/08/05/75/1124080575.db2.gz IVSKYBJMAGVLCF-MRXNPFEDSA-N 1 0 299.374 3.929 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CC(c3ccccc3)C2)cc1 ZINC000037668383 1129165377 /nfs/dbraw/zinc/16/53/77/1129165377.db2.gz BFEQDUPCCNUQRP-UHFFFAOYSA-N 1 0 282.343 3.631 20 5 CHBDRO CCCCC[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000034995161 1124110157 /nfs/dbraw/zinc/11/01/57/1124110157.db2.gz WFZUGYGDCONDRD-CYBMUJFWSA-N 1 0 264.369 3.962 20 5 CHBDRO C[C@H](c1cccs1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000121648996 1124111250 /nfs/dbraw/zinc/11/12/50/1124111250.db2.gz FEVBBOBANLQCBI-GFCCVEGCSA-N 1 0 290.388 3.892 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccccc1C1CC1 ZINC000094357716 1124119994 /nfs/dbraw/zinc/11/99/94/1124119994.db2.gz IFMPYWQQXMKPQT-UHFFFAOYSA-N 1 0 282.343 3.762 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)c1ccccc1 ZINC000449065416 1124640901 /nfs/dbraw/zinc/64/09/01/1124640901.db2.gz UHXKQCVLIVHNIE-LSDHHAIUSA-N 1 0 298.386 3.919 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccs1)c1c(F)cccc1[N+](=O)[O-] ZINC000872019048 1124657864 /nfs/dbraw/zinc/65/78/64/1124657864.db2.gz SSNCIDRRFKJODK-SNVBAGLBSA-N 1 0 294.351 3.689 20 5 CHBDRO C[C@H]([NH2+]CCc1cccs1)c1c(F)cccc1[N+](=O)[O-] ZINC000872019047 1124657986 /nfs/dbraw/zinc/65/79/86/1124657986.db2.gz SSNCIDRRFKJODK-JTQLQIEISA-N 1 0 294.351 3.689 20 5 CHBDRO C[C@@H]([NH2+]C[C@]1(C)CCCS1)c1c(F)cccc1[N+](=O)[O-] ZINC000872042907 1124664733 /nfs/dbraw/zinc/66/47/33/1124664733.db2.gz FHJCUDDFQKDAES-YGRLFVJLSA-N 1 0 298.383 3.670 20 5 CHBDRO CC[C@@H](CCC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000872047781 1124665432 /nfs/dbraw/zinc/66/54/32/1124665432.db2.gz VKOXPZUYVMUGFU-NSHDSACASA-N 1 0 290.285 3.806 20 5 CHBDRO C[C@H]([NH2+]CCC1(F)CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872071319 1124674472 /nfs/dbraw/zinc/67/44/72/1124674472.db2.gz NLZXWRVWRNOITF-JTQLQIEISA-N 1 0 284.306 3.667 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCCSC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872071923 1124674524 /nfs/dbraw/zinc/67/45/24/1124674524.db2.gz ZYEPXJPTWPXTIH-WDEREUQCSA-N 1 0 298.383 3.528 20 5 CHBDRO CC(C)C1([NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872074291 1124675032 /nfs/dbraw/zinc/67/50/32/1124675032.db2.gz WGFSZVLPZKVZMP-SNVBAGLBSA-N 1 0 266.316 3.573 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1C=CCC1 ZINC000872086157 1124679235 /nfs/dbraw/zinc/67/92/35/1124679235.db2.gz UKDBUQLPUJNJOJ-MNOVXSKESA-N 1 0 278.377 3.686 20 5 CHBDRO C[C@H]([NH2+]CCCc1ccco1)c1c(F)cccc1[N+](=O)[O-] ZINC000872089503 1124680519 /nfs/dbraw/zinc/68/05/19/1124680519.db2.gz YULCZLTUFWNJGT-NSHDSACASA-N 1 0 292.310 3.610 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC12CC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872091232 1124681221 /nfs/dbraw/zinc/68/12/21/1124681221.db2.gz HGMUTYOGWXZOOB-GWCFXTLKSA-N 1 0 278.327 3.717 20 5 CHBDRO COC1(C[C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000449350877 1124698130 /nfs/dbraw/zinc/69/81/30/1124698130.db2.gz XMZQPLYMCLUMAU-STQMWFEESA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000449706633 1124844516 /nfs/dbraw/zinc/84/45/16/1124844516.db2.gz NXZXZQLBHLLVSW-AGEOTTOMSA-N 1 0 274.364 3.776 20 5 CHBDRO C[C@H](NCc1scnc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000878659398 1125170970 /nfs/dbraw/zinc/17/09/70/1125170970.db2.gz CSYJPHZYSKKCLC-QMMMGPOBSA-N 1 0 297.767 3.556 20 5 CHBDRO Cc1cncc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000879749065 1125229109 /nfs/dbraw/zinc/22/91/09/1125229109.db2.gz STTFSRGMALDIRG-QGZVFWFLSA-N 1 0 297.358 3.635 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532326839 1125249107 /nfs/dbraw/zinc/24/91/07/1125249107.db2.gz LMIVVCIVXBYBJG-CYBMUJFWSA-N 1 0 262.353 3.607 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001168146849 1125263528 /nfs/dbraw/zinc/26/35/28/1125263528.db2.gz SUSDHCPLOGGVLN-AWEZNQCLSA-N 1 0 276.380 3.853 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccccc1 ZINC000532442403 1125386567 /nfs/dbraw/zinc/38/65/67/1125386567.db2.gz HEHHKPLASLQFKH-HNNXBMFYSA-N 1 0 298.386 3.748 20 5 CHBDRO CC(C)(C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])CC(F)F ZINC000883259905 1125387203 /nfs/dbraw/zinc/38/72/03/1125387203.db2.gz DJTSKVIFDSBIPV-GFCCVEGCSA-N 1 0 298.333 3.853 20 5 CHBDRO Cc1c(C[NH2+]CCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000037719575 1129210142 /nfs/dbraw/zinc/21/01/42/1129210142.db2.gz SKAFIMNXFSURGM-UHFFFAOYSA-N 1 0 284.359 3.626 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000766227556 1129387591 /nfs/dbraw/zinc/38/75/91/1129387591.db2.gz YHRQGTRJGCHCGJ-FRRDWIJNSA-N 1 0 294.420 3.838 20 5 CHBDRO O=[N+]([O-])c1cc2c(cc1NCCC1=CCCCC1)C[NH2+]C2 ZINC001168772220 1129425607 /nfs/dbraw/zinc/42/56/07/1129425607.db2.gz QCPOFNLHEDWASE-UHFFFAOYSA-N 1 0 287.363 3.500 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774662 1129451630 /nfs/dbraw/zinc/45/16/30/1129451630.db2.gz NQHNAHCIITZFIK-FZMZJTMJSA-N 1 0 280.343 3.744 20 5 CHBDRO CC(C)[C@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303648516 1129550413 /nfs/dbraw/zinc/55/04/13/1129550413.db2.gz DDMZQFAAAGQWOE-MRXNPFEDSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(C)o1 ZINC000746046626 1129623436 /nfs/dbraw/zinc/62/34/36/1129623436.db2.gz CIBDUBWZEYSRJA-LLVKDONJSA-N 1 0 274.320 3.655 20 5 CHBDRO Cc1cccc(F)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000746048636 1129623506 /nfs/dbraw/zinc/62/35/06/1129623506.db2.gz CXKQCHJWPMDSOD-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2)C2CCC2)C1 ZINC001168977364 1129686367 /nfs/dbraw/zinc/68/63/67/1129686367.db2.gz AYRARSQEDPVENB-XOKHGSTOSA-N 1 0 288.391 3.563 20 5 CHBDRO CC(C)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1Cl ZINC001168984286 1129686902 /nfs/dbraw/zinc/68/69/02/1129686902.db2.gz LRKHAOFMMNDMTH-NEPJUHHUSA-N 1 0 296.798 3.610 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc2ccccc21 ZINC001168964774 1129687610 /nfs/dbraw/zinc/68/76/10/1129687610.db2.gz WBQAWSPSNPLKAM-IIAWOOMASA-N 1 0 298.386 3.936 20 5 CHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]C2CCC3(CCCC3)CC2)C1 ZINC001168965136 1129687853 /nfs/dbraw/zinc/68/78/53/1129687853.db2.gz YHPJFDIDECJTJK-ZFWWWQNUSA-N 1 0 280.412 3.524 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(C)c1C ZINC001169001628 1129688967 /nfs/dbraw/zinc/68/89/67/1129688967.db2.gz HCJIVHDSVOLKQC-BFYDXBDKSA-N 1 0 290.407 3.790 20 5 CHBDRO CC(C)(C)[N@H+](Cc1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169005753 1129689433 /nfs/dbraw/zinc/68/94/33/1129689433.db2.gz CSMCRMXTEJMECB-HOTGVXAUSA-N 1 0 290.407 3.733 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(C)c1C ZINC001169001629 1129689480 /nfs/dbraw/zinc/68/94/80/1129689480.db2.gz HCJIVHDSVOLKQC-HLLBOEOZSA-N 1 0 290.407 3.790 20 5 CHBDRO CC[N@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169039776 1129690757 /nfs/dbraw/zinc/69/07/57/1129690757.db2.gz TWABAGUDJOHTAM-DZGCQCFKSA-N 1 0 296.798 3.607 20 5 CHBDRO CC[N@H+](Cc1cccc(Cl)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169042786 1129690827 /nfs/dbraw/zinc/69/08/27/1129690827.db2.gz FSCBNWDRFPANNW-HIFRSBDPSA-N 1 0 296.798 3.607 20 5 CHBDRO CC[N@H+](Cc1ccc(C)c(C)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169050089 1129691789 /nfs/dbraw/zinc/69/17/89/1129691789.db2.gz YLRCWSAUWKJNFP-IRXDYDNUSA-N 1 0 290.407 3.571 20 5 CHBDRO CC[C@H]1CCC[C@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC001169271691 1129713554 /nfs/dbraw/zinc/71/35/54/1129713554.db2.gz OIADYTQTFQSVRA-XJKSGUPXSA-N 1 0 292.379 3.532 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CC[C@H]2C2CCC2)c1 ZINC000800973743 1129901066 /nfs/dbraw/zinc/90/10/66/1129901066.db2.gz SSNIJOGUQFHXSG-ZFWWWQNUSA-N 1 0 294.782 3.917 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](C2CC2)C2CCCC2)cc1F ZINC000801516323 1129923482 /nfs/dbraw/zinc/92/34/82/1129923482.db2.gz BXSMHYAQXOHAJZ-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801517200 1129923802 /nfs/dbraw/zinc/92/38/02/1129923802.db2.gz BHFVYVKSCQFPDI-VXGBXAGGSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)C1 ZINC000801540137 1129925837 /nfs/dbraw/zinc/92/58/37/1129925837.db2.gz UWVMJOSMZRRAES-BLLLJJGKSA-N 1 0 292.354 3.746 20 5 CHBDRO C[N@H+](CCSC(C)(C)C)CCc1cccc([N+](=O)[O-])c1 ZINC000801955400 1129963493 /nfs/dbraw/zinc/96/34/93/1129963493.db2.gz SCWVATXSNDNHMK-UHFFFAOYSA-N 1 0 296.436 3.601 20 5 CHBDRO CCO[C@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000902999367 1130098065 /nfs/dbraw/zinc/09/80/65/1130098065.db2.gz BLSLTKNGWPRANH-NOLJZWGESA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1ccco1)c1ccccc1[N+](=O)[O-] ZINC000903245726 1130135902 /nfs/dbraw/zinc/13/59/02/1130135902.db2.gz OOEVCBVRLPTCCB-NEPJUHHUSA-N 1 0 274.320 3.642 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1cncs1)c1ccccc1[N+](=O)[O-] ZINC000903244973 1130136000 /nfs/dbraw/zinc/13/60/00/1130136000.db2.gz HFTOESBHJFADTR-QWRGUYRKSA-N 1 0 291.376 3.506 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1C1CC1 ZINC000746667098 1130144043 /nfs/dbraw/zinc/14/40/43/1130144043.db2.gz VOJOANQTTLLEFU-ZDUSSCGKSA-N 1 0 280.755 3.623 20 5 CHBDRO C[C@H](CCC(F)(F)F)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000903286888 1130146621 /nfs/dbraw/zinc/14/66/21/1130146621.db2.gz ISXIVUIAKXRSIW-NXEZZACHSA-N 1 0 290.285 3.976 20 5 CHBDRO CCOC1CCC([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000903286862 1130146926 /nfs/dbraw/zinc/14/69/26/1130146926.db2.gz IFPXVJRLQCDXJY-XEBKBJJBSA-N 1 0 292.379 3.593 20 5 CHBDRO CCc1cccnc1[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000903288342 1130146945 /nfs/dbraw/zinc/14/69/45/1130146945.db2.gz YGOUDNUYGWCVDU-OLZOCXBDSA-N 1 0 299.374 3.964 20 5 CHBDRO CO[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000903286808 1130146990 /nfs/dbraw/zinc/14/69/90/1130146990.db2.gz HCHPRUNKFNAXJQ-XNRPHZJLSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+]CCCC(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788669420 1130202331 /nfs/dbraw/zinc/20/23/31/1130202331.db2.gz ZTLKCVJJSXANPA-NSHDSACASA-N 1 0 279.384 3.654 20 5 CHBDRO CCCC[N@H+](CC)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329556 1130483312 /nfs/dbraw/zinc/48/33/12/1130483312.db2.gz RIQSEGHULUTKSJ-CYBMUJFWSA-N 1 0 294.395 3.656 20 5 CHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC1CC1 ZINC000783533287 1130834907 /nfs/dbraw/zinc/83/49/07/1130834907.db2.gz WRBBMIWRKSFKHD-UHFFFAOYSA-N 1 0 282.771 3.869 20 5 CHBDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678026 1130846453 /nfs/dbraw/zinc/84/64/53/1130846453.db2.gz BCZSWMOMLCIVPU-GWCFXTLKSA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000217235698 1130923122 /nfs/dbraw/zinc/92/31/22/1130923122.db2.gz RKFZUTYUIVUFST-JMSVASOKSA-N 1 0 292.354 3.887 20 5 CHBDRO CC(C)[C@@H]1CC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000796837515 1130937798 /nfs/dbraw/zinc/93/77/98/1130937798.db2.gz DFBDGDMSTVNOJY-JSGCOSHPSA-N 1 0 282.771 3.772 20 5 CHBDRO CC(C)[C@H]1CC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000796837517 1130938097 /nfs/dbraw/zinc/93/80/97/1130938097.db2.gz DFBDGDMSTVNOJY-OCCSQVGLSA-N 1 0 282.771 3.772 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(C)c1 ZINC000815561323 1130999613 /nfs/dbraw/zinc/99/96/13/1130999613.db2.gz DMCSCSLCWUAVFX-CYBMUJFWSA-N 1 0 299.374 3.645 20 5 CHBDRO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815579459 1131003014 /nfs/dbraw/zinc/00/30/14/1131003014.db2.gz NHMVGTKILXGILC-OQHXTRMZSA-N 1 0 297.358 3.541 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000799193236 1131075218 /nfs/dbraw/zinc/07/52/18/1131075218.db2.gz MFESSYTUKCUMPJ-KBPBESRZSA-N 1 0 297.358 3.540 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2C[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000816646777 1131119675 /nfs/dbraw/zinc/11/96/75/1131119675.db2.gz IYCGQDQGAPHAPP-RYUDHWBXSA-N 1 0 262.353 3.558 20 5 CHBDRO CC(F)(F)CCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000824477529 1131470839 /nfs/dbraw/zinc/47/08/39/1131470839.db2.gz UTUKSTJFQZMGMT-UHFFFAOYSA-N 1 0 292.713 3.773 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437066 1131563442 /nfs/dbraw/zinc/56/34/42/1131563442.db2.gz SCJROEOKMWIUEV-FZMZJTMJSA-N 1 0 296.317 3.777 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H](C2CCCC2)C1 ZINC001171331664 1131853667 /nfs/dbraw/zinc/85/36/67/1131853667.db2.gz KIHFFURCNOWPDL-CQSZACIVSA-N 1 0 274.364 3.607 20 5 CHBDRO CC1(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCC1 ZINC001172899624 1132348282 /nfs/dbraw/zinc/34/82/82/1132348282.db2.gz OLFLGTMTHXOGCV-HNNXBMFYSA-N 1 0 288.391 3.622 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914557 1132359743 /nfs/dbraw/zinc/35/97/43/1132359743.db2.gz HSOCFMNMDUJHPA-CVEARBPZSA-N 1 0 288.391 3.717 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914562 1132360118 /nfs/dbraw/zinc/36/01/18/1132360118.db2.gz HSOCFMNMDUJHPA-JKSUJKDBSA-N 1 0 288.391 3.717 20 5 CHBDRO CCC(CC)C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172896040 1132360256 /nfs/dbraw/zinc/36/02/56/1132360256.db2.gz LELUNMXVNQHCGL-INIZCTEOSA-N 1 0 290.407 3.868 20 5 CHBDRO CC1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172910421 1132372135 /nfs/dbraw/zinc/37/21/35/1132372135.db2.gz ZFSLKAWOLPIRSQ-MRXNPFEDSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C(C)(C)CC1CC1 ZINC001173220499 1132411143 /nfs/dbraw/zinc/41/11/43/1132411143.db2.gz CJYCCRWSCSCBKU-LBPRGKRZSA-N 1 0 276.380 3.694 20 5 CHBDRO CC(C)CC[C@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173217745 1132411422 /nfs/dbraw/zinc/41/14/22/1132411422.db2.gz LSRDZYIMXHQPQV-UONOGXRCSA-N 1 0 278.396 3.940 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173216084 1132411535 /nfs/dbraw/zinc/41/15/35/1132411535.db2.gz KDHUGVQNVMLHQS-CQSZACIVSA-N 1 0 284.359 3.624 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)C1CCCC1 ZINC001173215874 1132411802 /nfs/dbraw/zinc/41/18/02/1132411802.db2.gz ATQIUBYSANVXBI-OLZOCXBDSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC12CCCC2 ZINC001173220739 1132411917 /nfs/dbraw/zinc/41/19/17/1132411917.db2.gz CCLGFAIKYOAVQY-ZDUSSCGKSA-N 1 0 274.364 3.544 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CCC2)CC1 ZINC001173223072 1132412847 /nfs/dbraw/zinc/41/28/47/1132412847.db2.gz XBWBVFRHSHNNTH-CQSZACIVSA-N 1 0 288.391 3.792 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)[C@H](C)C1 ZINC001173230495 1132413768 /nfs/dbraw/zinc/41/37/68/1132413768.db2.gz YJKMVHSBWKVOHC-RBSFLKMASA-N 1 0 290.407 3.894 20 5 CHBDRO Cc1ccnc([C@@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173212897 1132416062 /nfs/dbraw/zinc/41/60/62/1132416062.db2.gz CIXKCIOAPSPAHI-ZIAGYGMSSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCc2ccccc21 ZINC001173214217 1132416829 /nfs/dbraw/zinc/41/68/29/1132416829.db2.gz NLCGIDNWYIXJHU-FZKQIMNGSA-N 1 0 296.370 3.803 20 5 CHBDRO CSCC[N@H+](C)Cc1ccc2ccc3cccnc3c2n1 ZINC001232229008 1132439261 /nfs/dbraw/zinc/43/92/61/1132439261.db2.gz XBPIACGAPYEIPL-UHFFFAOYSA-N 1 0 297.427 3.578 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC001174705307 1132960261 /nfs/dbraw/zinc/96/02/61/1132960261.db2.gz UFXRJWYAHLKHSB-CQSZACIVSA-N 1 0 274.364 3.607 20 5 CHBDRO Cc1cccc(NCc2cccc(C[NH+](C)C)c2)c1[N+](=O)[O-] ZINC001163994368 1133190958 /nfs/dbraw/zinc/19/09/58/1133190958.db2.gz VVOJQZFBODRBDA-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCCc1ccsc1 ZINC001166804269 1133289006 /nfs/dbraw/zinc/28/90/06/1133289006.db2.gz YZMOZZJQYLXZCB-UHFFFAOYSA-N 1 0 289.468 3.999 20 5 CHBDRO CSC(C)(C)CC[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001205755825 1133608783 /nfs/dbraw/zinc/60/87/83/1133608783.db2.gz OCXLYEZRPCPNDX-UHFFFAOYSA-N 1 0 296.436 3.601 20 5 CHBDRO C=C/C=C/CC[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC001207372938 1133795719 /nfs/dbraw/zinc/79/57/19/1133795719.db2.gz WMIAAJJNCBXLEN-ISZGNANSSA-N 1 0 274.364 3.638 20 5 CHBDRO Cc1ccc(Nc2ccc(CC[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC001213670470 1134476930 /nfs/dbraw/zinc/47/69/30/1134476930.db2.gz XIOFIZWRZMIBAP-UHFFFAOYSA-N 1 0 299.374 3.751 20 5 CHBDRO Cc1ccc(Nc2cc[nH+]c(C3CC3)c2)c([N+](=O)[O-])c1 ZINC001214169692 1134515797 /nfs/dbraw/zinc/51/57/97/1134515797.db2.gz YYWOLBPYLUXXOQ-UHFFFAOYSA-N 1 0 269.304 3.919 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@@H]1CCC[NH2+]C1 ZINC001217963264 1135031516 /nfs/dbraw/zinc/03/15/16/1135031516.db2.gz QYBWOMKAOJEXSQ-CQSZACIVSA-N 1 0 278.355 3.519 20 5 CHBDRO C[NH2+][C@H]1C[C@@H](Oc2c3ccccc3c(O)c3ccccc32)C1 ZINC001217957337 1135031987 /nfs/dbraw/zinc/03/19/87/1135031987.db2.gz GKWUCOHTBDJWMB-BETUJISGSA-N 1 0 293.366 3.828 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1OC1CC[NH2+]CC1 ZINC001217963483 1135032441 /nfs/dbraw/zinc/03/24/41/1135032441.db2.gz CTKQJUNDMXLXLQ-UHFFFAOYSA-N 1 0 278.355 3.519 20 5 CHBDRO Cc1cc(C)c2ccc3cccc(O[C@@H]4C[NH2+][C@@H]4C)c3c2n1 ZINC001218388157 1135097572 /nfs/dbraw/zinc/09/75/72/1135097572.db2.gz RQZBPUIRBJXLDR-CXAGYDPISA-N 1 0 292.382 3.744 20 5 CHBDRO C[C@@H]1CC[C@H](Oc2nccc3c4ccccc4ccc32)C[NH2+]1 ZINC001218404037 1135100183 /nfs/dbraw/zinc/10/01/83/1135100183.db2.gz YYTLOUYFSPIQTR-HIFRSBDPSA-N 1 0 292.382 3.907 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@@H]3[C@@H]4CC[C@H]3[NH2+]C4)c12 ZINC001218445208 1135106738 /nfs/dbraw/zinc/10/67/38/1135106738.db2.gz UVJRKOMWWHSECC-SPYBWZPUSA-N 1 0 290.366 3.517 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@@H]1C[C@@H]2CC[C@H]1[NH2+]2 ZINC001218477078 1135111979 /nfs/dbraw/zinc/11/19/79/1135111979.db2.gz DFMVFRLJZGFKLB-MORSLUCNSA-N 1 0 290.366 3.660 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCCC12CC3CC(CC(C3)C1)C2 ZINC001224463876 1135451866 /nfs/dbraw/zinc/45/18/66/1135451866.db2.gz QCQNITQVMPOOPJ-NUVRTYOOSA-N 1 0 280.476 3.704 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(Cc2ccccc2)cc1 ZINC001225264293 1135530566 /nfs/dbraw/zinc/53/05/66/1135530566.db2.gz PIJGIKIFLAMSOV-INIZCTEOSA-N 1 0 284.423 3.751 20 5 CHBDRO CCCCC(=O)c1ccc(O[C@H](C)C[N+](C)(C)C)cc1 ZINC001226772193 1135739616 /nfs/dbraw/zinc/73/96/16/1135739616.db2.gz OMQYGGGUXIWTEA-CQSZACIVSA-N 1 0 278.416 3.533 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000090217454 260339030 /nfs/dbraw/zinc/33/90/30/260339030.db2.gz GGOMYABLVDLPCO-VHSXEESVSA-N 1 0 290.285 3.895 20 5 CHBDRO CC(C)(C)C1CC([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000574580587 335031525 /nfs/dbraw/zinc/03/15/25/335031525.db2.gz APIXRIWHZZMNKP-UHFFFAOYSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccs2)cc1[N+](=O)[O-] ZINC000020139594 171026971 /nfs/dbraw/zinc/02/69/71/171026971.db2.gz QICYECGTEOFGPR-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000020148562 171037130 /nfs/dbraw/zinc/03/71/30/171037130.db2.gz POVDMOJKBCVEIG-SNVBAGLBSA-N 1 0 262.334 3.507 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000034995555 171924149 /nfs/dbraw/zinc/92/41/49/171924149.db2.gz MFPWQQYHXPRTDF-OSAQELSMSA-N 1 0 276.380 3.818 20 5 CHBDRO CCCCC[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000035135649 172002768 /nfs/dbraw/zinc/00/27/68/172002768.db2.gz SCNLGFCEUIFDBX-LBPRGKRZSA-N 1 0 250.342 3.653 20 5 CHBDRO CSC1(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)CC1 ZINC000347615737 226202721 /nfs/dbraw/zinc/20/27/21/226202721.db2.gz QWGBLTVSZYYENW-UHFFFAOYSA-N 1 0 294.420 3.701 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC=CCC1)CCC2 ZINC000193001793 227419568 /nfs/dbraw/zinc/41/95/68/227419568.db2.gz QTMGCCBTYAMDRH-CZUORRHYSA-N 1 0 272.348 3.671 20 5 CHBDRO CC(C)C(C)(C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000219272421 260003830 /nfs/dbraw/zinc/00/38/30/260003830.db2.gz RJCOQIXFHPQCLX-GFCCVEGCSA-N 1 0 264.369 3.928 20 5 CHBDRO Cc1ncsc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000071212587 260160437 /nfs/dbraw/zinc/16/04/37/260160437.db2.gz WOQCTNPJSIVMHQ-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO Cc1c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000426768931 260279308 /nfs/dbraw/zinc/27/93/08/260279308.db2.gz DKWYRDNHYHUSAV-HUUCEWRRSA-N 1 0 274.364 3.525 20 5 CHBDRO Cc1c(C[NH2+]C2CC(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000318476491 261210604 /nfs/dbraw/zinc/21/06/04/261210604.db2.gz GFVWPEVWAICVFZ-UHFFFAOYSA-N 1 0 296.370 3.939 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000163766162 261328563 /nfs/dbraw/zinc/32/85/63/261328563.db2.gz YHIXHHNUJJFXNT-MLGOLLRUSA-N 1 0 285.347 3.792 20 5 CHBDRO C[C@H](C[N@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000301984758 261345118 /nfs/dbraw/zinc/34/51/18/261345118.db2.gz CEOBQYQQYWOYDH-CQSZACIVSA-N 1 0 299.374 3.527 20 5 CHBDRO C[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc([N+](=O)[O-])cc1 ZINC000186004006 262075006 /nfs/dbraw/zinc/07/50/06/262075006.db2.gz YPKVXZLWJRXWCJ-CZUORRHYSA-N 1 0 292.379 3.595 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCCCC2(F)F)cc1[N+](=O)[O-] ZINC000390550369 262215753 /nfs/dbraw/zinc/21/57/53/262215753.db2.gz JVNCNVGUHMSZCB-ZDUSSCGKSA-N 1 0 298.333 3.818 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000228554653 262341672 /nfs/dbraw/zinc/34/16/72/262341672.db2.gz NJZWDARBPLEOTB-IUODEOHRSA-N 1 0 294.420 3.779 20 5 CHBDRO CCC[C@H]([NH2+]C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000021013643 262373594 /nfs/dbraw/zinc/37/35/94/262373594.db2.gz GGIAQFLFHWDFPG-HNNXBMFYSA-N 1 0 262.353 3.968 20 5 CHBDRO C[C@@H](CC(F)(F)F)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000463732875 262393738 /nfs/dbraw/zinc/39/37/38/262393738.db2.gz YUNXLEWODXFMHI-RWCYGVJQSA-N 1 0 288.269 3.539 20 5 CHBDRO Cc1cccc(CCC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000285049891 263089648 /nfs/dbraw/zinc/08/96/48/263089648.db2.gz IVBCJPMKIVZNFK-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)cccc1[N+](=O)[O-] ZINC000187846437 263271015 /nfs/dbraw/zinc/27/10/15/263271015.db2.gz ZCXXXPPAINWCPN-STQMWFEESA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000357022466 266233627 /nfs/dbraw/zinc/23/36/27/266233627.db2.gz JUVWEABDGAAESX-CYBMUJFWSA-N 1 0 274.364 3.607 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CCC1=CCCC1 ZINC000120157765 267388046 /nfs/dbraw/zinc/38/80/46/267388046.db2.gz MYKZSBDNGQWXOW-WEVVVXLNSA-N 1 0 272.348 3.698 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2(c3ccc(F)cc3)CC2)c1 ZINC000531207020 327889606 /nfs/dbraw/zinc/88/96/06/327889606.db2.gz SCMKFWYKEFNGTM-UHFFFAOYSA-N 1 0 286.306 3.513 20 5 CHBDRO CCC(CC)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000571228728 328093905 /nfs/dbraw/zinc/09/39/05/328093905.db2.gz PTHGABKUYQGUFH-UHFFFAOYSA-N 1 0 264.369 3.505 20 5 CHBDRO CC[N@H+](CCC1CC1)Cc1cccc([N+](=O)[O-])c1C ZINC000546225123 328232463 /nfs/dbraw/zinc/23/24/63/328232463.db2.gz ACACLCVVHOVUCF-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO CCC1CCC([NH2+]CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000049120777 328340105 /nfs/dbraw/zinc/34/01/05/328340105.db2.gz IOVOMOUQXXEBKD-UHFFFAOYSA-N 1 0 292.379 3.532 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000049120318 328340158 /nfs/dbraw/zinc/34/01/58/328340158.db2.gz ZWSDZZJUMCKDOO-KBPBESRZSA-N 1 0 292.379 3.662 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCC12CCCCC2 ZINC000534666773 328345302 /nfs/dbraw/zinc/34/53/02/328345302.db2.gz VFQWMDDTGLLARV-UHFFFAOYSA-N 1 0 274.364 3.894 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccsc2)cc1[N+](=O)[O-] ZINC000049153215 328349654 /nfs/dbraw/zinc/34/96/54/328349654.db2.gz WACIXUMIMZIHKA-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963336 328380109 /nfs/dbraw/zinc/38/01/09/328380109.db2.gz AWOZTPLAGMBFGM-SNVBAGLBSA-N 1 0 270.760 3.772 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](CC2CCCC2)C2CC2)c1 ZINC000532021488 328393191 /nfs/dbraw/zinc/39/31/91/328393191.db2.gz LVYOSHGKLKKHPF-UHFFFAOYSA-N 1 0 274.364 3.749 20 5 CHBDRO C[C@]1(c2ccccc2)CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532038689 328396974 /nfs/dbraw/zinc/39/69/74/328396974.db2.gz XUCGICOLXWAWFJ-SFHVURJKSA-N 1 0 296.370 3.758 20 5 CHBDRO CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000050887301 328450489 /nfs/dbraw/zinc/45/04/89/328450489.db2.gz GJNBBVOPNLKNGF-NEPJUHHUSA-N 1 0 250.342 3.824 20 5 CHBDRO C[C@H]1CCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000071207135 328480276 /nfs/dbraw/zinc/48/02/76/328480276.db2.gz NBTBIACFHXXETD-TVQRCGJNSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000037770940 326861230 /nfs/dbraw/zinc/86/12/30/326861230.db2.gz VKGBWVAOMXYYFB-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CSc3ccccc32)cc1 ZINC000083748891 326937713 /nfs/dbraw/zinc/93/77/13/326937713.db2.gz FBNUYYFZTLUCBR-AWEZNQCLSA-N 1 0 286.356 3.531 20 5 CHBDRO CC(C)(CC[NH2+]Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000381100605 327107582 /nfs/dbraw/zinc/10/75/82/327107582.db2.gz ZUKYPWKDQKFSOP-UHFFFAOYSA-N 1 0 262.353 3.511 20 5 CHBDRO C[N@@H+](C/C=C/c1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000558737088 327118512 /nfs/dbraw/zinc/11/85/12/327118512.db2.gz WZHJJZJUCZQUJC-UXBLZVDNSA-N 1 0 296.370 3.783 20 5 CHBDRO C[C@@H]1CCC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000088195115 327130363 /nfs/dbraw/zinc/13/03/63/327130363.db2.gz LTJLEDDJBLEDTJ-TZMCWYRMSA-N 1 0 262.353 3.511 20 5 CHBDRO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CS1 ZINC000449348653 327166306 /nfs/dbraw/zinc/16/63/06/327166306.db2.gz MRVBBXZJNXNRKF-WHOFXGATSA-N 1 0 294.420 3.776 20 5 CHBDRO C[C@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089511931 327170869 /nfs/dbraw/zinc/17/08/69/327170869.db2.gz HGSGWBCLDCPKTA-SJCJKPOMSA-N 1 0 282.343 3.618 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000533821139 327203538 /nfs/dbraw/zinc/20/35/38/327203538.db2.gz XLCHQPJRQYIOMJ-KRWDZBQOSA-N 1 0 297.358 3.502 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCCC1(F)F ZINC000560351034 327302219 /nfs/dbraw/zinc/30/22/19/327302219.db2.gz DATXZYZZWVYZJO-NWDGAFQWSA-N 1 0 298.333 3.989 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCCC[C@@H]2C2CC2)cc1 ZINC000507463135 332807269 /nfs/dbraw/zinc/80/72/69/332807269.db2.gz RDFSBPABNJYCBM-IAGOWNOFSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H](F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000569724135 327542412 /nfs/dbraw/zinc/54/24/12/327542412.db2.gz UMLXXXCMMLTEQA-UHTWSYAYSA-N 1 0 266.316 3.526 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@H]2C[C@H]2c2ccccc2)cc1 ZINC000532127584 328700816 /nfs/dbraw/zinc/70/08/16/328700816.db2.gz GBEKVNOSLGMOHX-AEFFLSMTSA-N 1 0 296.370 3.531 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccccc1 ZINC000532188775 328703745 /nfs/dbraw/zinc/70/37/45/328703745.db2.gz XZXFYFPKSCXQEH-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO C[C@@H]([NH2+][C@H](C1CC1)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000324663207 328772121 /nfs/dbraw/zinc/77/21/21/328772121.db2.gz ISQXOQOAXYQDJG-BZNIZROVSA-N 1 0 274.364 3.824 20 5 CHBDRO CCO[C@@H](CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000178661176 329201926 /nfs/dbraw/zinc/20/19/26/329201926.db2.gz VVFXMRQNTKLIRX-BBRMVZONSA-N 1 0 294.395 3.697 20 5 CHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000182061439 329239181 /nfs/dbraw/zinc/23/91/81/329239181.db2.gz UXDAXIFTBXUWQL-UHFFFAOYSA-N 1 0 268.744 3.621 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)C1CC1 ZINC000582921343 329288888 /nfs/dbraw/zinc/28/88/88/329288888.db2.gz XQKHGBKWGZUHMT-LBPRGKRZSA-N 1 0 292.379 3.612 20 5 CHBDRO COCC[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000508996257 332854757 /nfs/dbraw/zinc/85/47/57/332854757.db2.gz FQMSQTPGUVJFLN-SWLSCSKDSA-N 1 0 294.395 3.697 20 5 CHBDRO C[C@@H](F)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000584536664 329516316 /nfs/dbraw/zinc/51/63/16/329516316.db2.gz WCLLBDDXJLJVHD-LLVKDONJSA-N 1 0 292.310 3.693 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccs2)c(Cl)c1 ZINC000049963320 329643364 /nfs/dbraw/zinc/64/33/64/329643364.db2.gz SORHXXHCXSUWDU-UHFFFAOYSA-N 1 0 282.752 3.600 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc(C)n1 ZINC000421888573 330096656 /nfs/dbraw/zinc/09/66/56/330096656.db2.gz TYBUDSUJZGFGCK-AWEZNQCLSA-N 1 0 299.374 3.766 20 5 CHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000396778910 330225937 /nfs/dbraw/zinc/22/59/37/330225937.db2.gz LIYFWUQQOVMKOZ-CYBMUJFWSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)CC(C)C)cccc1[N+](=O)[O-] ZINC000536838582 330231931 /nfs/dbraw/zinc/23/19/31/330231931.db2.gz LYYVCLLLRLJPFC-AAEUAGOBSA-N 1 0 264.369 3.988 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000035257016 330244786 /nfs/dbraw/zinc/24/47/86/330244786.db2.gz UZULXCZYUDWGHN-ZFWWWQNUSA-N 1 0 262.353 3.653 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1ccc([N+](=O)[O-])cc1C ZINC000036950027 330321855 /nfs/dbraw/zinc/32/18/55/330321855.db2.gz FYCQCDARNNSXHN-CQSZACIVSA-N 1 0 293.411 3.826 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1C[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000044674735 330331810 /nfs/dbraw/zinc/33/18/10/330331810.db2.gz SPORMIBUECNTQT-CSMYWGQOSA-N 1 0 282.343 3.802 20 5 CHBDRO CC(C)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000445436430 330342608 /nfs/dbraw/zinc/34/26/08/330342608.db2.gz RBVJCHYPCCCBOQ-STQMWFEESA-N 1 0 262.353 3.634 20 5 CHBDRO COC1(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCCC1 ZINC000315585671 330477772 /nfs/dbraw/zinc/47/77/72/330477772.db2.gz SPPJTYPYMBRAMB-ZDUSSCGKSA-N 1 0 292.379 3.513 20 5 CHBDRO CCCCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447517669 330867582 /nfs/dbraw/zinc/86/75/82/330867582.db2.gz LUOOOZJQFHENIX-OAHLLOKOSA-N 1 0 262.353 3.752 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449439038 330925663 /nfs/dbraw/zinc/92/56/63/330925663.db2.gz GAIUJONMXKHLJR-LLVKDONJSA-N 1 0 286.331 3.743 20 5 CHBDRO CCC[C@@H]([NH2+]C1CCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000163258508 331010507 /nfs/dbraw/zinc/01/05/07/331010507.db2.gz HPDHGTWYGGUYMG-OAHLLOKOSA-N 1 0 294.420 3.921 20 5 CHBDRO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H]2CCC23CCCC3)c(F)c1 ZINC000451465087 331030527 /nfs/dbraw/zinc/03/05/27/331030527.db2.gz ZMZWGHNPOQVDQX-AWEZNQCLSA-N 1 0 296.317 3.685 20 5 CHBDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000452010381 331050244 /nfs/dbraw/zinc/05/02/44/331050244.db2.gz FFNGXNQABMSDGW-DAXOMENPSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@@H](N[C@H](CC)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000453242964 331106394 /nfs/dbraw/zinc/10/63/94/331106394.db2.gz IRHHIWFCRJWPGM-VXGBXAGGSA-N 1 0 272.295 3.679 20 5 CHBDRO CC(C)[C@@H]1C[C@H]1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000453374942 331124572 /nfs/dbraw/zinc/12/45/72/331124572.db2.gz XDHCYIHMBUEARX-WHOFXGATSA-N 1 0 262.353 3.538 20 5 CHBDRO CCC(C)(C)OCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453410365 331129784 /nfs/dbraw/zinc/12/97/84/331129784.db2.gz PGKQDIBJELUUOT-CYBMUJFWSA-N 1 0 294.395 3.759 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000195651199 331179457 /nfs/dbraw/zinc/17/94/57/331179457.db2.gz DFHPFJAFGUOIAS-MAUKXSAKSA-N 1 0 296.370 3.975 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CCC[C@H]2CCCF)c1 ZINC000510661047 332909989 /nfs/dbraw/zinc/90/99/89/332909989.db2.gz FPOPVHOBCYEISU-HOCLYGCPSA-N 1 0 294.370 3.645 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459774311 331300095 /nfs/dbraw/zinc/30/00/95/331300095.db2.gz ITVCNXWMSUNVFW-JIMOISOXSA-N 1 0 280.755 3.526 20 5 CHBDRO Cc1cc(C)cc(C[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000462731603 331325920 /nfs/dbraw/zinc/32/59/20/331325920.db2.gz PDPAVUSYMZSQJZ-HNNXBMFYSA-N 1 0 298.386 3.932 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CCCCF ZINC000462812918 331330472 /nfs/dbraw/zinc/33/04/72/331330472.db2.gz PCHDRBJOYOIPLI-HIFRSBDPSA-N 1 0 294.370 3.645 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC1(C)CC1 ZINC000475224247 331619843 /nfs/dbraw/zinc/61/98/43/331619843.db2.gz MSUWCJFTSKPUPI-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC[C@@H]2C2CC2)cccc1[N+](=O)[O-] ZINC000477741260 331689736 /nfs/dbraw/zinc/68/97/36/331689736.db2.gz IDFCDWQMBGGCKF-CABCVRRESA-N 1 0 274.364 3.572 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000479972856 331752917 /nfs/dbraw/zinc/75/29/17/331752917.db2.gz WSBOXSFYARMOQL-HBYGRHMLSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2cc(Cl)cs2)c1 ZINC000487567956 331975139 /nfs/dbraw/zinc/97/51/39/331975139.db2.gz DICMAEXUWXIVMA-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000487967780 331986052 /nfs/dbraw/zinc/98/60/52/331986052.db2.gz DETYEFKYJSLLEO-UPJWGTAASA-N 1 0 262.353 3.634 20 5 CHBDRO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])CS1 ZINC000488420175 332006103 /nfs/dbraw/zinc/00/61/03/332006103.db2.gz PWJJBRDNFOVKFM-GXTWGEPZSA-N 1 0 294.420 3.605 20 5 CHBDRO CC(C)C1CC([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000488440490 332008687 /nfs/dbraw/zinc/00/86/87/332008687.db2.gz JKBBYNLEIWWNOC-PNESKVBLSA-N 1 0 262.353 3.680 20 5 CHBDRO COc1cc(C[N@H+](C)C2(C)CCCC2)c([N+](=O)[O-])cc1F ZINC000489854136 332070398 /nfs/dbraw/zinc/07/03/98/332070398.db2.gz UJCWNGAFXMXZAH-UHFFFAOYSA-N 1 0 296.342 3.507 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](C2CC2)[C@@H]2C=CCCC2)c1 ZINC000490043758 332078159 /nfs/dbraw/zinc/07/81/59/332078159.db2.gz KLFMSKVIIDZERL-CQSZACIVSA-N 1 0 272.348 3.668 20 5 CHBDRO Cc1c(C[N@@H+](C)C2(C)CCCC2)cccc1[N+](=O)[O-] ZINC000490161830 332083168 /nfs/dbraw/zinc/08/31/68/332083168.db2.gz BHXYEFVWGXPTJM-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO CC(C)C[C@H](C)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000499610456 332590061 /nfs/dbraw/zinc/59/00/61/332590061.db2.gz JXNUACPSWGUKEQ-QWHCGFSZSA-N 1 0 264.369 3.928 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178643247 333076203 /nfs/dbraw/zinc/07/62/03/333076203.db2.gz MQRBXNCKEUCMNW-SNVBAGLBSA-N 1 0 292.285 3.724 20 5 CHBDRO CC(C)(C)C(C)(C)C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000312087671 333076293 /nfs/dbraw/zinc/07/62/93/333076293.db2.gz OHGWIPVVZSFSKP-UHFFFAOYSA-N 1 0 264.369 3.757 20 5 CHBDRO CC[C@@H](C)C[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000088295549 333087845 /nfs/dbraw/zinc/08/78/45/333087845.db2.gz XXVPFXLBBSQMQH-VXGBXAGGSA-N 1 0 250.342 3.509 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000182842686 333117857 /nfs/dbraw/zinc/11/78/57/333117857.db2.gz LCKGTBWBHRWFFD-MCIONIFRSA-N 1 0 274.364 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC2(CCC2)C1 ZINC000182844548 333117884 /nfs/dbraw/zinc/11/78/84/333117884.db2.gz JEJPFOFTWSCUMT-CYBMUJFWSA-N 1 0 274.364 3.840 20 5 CHBDRO C[C@H]([NH2+][C@H]1COCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000336862412 335121795 /nfs/dbraw/zinc/12/17/95/335121795.db2.gz IWZKCLRGTPLMIB-SJCJKPOMSA-N 1 0 298.342 3.517 20 5 CHBDRO CC[C@@H]([NH2+]C1CC(OC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000186551710 333162823 /nfs/dbraw/zinc/16/28/23/333162823.db2.gz HPQAXYLJQLKHBE-AVVWSFFYSA-N 1 0 292.379 3.592 20 5 CHBDRO CCC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000224505270 333221358 /nfs/dbraw/zinc/22/13/58/333221358.db2.gz ZCZRWAMRMNTPLM-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)CC2)cc1[N+](=O)[O-] ZINC000227310167 333280137 /nfs/dbraw/zinc/28/01/37/333280137.db2.gz SMADDBHZJMNDSW-TZMCWYRMSA-N 1 0 292.379 3.662 20 5 CHBDRO CCC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000227758307 333288012 /nfs/dbraw/zinc/28/80/12/333288012.db2.gz IJUDNSGACMVDEP-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO CCC[NH+](CCC)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522535491 333289223 /nfs/dbraw/zinc/28/92/23/333289223.db2.gz OGTOAZMSBMNJSV-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO Cc1ccc(C[C@@H](C)[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000523438806 333326772 /nfs/dbraw/zinc/32/67/72/333326772.db2.gz REWABNYJPKOJIG-OAHLLOKOSA-N 1 0 298.386 3.966 20 5 CHBDRO Cc1cc(F)ccc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000231884267 333331178 /nfs/dbraw/zinc/33/11/78/333331178.db2.gz RMOLWSJHDLVZCH-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO CC1=C[C@H](C)C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000235391251 333368827 /nfs/dbraw/zinc/36/88/27/333368827.db2.gz CWWGPMPREORCQL-SWLSCSKDSA-N 1 0 274.364 3.677 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CS[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000397941645 333431297 /nfs/dbraw/zinc/43/12/97/333431297.db2.gz VAJDLQSAJUHFEL-OSMZGAPFSA-N 1 0 280.393 3.530 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CC(C)C)cc1[N+](=O)[O-] ZINC000037260586 333525947 /nfs/dbraw/zinc/52/59/47/333525947.db2.gz ZBVMBQVEPCZPLF-QWHCGFSZSA-N 1 0 264.369 3.988 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000037775709 333539381 /nfs/dbraw/zinc/53/93/81/333539381.db2.gz IEYDXLSMNXNLEF-OLZOCXBDSA-N 1 0 260.337 3.602 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000062726586 333554111 /nfs/dbraw/zinc/55/41/11/333554111.db2.gz VFISDYYZRBBBMT-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000538194745 333578490 /nfs/dbraw/zinc/57/84/90/333578490.db2.gz PJEHUAZZTIVTPZ-NWDGAFQWSA-N 1 0 282.409 3.695 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1CCCC(F)(F)C1 ZINC000540625913 333739145 /nfs/dbraw/zinc/73/91/45/333739145.db2.gz WZGYUTGGGDTDRQ-AGLBCWCQSA-N 1 0 296.317 3.776 20 5 CHBDRO CS[C@H]1CCCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000134596622 334096475 /nfs/dbraw/zinc/09/64/75/334096475.db2.gz LUTILWQSUCVTOI-WFASDCNBSA-N 1 0 294.420 3.873 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000078463082 334134030 /nfs/dbraw/zinc/13/40/30/334134030.db2.gz OOJRRGUPKLBNIY-YRGRVCCFSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)C(F)(F)F ZINC000548157552 334143532 /nfs/dbraw/zinc/14/35/32/334143532.db2.gz KWUPJSREKWIAHA-NXEZZACHSA-N 1 0 290.285 3.752 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC(C)(C)C(F)(F)F ZINC000548860002 334176962 /nfs/dbraw/zinc/17/69/62/334176962.db2.gz HKOUKLHHNNUXKE-UHFFFAOYSA-N 1 0 290.285 3.581 20 5 CHBDRO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000550079270 334212458 /nfs/dbraw/zinc/21/24/58/334212458.db2.gz LFTFTJIESUGHNM-ZFWWWQNUSA-N 1 0 274.364 3.605 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CC=CCC1)C1CC1 ZINC000090035858 334356025 /nfs/dbraw/zinc/35/60/25/334356025.db2.gz LQJCRDXBLZMDRJ-CVEARBPZSA-N 1 0 286.375 3.614 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000577418798 335351147 /nfs/dbraw/zinc/35/11/47/335351147.db2.gz KBJRFNVGSGDOLW-UHFFFAOYSA-N 1 0 298.358 3.753 20 5 CHBDRO CC[C@H](C)[C@H](C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)OC ZINC000381185871 336053994 /nfs/dbraw/zinc/05/39/94/336053994.db2.gz SBVYXXBSMHGDBY-GHJWDPDVSA-N 1 0 294.395 3.615 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H](C1CC1)C1CCC1 ZINC000581677110 336127192 /nfs/dbraw/zinc/12/71/92/336127192.db2.gz QUHWKCHOIKWAHG-DOTOQJQBSA-N 1 0 286.375 3.750 20 5 CHBDRO Cc1ccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000581919175 336165768 /nfs/dbraw/zinc/16/57/68/336165768.db2.gz AYAIKMRAWLOFSR-CYBMUJFWSA-N 1 0 288.347 3.698 20 5 CHBDRO CC1(C)CCC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C1 ZINC000149402656 520356677 /nfs/dbraw/zinc/35/66/77/520356677.db2.gz LSUOYVBLCXNIPJ-NSHDSACASA-N 1 0 268.382 3.715 20 5 CHBDRO CCO[C@H](CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000155684162 520511675 /nfs/dbraw/zinc/51/16/75/520511675.db2.gz SCJNNRDUZSLQHO-XJKSGUPXSA-N 1 0 294.395 3.697 20 5 CHBDRO CC1(C)C[C@H]([NH2+]Cc2cccnc2)c2cc([N+](=O)[O-])ccc21 ZINC000279185187 520555846 /nfs/dbraw/zinc/55/58/46/520555846.db2.gz VVVBIYKTTOKMPX-INIZCTEOSA-N 1 0 297.358 3.502 20 5 CHBDRO CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)c1cccnc1 ZINC000290535795 521305112 /nfs/dbraw/zinc/30/51/12/521305112.db2.gz QWUDSMCHOUCRLM-AWEZNQCLSA-N 1 0 299.374 3.881 20 5 CHBDRO COC1(C[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000277063431 522639428 /nfs/dbraw/zinc/63/94/28/522639428.db2.gz IEXJAJOYUMDBSU-OLZOCXBDSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000149558463 522852671 /nfs/dbraw/zinc/85/26/71/522852671.db2.gz HDTSXUWPIVSENS-UONOGXRCSA-N 1 0 280.393 3.531 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1 ZINC000051627909 522871059 /nfs/dbraw/zinc/87/10/59/522871059.db2.gz HZVKRFIWXKHBPE-OAHLLOKOSA-N 1 0 288.322 3.975 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc([N+](=O)[O-])cc1 ZINC000130587683 525631918 /nfs/dbraw/zinc/63/19/18/525631918.db2.gz NJRUIQQKHGTNJA-ZBEGNZNMSA-N 1 0 298.342 3.639 20 5 CHBDRO C[C@@H](c1cccs1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774590 526145514 /nfs/dbraw/zinc/14/55/14/526145514.db2.gz WAJMFFJFRLVPRL-JTQLQIEISA-N 1 0 294.351 3.988 20 5 CHBDRO Cc1sccc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000293397470 526917636 /nfs/dbraw/zinc/91/76/36/526917636.db2.gz XQNXEHKVYQQSEA-JTQLQIEISA-N 1 0 276.361 3.816 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)C1(C)CC1 ZINC000355083162 528612038 /nfs/dbraw/zinc/61/20/38/528612038.db2.gz SIMBJVBMMBLFNT-LBPRGKRZSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCC2=CCCCC2)cc1 ZINC000013718123 567894068 /nfs/dbraw/zinc/89/40/68/567894068.db2.gz ASJYQEJICWKICK-UHFFFAOYSA-N 1 0 260.337 3.575 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CC[C@H](C)CC2)cccc1[N+](=O)[O-] ZINC000253143150 1119403000 /nfs/dbraw/zinc/40/30/00/1119403000.db2.gz YDRYCLHYOONHEI-YEORSEQZSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H](C)CC(F)(F)F ZINC000414513656 1120106036 /nfs/dbraw/zinc/10/60/36/1120106036.db2.gz KPUDQJHNOHDYSE-VIFPVBQESA-N 1 0 290.285 3.581 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)/C=C\Cl)cc1[N+](=O)[O-] ZINC001179625835 1121897339 /nfs/dbraw/zinc/89/73/39/1121897339.db2.gz CHRRIEUKWYPAQU-SREVYHEPSA-N 1 0 268.744 3.524 20 5 CHBDRO CC[C@@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000533504895 1125611463 /nfs/dbraw/zinc/61/14/63/1125611463.db2.gz IVRHKXSQFOXBAE-GFCCVEGCSA-N 1 0 280.368 3.612 20 5 CHBDRO CO[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000886512981 1125682962 /nfs/dbraw/zinc/68/29/62/1125682962.db2.gz QXLNFGXRBWKJSQ-IVMMDQJWSA-N 1 0 292.379 3.593 20 5 CHBDRO CO[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000886615465 1125697694 /nfs/dbraw/zinc/69/76/94/1125697694.db2.gz HCHPRUNKFNAXJQ-DUVNUKRYSA-N 1 0 292.379 3.593 20 5 CHBDRO CO[C@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000886615467 1125697816 /nfs/dbraw/zinc/69/78/16/1125697816.db2.gz HCHPRUNKFNAXJQ-NOLJZWGESA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000237405992 1125698635 /nfs/dbraw/zinc/69/86/35/1125698635.db2.gz NNWXGFNZYAHHQG-NXEZZACHSA-N 1 0 268.382 3.571 20 5 CHBDRO CCC(C)(C)C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000192352458 1125765127 /nfs/dbraw/zinc/76/51/27/1125765127.db2.gz XUBGZIZYTNVPRW-VQHVLOKHSA-N 1 0 262.353 3.634 20 5 CHBDRO CCCC[C@@H](CCC)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819133751 1131233091 /nfs/dbraw/zinc/23/30/91/1131233091.db2.gz CDRPJPJFQFOFOP-ZBFHGGJFSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000159723422 1126751340 /nfs/dbraw/zinc/75/13/40/1126751340.db2.gz PGVCRDFOLJPGKR-KRWDZBQOSA-N 1 0 297.358 3.635 20 5 CHBDRO C[C@@H]1CCCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000482314780 1126751478 /nfs/dbraw/zinc/75/14/78/1126751478.db2.gz WIIWIRSVNUCTJB-VIIAAUOXSA-N 1 0 274.364 3.730 20 5 CHBDRO C[N@H+](Cc1cccc(Cl)c1)Cc1cccc([N+](=O)[O-])c1 ZINC000042366922 1126752148 /nfs/dbraw/zinc/75/21/48/1126752148.db2.gz VIMBHYYEPKFEGS-UHFFFAOYSA-N 1 0 290.750 3.880 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000036721102 1126799441 /nfs/dbraw/zinc/79/94/41/1126799441.db2.gz GBXDHSYNOSPRDY-MRXNPFEDSA-N 1 0 288.322 3.975 20 5 CHBDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000483750001 1126800157 /nfs/dbraw/zinc/80/01/57/1126800157.db2.gz VLVAQAJOBINXLN-DUVNUKRYSA-N 1 0 292.379 3.511 20 5 CHBDRO CCCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000483953789 1126806045 /nfs/dbraw/zinc/80/60/45/1126806045.db2.gz JJPYDJLWOXTMCT-UHFFFAOYSA-N 1 0 262.353 3.749 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC[C@@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000180260436 1126841630 /nfs/dbraw/zinc/84/16/30/1126841630.db2.gz KNSXTKUCTLYNTF-KBPBESRZSA-N 1 0 292.379 3.513 20 5 CHBDRO CC[C@@H]([NH2+]C(C1CC1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000037010526 1126848716 /nfs/dbraw/zinc/84/87/16/1126848716.db2.gz TVBXPCIZVHXMRZ-OAHLLOKOSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CCCc2occc21 ZINC000183432210 1126886350 /nfs/dbraw/zinc/88/63/50/1126886350.db2.gz LATKGUITJPTRBD-HNNXBMFYSA-N 1 0 286.331 3.663 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2c2ccccc2)c1 ZINC000054669779 1127086093 /nfs/dbraw/zinc/08/60/93/1127086093.db2.gz ZCVOVGXPQOBCSQ-QGZVFWFLSA-N 1 0 282.343 3.932 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000029482274 1127124107 /nfs/dbraw/zinc/12/41/07/1127124107.db2.gz DGLKHFKSEQXVOB-QGZVFWFLSA-N 1 0 282.343 3.714 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cccs1 ZINC000349837091 1127165075 /nfs/dbraw/zinc/16/50/75/1127165075.db2.gz UIHCHTCVEQMHSW-UHFFFAOYSA-N 1 0 276.361 3.597 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CC(C4CC4)C3)o2)c1 ZINC000589736883 1127234658 /nfs/dbraw/zinc/23/46/58/1127234658.db2.gz WXMROMAMCYGVLS-UHFFFAOYSA-N 1 0 298.342 3.697 20 5 CHBDRO CC(C)CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000045751752 1127293116 /nfs/dbraw/zinc/29/31/16/1127293116.db2.gz OBLNIZOUPPRPQO-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[C@H](F)C1)CCCC2 ZINC000591348165 1127299150 /nfs/dbraw/zinc/29/91/50/1127299150.db2.gz AXBFKUZLDQVIRO-HEHGZKQESA-N 1 0 292.354 3.843 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@H](C)C1 ZINC000355108026 1127317421 /nfs/dbraw/zinc/31/74/21/1127317421.db2.gz KBYJZIVHXZCVIQ-WDEREUQCSA-N 1 0 268.382 3.524 20 5 CHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CC(F)F ZINC000592373065 1127343791 /nfs/dbraw/zinc/34/37/91/1127343791.db2.gz SKJAVNXADXMGRZ-QMMMGPOBSA-N 1 0 292.713 3.629 20 5 CHBDRO CC(C)C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000592387573 1127346017 /nfs/dbraw/zinc/34/60/17/1127346017.db2.gz SMELYGCMQLHKBF-MRXNPFEDSA-N 1 0 299.374 3.867 20 5 CHBDRO CC(C)C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000592387572 1127346468 /nfs/dbraw/zinc/34/64/68/1127346468.db2.gz SMELYGCMQLHKBF-INIZCTEOSA-N 1 0 299.374 3.867 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000592396582 1127373905 /nfs/dbraw/zinc/37/39/05/1127373905.db2.gz BPTJRADHWHXWQW-DTZQCDIJSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@H]([NH2+]C1CC2(CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000593182842 1127378373 /nfs/dbraw/zinc/37/83/73/1127378373.db2.gz GVGRGNMBXJYZQM-LLVKDONJSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000358351839 1127417048 /nfs/dbraw/zinc/41/70/48/1127417048.db2.gz LLTPHQRRRHOFBO-YVEFUNNKSA-N 1 0 297.358 3.792 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC2(CC2)CC1 ZINC000761062769 1127415878 /nfs/dbraw/zinc/41/58/78/1127415878.db2.gz PDNNXJUEDIXMRY-UHFFFAOYSA-N 1 0 280.755 3.624 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CC1CCC(F)CC1 ZINC000594507757 1127418852 /nfs/dbraw/zinc/41/88/52/1127418852.db2.gz QWMOUUSUTKLEKQ-QOZQQMKHSA-N 1 0 292.354 3.700 20 5 CHBDRO C[C@@H]([NH2+][C@H]1C[C@H](OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000594514170 1127420550 /nfs/dbraw/zinc/42/05/50/1127420550.db2.gz HMVHYEVGZCUNDB-UXIGCNINSA-N 1 0 292.379 3.592 20 5 CHBDRO CC1(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000358984823 1127442317 /nfs/dbraw/zinc/44/23/17/1127442317.db2.gz LIHCKIGYGNBRJO-HNNXBMFYSA-N 1 0 274.364 3.752 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2(C(F)F)CC2)cccc1[N+](=O)[O-] ZINC000359006566 1127444430 /nfs/dbraw/zinc/44/44/30/1127444430.db2.gz XTVBIZONNMBMKZ-JTQLQIEISA-N 1 0 284.306 3.599 20 5 CHBDRO CCOC1CCC([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595004571 1127445152 /nfs/dbraw/zinc/44/51/52/1127445152.db2.gz BRAYALOHRLYYOU-YGONEPDPSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCC23CC3)c(Cl)c1 ZINC000595034457 1127449243 /nfs/dbraw/zinc/44/92/43/1127449243.db2.gz ZYTRGDOWPJAYDS-CYBMUJFWSA-N 1 0 280.755 3.671 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)C(C)(C)C(F)F)cccc1[N+](=O)[O-] ZINC000595041410 1127450747 /nfs/dbraw/zinc/45/07/47/1127450747.db2.gz PTSXUIILBLAESA-JTQLQIEISA-N 1 0 286.322 3.673 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)c1ccccn1 ZINC000595051996 1127451091 /nfs/dbraw/zinc/45/10/91/1127451091.db2.gz ZZERNHVODBFYAP-KBPBESRZSA-N 1 0 299.374 3.753 20 5 CHBDRO CCSC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595102082 1127452612 /nfs/dbraw/zinc/45/26/12/1127452612.db2.gz ZWWKSYLJYPSKSN-LLVKDONJSA-N 1 0 280.393 3.531 20 5 CHBDRO CC[C@@H]([NH2+]CCc1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000595075169 1127453120 /nfs/dbraw/zinc/45/31/20/1127453120.db2.gz WPCALVGCEADOLX-QGZVFWFLSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@]2(C)CC2(F)F)cccc1[N+](=O)[O-] ZINC000595080032 1127453635 /nfs/dbraw/zinc/45/36/35/1127453635.db2.gz NLMMJTWTNLOLFY-GWCFXTLKSA-N 1 0 284.306 3.599 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2=CCCC2)cccc1[N+](=O)[O-] ZINC000595096356 1127455343 /nfs/dbraw/zinc/45/53/43/1127455343.db2.gz JXHWICUCUWNFOR-GFCCVEGCSA-N 1 0 260.337 3.664 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)cc1[N+](=O)[O-] ZINC000595095003 1127455562 /nfs/dbraw/zinc/45/55/62/1127455562.db2.gz SNBSGQRRBXBVAH-GWCFXTLKSA-N 1 0 298.333 3.845 20 5 CHBDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359293517 1127456857 /nfs/dbraw/zinc/45/68/57/1127456857.db2.gz FPFTUFGXWWVTIJ-XJKSGUPXSA-N 1 0 274.364 3.607 20 5 CHBDRO CC[C@H](C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])CC(F)F ZINC000595423309 1127462361 /nfs/dbraw/zinc/46/23/61/1127462361.db2.gz NFJHIDPSRXAJST-MNOVXSKESA-N 1 0 286.322 3.927 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1C[C@@H]2CCCC[C@@H]21 ZINC000595566805 1127465617 /nfs/dbraw/zinc/46/56/17/1127465617.db2.gz NXIZQZDLEMLLPS-GWCFXTLKSA-N 1 0 280.755 3.623 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000595822337 1127476573 /nfs/dbraw/zinc/47/65/73/1127476573.db2.gz RCNRLOYSOTXNIH-DCBWTQNWSA-N 1 0 280.343 3.601 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC23CC3)cc1[N+](=O)[O-] ZINC000597059370 1127526632 /nfs/dbraw/zinc/52/66/32/1127526632.db2.gz JTPJIEZLOMQVIE-SWLSCSKDSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1ccncc1C[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000361434022 1127563310 /nfs/dbraw/zinc/56/33/10/1127563310.db2.gz KKHJNCFRIKMZFT-CQSZACIVSA-N 1 0 299.374 3.800 20 5 CHBDRO CC(C)C(C)(C)C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602628044 1127600449 /nfs/dbraw/zinc/60/04/49/1127600449.db2.gz GRZBEOIOPSSOEL-UHFFFAOYSA-N 1 0 291.351 3.508 20 5 CHBDRO COC[C@@H](CC(C)(C)C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000593585343 1127629901 /nfs/dbraw/zinc/62/99/01/1127629901.db2.gz GGFHHVCZWFWPLZ-TZMCWYRMSA-N 1 0 294.395 3.697 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000061030268 1127636519 /nfs/dbraw/zinc/63/65/19/1127636519.db2.gz KHJCMLBAMCXPDL-LLVKDONJSA-N 1 0 262.353 3.606 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CC1CCCCC1 ZINC000603491034 1127652984 /nfs/dbraw/zinc/65/29/84/1127652984.db2.gz XGTBDVQHNLBJCW-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CC=CC1 ZINC000598991679 1127650393 /nfs/dbraw/zinc/65/03/93/1127650393.db2.gz ANSPWDMOGPNVDD-UKTHLTGXSA-N 1 0 272.348 3.554 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000593674233 1127655990 /nfs/dbraw/zinc/65/59/90/1127655990.db2.gz WFQZNZVKSFLCPT-UHFFFAOYSA-N 1 0 296.317 3.524 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCCC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000599093069 1127657194 /nfs/dbraw/zinc/65/71/94/1127657194.db2.gz USXZJXZPDTWELJ-OCCSQVGLSA-N 1 0 274.364 3.826 20 5 CHBDRO CC[N@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000603852337 1127676705 /nfs/dbraw/zinc/67/67/05/1127676705.db2.gz UEHUXHWSBPQQDL-UHFFFAOYSA-N 1 0 284.359 3.659 20 5 CHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000603873872 1127679543 /nfs/dbraw/zinc/67/95/43/1127679543.db2.gz JAXMJRSVWSNIIP-CZUORRHYSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCC(C)(F)F)cccc1[N+](=O)[O-] ZINC000297311637 1127693276 /nfs/dbraw/zinc/69/32/76/1127693276.db2.gz MWPPCCJNZMDHCH-SNVBAGLBSA-N 1 0 272.295 3.599 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000297338904 1127693936 /nfs/dbraw/zinc/69/39/36/1127693936.db2.gz OJXFOHCZPMFTAZ-SMDDNHRTSA-N 1 0 260.337 3.578 20 5 CHBDRO CC1CC[NH+](CCCCNc2ccsc2[N+](=O)[O-])CC1 ZINC000604433538 1127705780 /nfs/dbraw/zinc/70/57/80/1127705780.db2.gz XLJJSYJDLWTJDC-UHFFFAOYSA-N 1 0 297.424 3.580 20 5 CHBDRO Cc1cccc(C(C)(C)C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000604532729 1127709487 /nfs/dbraw/zinc/70/94/87/1127709487.db2.gz YQOYWPLCFGPCBS-UHFFFAOYSA-N 1 0 298.386 3.971 20 5 CHBDRO C[C@H]1CC[C@@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000230417774 1127753818 /nfs/dbraw/zinc/75/38/18/1127753818.db2.gz QXAQJMFPQQRXDS-WDEREUQCSA-N 1 0 282.771 3.774 20 5 CHBDRO C[C@H]1CCC[C@H]1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000230672714 1127770770 /nfs/dbraw/zinc/77/07/70/1127770770.db2.gz QEPMIIYCXQPYFS-QWRGUYRKSA-N 1 0 282.771 3.774 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]Cc1ccc(Cl)o1 ZINC000608835474 1127889410 /nfs/dbraw/zinc/88/94/10/1127889410.db2.gz KMGMIDJHZULZHQ-HYXAFXHYSA-N 1 0 292.722 3.644 20 5 CHBDRO CC(C)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000232541233 1127895877 /nfs/dbraw/zinc/89/58/77/1127895877.db2.gz VMIFNWPFDPUDJQ-UHFFFAOYSA-N 1 0 280.343 3.602 20 5 CHBDRO Cc1ccc(C[N@H+]2C[C@H](C)CC2(C)C)cc1[N+](=O)[O-] ZINC000539828082 1127945669 /nfs/dbraw/zinc/94/56/69/1127945669.db2.gz GIIBXRHRXIBZPT-LLVKDONJSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@H]1CC=CCC1 ZINC000544116847 1127958968 /nfs/dbraw/zinc/95/89/68/1127958968.db2.gz KKGCFDFTKBKRJQ-KGLIPLIRSA-N 1 0 274.364 3.944 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000540165117 1127966414 /nfs/dbraw/zinc/96/64/14/1127966414.db2.gz VPZQEOCOCHIWCW-JQWIXIFHSA-N 1 0 284.306 3.823 20 5 CHBDRO CC[C@@]1(C)CC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468138130 1127994784 /nfs/dbraw/zinc/99/47/84/1127994784.db2.gz KHUBSAJGCZYWAD-DOMZBBRYSA-N 1 0 262.353 3.778 20 5 CHBDRO CCC(CC)[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)C1CC1 ZINC000540910831 1128000733 /nfs/dbraw/zinc/00/07/33/1128000733.db2.gz BNYABPSZMAGOGZ-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO CS[C@H](C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000541381533 1128021109 /nfs/dbraw/zinc/02/11/09/1128021109.db2.gz OXZQAQIOEQDZGP-CQSZACIVSA-N 1 0 296.436 3.771 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCC1=CCCCC1 ZINC000541772001 1128038863 /nfs/dbraw/zinc/03/88/63/1128038863.db2.gz UEUYEFHVHBOLOS-UHFFFAOYSA-N 1 0 274.364 3.883 20 5 CHBDRO CCCC[N@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470176658 1128063641 /nfs/dbraw/zinc/06/36/41/1128063641.db2.gz XUOGSYODSJADPD-JLHYYAGUSA-N 1 0 262.353 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)C[C@@H]1C ZINC000470178875 1128065244 /nfs/dbraw/zinc/06/52/44/1128065244.db2.gz PDVKLXBYYFDULY-SUHDFKPZSA-N 1 0 274.364 3.728 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@H](C)C[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492629933 1128106257 /nfs/dbraw/zinc/10/62/57/1128106257.db2.gz KZSJRYOLCYNSFO-TZMCWYRMSA-N 1 0 292.379 3.614 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000492819598 1128113555 /nfs/dbraw/zinc/11/35/55/1128113555.db2.gz SUCSYSFSGVQXCY-ZDUSSCGKSA-N 1 0 292.379 3.616 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524284 1128132272 /nfs/dbraw/zinc/13/22/72/1128132272.db2.gz ZNQMZTONZNJEKX-VHSXEESVSA-N 1 0 270.760 3.772 20 5 CHBDRO CCCC[N@H+](CC)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761509956 1128132356 /nfs/dbraw/zinc/13/23/56/1128132356.db2.gz DSFDEDWNSCDNFP-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO CCC(CC)C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761523548 1128132520 /nfs/dbraw/zinc/13/25/20/1128132520.db2.gz UUOVVMZHLWCZKW-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493333131 1128138342 /nfs/dbraw/zinc/13/83/42/1128138342.db2.gz FDFYXFKACJATAB-ZDUSSCGKSA-N 1 0 282.771 3.869 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000054467487 1128177597 /nfs/dbraw/zinc/17/75/97/1128177597.db2.gz NOYRQVVVZBPFJK-BXUZGUMPSA-N 1 0 250.342 3.682 20 5 CHBDRO CC(C)[N@@H+](Cc1csc([N+](=O)[O-])c1)CC1CCC1 ZINC000193209146 1128242759 /nfs/dbraw/zinc/24/27/59/1128242759.db2.gz ZPVHPDGLEFGBGU-UHFFFAOYSA-N 1 0 268.382 3.667 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000495425363 1128282172 /nfs/dbraw/zinc/28/21/72/1128282172.db2.gz AFIPJQWJFVEKNS-NSHDSACASA-N 1 0 296.798 3.959 20 5 CHBDRO C[C@H](CSC(C)(C)C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000089513211 1128298014 /nfs/dbraw/zinc/29/80/14/1128298014.db2.gz BULRRQMYUJMJEL-LLVKDONJSA-N 1 0 282.409 3.605 20 5 CHBDRO CC(F)(F)CCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000930060235 1128298792 /nfs/dbraw/zinc/29/87/92/1128298792.db2.gz IABFXZJNZSWEGP-UHFFFAOYSA-N 1 0 298.333 3.995 20 5 CHBDRO Cc1ccsc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000094879638 1128325013 /nfs/dbraw/zinc/32/50/13/1128325013.db2.gz FZTCGHVIRSVLBN-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO CC[N@H+](Cc1ccncc1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000272507327 1128350169 /nfs/dbraw/zinc/35/01/69/1128350169.db2.gz OJLISWCLDGJXFC-AWEZNQCLSA-N 1 0 299.374 3.881 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])C(C)(C)C ZINC000917099011 1128479199 /nfs/dbraw/zinc/47/91/99/1128479199.db2.gz ZYXGRPFQRXPGRB-SNVBAGLBSA-N 1 0 268.332 3.600 20 5 CHBDRO CC1=CC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000556253251 1128569359 /nfs/dbraw/zinc/56/93/59/1128569359.db2.gz NNYFNGJWSHDARA-AWEZNQCLSA-N 1 0 294.782 3.879 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000556958666 1128651932 /nfs/dbraw/zinc/65/19/32/1128651932.db2.gz JZJFWKVQMFEKTO-UJAVWCLSSA-N 1 0 286.375 3.730 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000575010874 1128665761 /nfs/dbraw/zinc/66/57/61/1128665761.db2.gz DXGKCDLXVHPPNF-WCQYABFASA-N 1 0 292.379 3.690 20 5 CHBDRO CC1(C)C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@H]2CCC[C@@H]21 ZINC000557055459 1128664374 /nfs/dbraw/zinc/66/43/74/1128664374.db2.gz NEUDQBYXNCUSSX-RYUDHWBXSA-N 1 0 280.393 3.667 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CC2(C3CC3)CC2)c1 ZINC000130716100 1128684727 /nfs/dbraw/zinc/68/47/27/1128684727.db2.gz XHLLDHGHNRUJPV-UHFFFAOYSA-N 1 0 280.755 3.528 20 5 CHBDRO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000601298374 1128708985 /nfs/dbraw/zinc/70/89/85/1128708985.db2.gz NONYPILWYBUWQD-NXEZZACHSA-N 1 0 291.376 3.772 20 5 CHBDRO O=[N+]([O-])c1ccc(CNc2cc[nH+]c3cc(F)ccc23)cc1 ZINC000301244611 1128740654 /nfs/dbraw/zinc/74/06/54/1128740654.db2.gz HCQVSZUWBSSUKB-UHFFFAOYSA-N 1 0 297.289 3.894 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](C)CCC[C@H]1C ZINC000610215384 1117882221 /nfs/dbraw/zinc/88/22/21/1117882221.db2.gz KQEVFCWLXABPRH-CHWSQXEVSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1cc(NC[C@H](C)[N@@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000510095999 1117882361 /nfs/dbraw/zinc/88/23/61/1117882361.db2.gz VQUJWRPEDIFWKW-KBPBESRZSA-N 1 0 291.395 3.578 20 5 CHBDRO Cc1c(C[N@H+]2Cc3ccccc3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000610216315 1117883793 /nfs/dbraw/zinc/88/37/93/1117883793.db2.gz LJMFGEIPDJZBLL-ZDUSSCGKSA-N 1 0 296.370 3.850 20 5 CHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001307686304 1117928655 /nfs/dbraw/zinc/92/86/55/1117928655.db2.gz SPJRODKFXSNRBZ-ZUZCIYMTSA-N 1 0 298.333 3.884 20 5 CHBDRO Cc1c(COc2ccc([C@@H](C)[NH3+])cc2)cccc1[N+](=O)[O-] ZINC000037697593 1128747509 /nfs/dbraw/zinc/74/75/09/1128747509.db2.gz MEVLARHDHXOSAN-GFCCVEGCSA-N 1 0 286.331 3.502 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CCC1)CCCC2 ZINC000579571128 1128752683 /nfs/dbraw/zinc/75/26/83/1128752683.db2.gz DZBKNVOOHOPAGJ-OAHLLOKOSA-N 1 0 260.337 3.504 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](c2ccccc2)C2CC2)cc1 ZINC000578458968 1118093976 /nfs/dbraw/zinc/09/39/76/1118093976.db2.gz UCCNAEHZJWMQPO-GOSISDBHSA-N 1 0 296.370 3.878 20 5 CHBDRO Cc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)CO2 ZINC000130747423 1118194837 /nfs/dbraw/zinc/19/48/37/1118194837.db2.gz QENKVXICCJCTAM-LRDDRELGSA-N 1 0 298.342 3.688 20 5 CHBDRO CC(C)C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)C ZINC000083168427 1118243175 /nfs/dbraw/zinc/24/31/75/1118243175.db2.gz NNLSIHRALJNHMY-UHFFFAOYSA-N 1 0 291.351 3.602 20 5 CHBDRO CC[N@H+](CCc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000058506541 1118289800 /nfs/dbraw/zinc/28/98/00/1118289800.db2.gz ZTMGFYARAKXIOJ-UHFFFAOYSA-N 1 0 284.359 3.659 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccsc1 ZINC000122969134 1118299386 /nfs/dbraw/zinc/29/93/86/1118299386.db2.gz IILNRIAINBVWQH-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO O[C@@H]1CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000179950748 1128768564 /nfs/dbraw/zinc/76/85/64/1128768564.db2.gz OTBAFWFIUQXIGJ-MRXNPFEDSA-N 1 0 277.367 3.560 20 5 CHBDRO Cc1ccsc1[C@H](C)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000090910145 1118332861 /nfs/dbraw/zinc/33/28/61/1118332861.db2.gz LUVCOLXLWCFRQT-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)Cc2cccs2)cccc1[N+](=O)[O-] ZINC000071270534 1118459623 /nfs/dbraw/zinc/45/96/23/1118459623.db2.gz VVMILDZJNBYKOQ-LLVKDONJSA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCCCOC(C)C)cccc1[N+](=O)[O-] ZINC000180452888 1128793802 /nfs/dbraw/zinc/79/38/02/1128793802.db2.gz LOWSGFYOSCQNNQ-AWEZNQCLSA-N 1 0 294.395 3.759 20 5 CHBDRO CC[C@@H]([NH2+]C1CC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000395286462 1118710048 /nfs/dbraw/zinc/71/00/48/1118710048.db2.gz HAUZJSOKYIMWAZ-CQSZACIVSA-N 1 0 262.353 3.824 20 5 CHBDRO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CC1CC1 ZINC000051281346 1118727232 /nfs/dbraw/zinc/72/72/32/1118727232.db2.gz NUTQGBMEEBOEHM-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510793868 1118817713 /nfs/dbraw/zinc/81/77/13/1118817713.db2.gz DPCDAUSSYOJSCI-OTYXRUKQSA-N 1 0 284.306 3.541 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@@H]1CC=CCC1 ZINC000084439974 1118943566 /nfs/dbraw/zinc/94/35/66/1118943566.db2.gz UOSUFZGQWFUZTO-LLVKDONJSA-N 1 0 280.755 3.694 20 5 CHBDRO Cc1ccc(C[NH2+]C2C[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000084461552 1118944618 /nfs/dbraw/zinc/94/46/18/1118944618.db2.gz ABHNGAMRMJGVDQ-RYUDHWBXSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000538721391 1118950630 /nfs/dbraw/zinc/95/06/30/1118950630.db2.gz HDUIRMNEEQAXLZ-KRWDZBQOSA-N 1 0 296.370 3.720 20 5 CHBDRO CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000065533558 1118964881 /nfs/dbraw/zinc/96/48/81/1118964881.db2.gz CYHWURBHFKVNDL-UHFFFAOYSA-N 1 0 292.379 3.628 20 5 CHBDRO C[C@@H](c1ccccc1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000071951766 1118978048 /nfs/dbraw/zinc/97/80/48/1118978048.db2.gz JWKHAXNWBUZZEV-AWEZNQCLSA-N 1 0 284.359 3.830 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)Cc1cccnc1 ZINC000934234775 1118985106 /nfs/dbraw/zinc/98/51/06/1118985106.db2.gz QOMDWMUODUMWJR-ZIAGYGMSSA-N 1 0 299.374 3.580 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@H+](Cc2ccccc2)C2CC2)cc1 ZINC000071969019 1118987987 /nfs/dbraw/zinc/98/79/87/1118987987.db2.gz RMXIBQUJIDTDSF-UHFFFAOYSA-N 1 0 296.370 3.802 20 5 CHBDRO C[C@@H](c1ccccc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511062925 1118996383 /nfs/dbraw/zinc/99/63/83/1118996383.db2.gz FSMDNCDQMHKILI-AWEZNQCLSA-N 1 0 284.359 3.830 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCSC(C)C)cccc1[N+](=O)[O-] ZINC000562066653 1119098588 /nfs/dbraw/zinc/09/85/88/1119098588.db2.gz WVYBULGDYYYNHA-GFCCVEGCSA-N 1 0 282.409 3.695 20 5 CHBDRO CC(C)[C@H](C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479577611 1119124739 /nfs/dbraw/zinc/12/47/39/1119124739.db2.gz JFUHQOMBNNBILO-LBPRGKRZSA-N 1 0 262.353 3.604 20 5 CHBDRO Cc1c(C[NH2+]C2(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000077379078 1119145381 /nfs/dbraw/zinc/14/53/81/1119145381.db2.gz ANRIPMXBLWRUTN-UHFFFAOYSA-N 1 0 282.343 3.682 20 5 CHBDRO Cc1cccc(C)c1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001167647598 1119272898 /nfs/dbraw/zinc/27/28/98/1119272898.db2.gz MVWLIINWPUTFPA-UHFFFAOYSA-N 1 0 296.370 3.770 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC000611802030 1119467084 /nfs/dbraw/zinc/46/70/84/1119467084.db2.gz GDUASRAUCDUJMM-LALPHHSUSA-N 1 0 292.354 3.744 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CCC[C@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000340521607 1119492502 /nfs/dbraw/zinc/49/25/02/1119492502.db2.gz ARSKLKJTAZNXCQ-ILXRZTDVSA-N 1 0 280.343 3.916 20 5 CHBDRO CC[C@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)CC(F)(F)F ZINC000402715380 1119640347 /nfs/dbraw/zinc/64/03/47/1119640347.db2.gz VWOVPSATNYYBNN-QMMMGPOBSA-N 1 0 296.314 3.725 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)cccc1[N+](=O)[O-] ZINC000414211982 1119941795 /nfs/dbraw/zinc/94/17/95/1119941795.db2.gz PJIPWFBKRCOSFT-MYZSUADSSA-N 1 0 274.364 3.742 20 5 CHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1CC1 ZINC000122912978 1120049721 /nfs/dbraw/zinc/04/97/21/1120049721.db2.gz LBYWUCLWTOGLBP-UHFFFAOYSA-N 1 0 286.331 3.697 20 5 CHBDRO CC[C@@H](C[C@](C)(O)CC)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000926893194 1120204166 /nfs/dbraw/zinc/20/41/66/1120204166.db2.gz QTZPEUOMVSHDPM-IVMMDQJWSA-N 1 0 294.395 3.575 20 5 CHBDRO CC(C)[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCC1 ZINC000255625845 1120388051 /nfs/dbraw/zinc/38/80/51/1120388051.db2.gz SWLWBPKGRGHPDW-VURMDHGXSA-N 1 0 274.364 3.871 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccc(C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000161613575 1120403726 /nfs/dbraw/zinc/40/37/26/1120403726.db2.gz IDYHLYMNYWPCRX-KRWDZBQOSA-N 1 0 299.374 3.582 20 5 CHBDRO CS[C@@H](C)C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417314233 1120425678 /nfs/dbraw/zinc/42/56/78/1120425678.db2.gz YKWPVGRTVAQJTE-NHYWBVRUSA-N 1 0 294.420 3.703 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCCCc1ccccc1 ZINC000131014429 1120458436 /nfs/dbraw/zinc/45/84/36/1120458436.db2.gz LJRFJYDLEUWLDK-UHFFFAOYSA-N 1 0 284.359 3.707 20 5 CHBDRO C[N@H+](CCCNc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000037859949 1120497564 /nfs/dbraw/zinc/49/75/64/1120497564.db2.gz DBGANYYVRITWDE-UHFFFAOYSA-N 1 0 291.395 3.661 20 5 CHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000123138264 1120521844 /nfs/dbraw/zinc/52/18/44/1120521844.db2.gz FMTDOJASACFNIR-RCBQFDQVSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000091900463 1120535971 /nfs/dbraw/zinc/53/59/71/1120535971.db2.gz FGRJEUNFBZTVSL-GFCCVEGCSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@H](C1CC1)[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000092009426 1120537839 /nfs/dbraw/zinc/53/78/39/1120537839.db2.gz PCIALLMDNUDLTL-DIECRNLCSA-N 1 0 286.375 3.871 20 5 CHBDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000508992805 1120578286 /nfs/dbraw/zinc/57/82/86/1120578286.db2.gz BSKZILMATMIKQE-SWLSCSKDSA-N 1 0 294.395 3.697 20 5 CHBDRO CCC[C@@H](C)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000555339629 1120583284 /nfs/dbraw/zinc/58/32/84/1120583284.db2.gz DAEDSPRLQKFMLU-CYBMUJFWSA-N 1 0 264.369 3.505 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCSC3(CCC3)C2)cs1 ZINC000922842988 1120609811 /nfs/dbraw/zinc/60/98/11/1120609811.db2.gz RQRZWIUTXCKYEK-LLVKDONJSA-N 1 0 298.433 3.564 20 5 CHBDRO CC[C@@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000302073636 1120648855 /nfs/dbraw/zinc/64/88/55/1120648855.db2.gz HTKLLEXQPBTZGR-GFCCVEGCSA-N 1 0 285.347 3.688 20 5 CHBDRO C[C@H](c1ccncc1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350357665 1120650750 /nfs/dbraw/zinc/65/07/50/1120650750.db2.gz OZYXHTYTCBKHLD-BRLPQQTGSA-N 1 0 297.358 3.696 20 5 CHBDRO CCCC[NH+]1CCC(Nc2cccc(C)c2[N+](=O)[O-])CC1 ZINC000302486505 1120652664 /nfs/dbraw/zinc/65/26/64/1120652664.db2.gz IHZLNMNCSFSIMC-UHFFFAOYSA-N 1 0 291.395 3.580 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(C(F)F)cc2)cc1 ZINC000131359364 1120656333 /nfs/dbraw/zinc/65/63/33/1120656333.db2.gz XCDTXQLMLMWWMG-UHFFFAOYSA-N 1 0 292.285 3.822 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000511855393 1120665609 /nfs/dbraw/zinc/66/56/09/1120665609.db2.gz OAPZQBQDEIWROY-PCKHISNJSA-N 1 0 286.375 3.873 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2cccc(Cl)c2)c1 ZINC000048408838 1120817955 /nfs/dbraw/zinc/81/79/55/1120817955.db2.gz AYXGEKBXHVWSRD-UHFFFAOYSA-N 1 0 276.723 3.538 20 5 CHBDRO Cc1cccc(CC[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000051668570 1120967626 /nfs/dbraw/zinc/96/76/26/1120967626.db2.gz AMHVQSDOQVYXLS-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000300409914 1120988862 /nfs/dbraw/zinc/98/88/62/1120988862.db2.gz CKTSNSINEHMNDS-MRVWCRGKSA-N 1 0 294.420 3.838 20 5 CHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC001174781596 1121028602 /nfs/dbraw/zinc/02/86/02/1121028602.db2.gz WPIZVLJSFZGEFJ-GXTWGEPZSA-N 1 0 292.379 3.756 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(CCC2)C1 ZINC000344210032 1121120534 /nfs/dbraw/zinc/12/05/34/1121120534.db2.gz CTUFJQZFWAGXOG-LBPRGKRZSA-N 1 0 260.337 3.532 20 5 CHBDRO C[C@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000512178392 1121141891 /nfs/dbraw/zinc/14/18/91/1121141891.db2.gz ILQNTWSNVKUJGR-GPAKFWEMSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C=C\C[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001175043991 1121157301 /nfs/dbraw/zinc/15/73/01/1121157301.db2.gz AYAJJOMMZZCGOK-YPQKKHBXSA-N 1 0 288.391 3.816 20 5 CHBDRO CC(C)C[NH+](CCc1ccc([N+](=O)[O-])cc1)CC(C)C ZINC000001666767 1121227281 /nfs/dbraw/zinc/22/72/81/1121227281.db2.gz APFPFHLRMFQGRR-UHFFFAOYSA-N 1 0 278.396 3.751 20 5 CHBDRO CC(C)C[C@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000500501390 1121289070 /nfs/dbraw/zinc/28/90/70/1121289070.db2.gz MCVMNUGCPVMWGQ-MRXNPFEDSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000042859094 1121317856 /nfs/dbraw/zinc/31/78/56/1121317856.db2.gz QUGUZSQRSDJNOX-DOMZBBRYSA-N 1 0 276.380 3.819 20 5 CHBDRO CCC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000500617963 1121325999 /nfs/dbraw/zinc/32/59/99/1121325999.db2.gz NPLSXYVEZMQSII-HNNXBMFYSA-N 1 0 299.374 3.663 20 5 CHBDRO CC[C@@H]([NH2+]CC[C@@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000704774870 1121367680 /nfs/dbraw/zinc/36/76/80/1121367680.db2.gz ZYUBZMPCAHWNTD-IUODEOHRSA-N 1 0 294.420 3.779 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H]2C2CC2)c1 ZINC000706881205 1121443412 /nfs/dbraw/zinc/44/34/12/1121443412.db2.gz BHAJKDVPGGBIFU-AWEZNQCLSA-N 1 0 280.755 3.623 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000512622155 1121496108 /nfs/dbraw/zinc/49/61/08/1121496108.db2.gz JRJCEUDGROMYBL-HNNXBMFYSA-N 1 0 274.364 3.668 20 5 CHBDRO C[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@@H]1C ZINC000512647835 1121506218 /nfs/dbraw/zinc/50/62/18/1121506218.db2.gz HTGBOAZWEOWWIW-VAIDBEGPSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1ccc(C)c(CN(C)Cc2csc([N+](=O)[O-])c2)c1 ZINC000429289891 1121511387 /nfs/dbraw/zinc/51/13/87/1121511387.db2.gz FHJXUHZRUOBZMV-UHFFFAOYSA-N 1 0 290.388 3.905 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543632630 1121539298 /nfs/dbraw/zinc/53/92/98/1121539298.db2.gz VQJNKWRJWXBSNK-GFCCVEGCSA-N 1 0 250.342 3.524 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[NH+]1C2CCCC1CCC2 ZINC000619531579 1128994469 /nfs/dbraw/zinc/99/44/69/1128994469.db2.gz FWYIBMWHWIGRQI-UHFFFAOYSA-N 1 0 290.363 3.510 20 5 CHBDRO CC1(C)C[C@H]([NH2+]CC2CCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433174292 1121606510 /nfs/dbraw/zinc/60/65/10/1121606510.db2.gz MRUQLBCEANDOMF-HNNXBMFYSA-N 1 0 274.364 3.707 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CSC[C@H]2C)cc1[N+](=O)[O-] ZINC000512863083 1121623997 /nfs/dbraw/zinc/62/39/97/1121623997.db2.gz ZIYVCGBLVMDEBI-BXUZGUMPSA-N 1 0 294.420 3.559 20 5 CHBDRO CSC[C@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433263784 1121633069 /nfs/dbraw/zinc/63/30/69/1121633069.db2.gz WXCAFJWKTNGPRB-IINYFYTJSA-N 1 0 294.420 3.658 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000611293075 1121635131 /nfs/dbraw/zinc/63/51/31/1121635131.db2.gz AEOMFMCUDYEGIZ-VSKVDJIOSA-N 1 0 297.358 3.662 20 5 CHBDRO CO[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000611337060 1121638143 /nfs/dbraw/zinc/63/81/43/1121638143.db2.gz KNYLHSSKJBBKBB-VHDGCEQUSA-N 1 0 292.379 3.511 20 5 CHBDRO CS[C@H](C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433297414 1121642612 /nfs/dbraw/zinc/64/26/12/1121642612.db2.gz LEJUUTNMUCOBDB-QMTHXVAHSA-N 1 0 294.420 3.658 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000611408977 1121645271 /nfs/dbraw/zinc/64/52/71/1121645271.db2.gz PUGGAUVNYQYYHJ-HBYGRHMLSA-N 1 0 280.343 3.648 20 5 CHBDRO COc1ccc(C[NH2+][C@@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000052338183 1121703458 /nfs/dbraw/zinc/70/34/58/1121703458.db2.gz DSAYZOHUTPYJME-LBPRGKRZSA-N 1 0 292.379 3.662 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)C1CCCCC1 ZINC000052338165 1121703685 /nfs/dbraw/zinc/70/36/85/1121703685.db2.gz MPCUDZOQIYGOEO-GFCCVEGCSA-N 1 0 292.379 3.662 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H]1CC[C@H](C)O1)c1cccc([N+](=O)[O-])c1 ZINC000398103844 1121708330 /nfs/dbraw/zinc/70/83/30/1121708330.db2.gz YMTGNGUBTZSOTD-MAZHCROVSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C/C=C\c2cccc(F)c2)cc1 ZINC001177415824 1121729267 /nfs/dbraw/zinc/72/92/67/1121729267.db2.gz BPOVBAVPKOKZBR-RQOWECAXSA-N 1 0 286.306 3.537 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCCC(F)F)C1CC1 ZINC001119540921 1121799632 /nfs/dbraw/zinc/79/96/32/1121799632.db2.gz LPSCMHXHYWEWSN-CYBMUJFWSA-N 1 0 298.333 3.551 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C1CC1 ZINC001179173012 1121858537 /nfs/dbraw/zinc/85/85/37/1121858537.db2.gz FTBKAHMNGANUMF-HNNXBMFYSA-N 1 0 276.380 3.996 20 5 CHBDRO Cc1c(CNc2ccc3c([nH+]2)CCCC3)cccc1[N+](=O)[O-] ZINC001179515941 1121883500 /nfs/dbraw/zinc/88/35/00/1121883500.db2.gz LXEVEBSJWJWCNH-UHFFFAOYSA-N 1 0 297.358 3.789 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000430034397 1121931478 /nfs/dbraw/zinc/93/14/78/1121931478.db2.gz JSXDZGPXDQXISU-OGOUPESXSA-N 1 0 296.317 3.633 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)CC1CCCC1 ZINC001179989552 1121935345 /nfs/dbraw/zinc/93/53/45/1121935345.db2.gz QYSMFUXZRGCUKT-UHFFFAOYSA-N 1 0 276.380 3.834 20 5 CHBDRO CCSCCC[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000502377925 1122077835 /nfs/dbraw/zinc/07/78/35/1122077835.db2.gz UMQGCVSXUVZLQR-CYBMUJFWSA-N 1 0 296.436 3.649 20 5 CHBDRO CC[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC001182951230 1122197250 /nfs/dbraw/zinc/19/72/50/1122197250.db2.gz ZJOKQWKLABIBJP-CQSZACIVSA-N 1 0 282.771 3.917 20 5 CHBDRO CC1=CC[C@H]([NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC001184046137 1122253905 /nfs/dbraw/zinc/25/39/05/1122253905.db2.gz UTRMQJPZMHXVTB-KBPBESRZSA-N 1 0 274.364 3.787 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCSC(C)(C)CC1 ZINC000434683733 1122395499 /nfs/dbraw/zinc/39/54/99/1122395499.db2.gz FOJRIOSABQBCEF-LBPRGKRZSA-N 1 0 294.420 3.873 20 5 CHBDRO CC(C)[C@H]1[N@H+](Cc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000430089033 1122398135 /nfs/dbraw/zinc/39/81/35/1122398135.db2.gz MIRFGJAHRXARGV-OAHLLOKOSA-N 1 0 274.364 3.605 20 5 CHBDRO CC(C)[C@@H]1[N@H+](Cc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000430089031 1122398168 /nfs/dbraw/zinc/39/81/68/1122398168.db2.gz MIRFGJAHRXARGV-HNNXBMFYSA-N 1 0 274.364 3.605 20 5 CHBDRO CC(C)CCN(Cc1c(F)cccc1[N+](=O)[O-])C1CC1 ZINC000505640921 1122446960 /nfs/dbraw/zinc/44/69/60/1122446960.db2.gz TVEHBLXVOUIUIU-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CC1CCCC1 ZINC000435418033 1122464640 /nfs/dbraw/zinc/46/46/40/1122464640.db2.gz WAKOQUQTGPKKEO-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)CCC[C@H]1C ZINC001191070301 1122568114 /nfs/dbraw/zinc/56/81/14/1122568114.db2.gz KCQGVHJGDCZCOV-QWHCGFSZSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1(C)CC1 ZINC000183570912 1129064443 /nfs/dbraw/zinc/06/44/43/1129064443.db2.gz XPIOHRNNMSYJDP-VIFPVBQESA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1(C)CC1 ZINC000183570925 1129064630 /nfs/dbraw/zinc/06/46/30/1129064630.db2.gz XPIOHRNNMSYJDP-SECBINFHSA-N 1 0 268.744 3.526 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000505898561 1122593604 /nfs/dbraw/zinc/59/36/04/1122593604.db2.gz PYZVJMBTYRURRV-OAHLLOKOSA-N 1 0 292.354 3.889 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000601289567 1122616293 /nfs/dbraw/zinc/61/62/93/1122616293.db2.gz PBIVQAXKBWZEGM-FZMZJTMJSA-N 1 0 260.337 3.578 20 5 CHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000438479335 1122702379 /nfs/dbraw/zinc/70/23/79/1122702379.db2.gz BVDWHKGJBIWPNN-GFCCVEGCSA-N 1 0 290.285 3.661 20 5 CHBDRO Cc1cc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000507132796 1122723859 /nfs/dbraw/zinc/72/38/59/1122723859.db2.gz PGIBRXWEHJHXEG-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CC=CCC1 ZINC000518562612 1122768844 /nfs/dbraw/zinc/76/88/44/1122768844.db2.gz MQLYIFKMUZHFFU-WFASDCNBSA-N 1 0 272.348 3.528 20 5 CHBDRO C=C/C=C\CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194478306 1122779116 /nfs/dbraw/zinc/77/91/16/1122779116.db2.gz SOJLVIKKRRBIBZ-MJSXRHKHSA-N 1 0 286.375 3.907 20 5 CHBDRO CCCC[C@H](C)[N@H+](CCCC)Cc1cn(C)nc1[N+](=O)[O-] ZINC001194570516 1122783925 /nfs/dbraw/zinc/78/39/25/1122783925.db2.gz KIPDMHIMENVJFK-ZDUSSCGKSA-N 1 0 296.415 3.509 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000140540544 1122817366 /nfs/dbraw/zinc/81/73/66/1122817366.db2.gz RNXJVFABCRIOFG-CQSZACIVSA-N 1 0 262.353 3.524 20 5 CHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000507117267 1122927194 /nfs/dbraw/zinc/92/71/94/1122927194.db2.gz PVHONFFAYVDKPS-UHFFFAOYSA-N 1 0 288.372 3.918 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2[nH]ccc21 ZINC000507158133 1122934247 /nfs/dbraw/zinc/93/42/47/1122934247.db2.gz ZNRSKLSOARKYJN-UHFFFAOYSA-N 1 0 295.342 3.708 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2CC(c3ccccc3)C2)c1 ZINC000052926170 1123061937 /nfs/dbraw/zinc/06/19/37/1123061937.db2.gz SWLBLNYZLRRNGG-UHFFFAOYSA-N 1 0 282.343 3.631 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)CC1 ZINC001201823227 1123153336 /nfs/dbraw/zinc/15/33/36/1123153336.db2.gz XJWRVPUSVISHLX-HIFRSBDPSA-N 1 0 276.380 3.696 20 5 CHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)C(C)(F)F ZINC000696553042 1123165293 /nfs/dbraw/zinc/16/52/93/1123165293.db2.gz ZGOMKIVFIYHHJP-UHFFFAOYSA-N 1 0 290.285 3.505 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1C=CCC1)CCCC2 ZINC000850505968 1123276075 /nfs/dbraw/zinc/27/60/75/1123276075.db2.gz ACTSBSMRVVIJKT-XJKSGUPXSA-N 1 0 272.348 3.671 20 5 CHBDRO CCCCC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000776579245 1123401217 /nfs/dbraw/zinc/40/12/17/1123401217.db2.gz KJCLTFYLNWCRKI-INIZCTEOSA-N 1 0 294.395 3.529 20 5 CHBDRO Cc1cccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000020526198 1123646606 /nfs/dbraw/zinc/64/66/06/1123646606.db2.gz LLGNYDBCZIMOIL-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CC2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000717905606 1129151652 /nfs/dbraw/zinc/15/16/52/1129151652.db2.gz ZAAIWFQQCMBVOI-LLVKDONJSA-N 1 0 260.337 3.578 20 5 CHBDRO C=Cc1ccc(CC[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC001202519105 1124001730 /nfs/dbraw/zinc/00/17/30/1124001730.db2.gz FGBFRHNDPVTPRL-UHFFFAOYSA-N 1 0 296.370 3.879 20 5 CHBDRO Cc1ccc(F)c(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000865788080 1124014111 /nfs/dbraw/zinc/01/41/11/1124014111.db2.gz YGEBRXROMXWSRO-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1ccsc1 ZINC000866233590 1124039996 /nfs/dbraw/zinc/03/99/96/1124039996.db2.gz WRHJHWJRPFYLIN-SNVBAGLBSA-N 1 0 294.351 3.516 20 5 CHBDRO COc1cc(C[N@H+](C)[C@@H]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000444665981 1124050630 /nfs/dbraw/zinc/05/06/30/1124050630.db2.gz QJQVGBUHZXBIHD-TZMCWYRMSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H](CCc1cccnc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000866365759 1124058131 /nfs/dbraw/zinc/05/81/31/1124058131.db2.gz WVJDGCACWDNSAX-KGLIPLIRSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CC2(CCC2)C1 ZINC000866383650 1124059897 /nfs/dbraw/zinc/05/98/97/1124059897.db2.gz AGAZYSCINULLIT-LLVKDONJSA-N 1 0 292.354 3.587 20 5 CHBDRO CC(C)[N@@H+](Cc1cccc([N+](=O)[O-])c1)CC1CCC1 ZINC000444765076 1124061529 /nfs/dbraw/zinc/06/15/29/1124061529.db2.gz HZTRQTFRXITCMW-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1CC(C)(C)C1 ZINC000526108415 1124507424 /nfs/dbraw/zinc/50/74/24/1124507424.db2.gz OKSTXFZBLBRDPD-ZDUSSCGKSA-N 1 0 290.407 3.942 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC2(F)F)CC1 ZINC000593077492 1124560784 /nfs/dbraw/zinc/56/07/84/1124560784.db2.gz RFJLKSGKNULHMV-NSHDSACASA-N 1 0 296.317 3.777 20 5 CHBDRO C[C@H](C[NH2+]Cc1cccn1C1CC1)c1ccccc1[N+](=O)[O-] ZINC001120248991 1131272503 /nfs/dbraw/zinc/27/25/03/1131272503.db2.gz DHUWWDKXSYBCOK-CYBMUJFWSA-N 1 0 299.374 3.625 20 5 CHBDRO CCC[C@@H](CC)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449130251 1124653018 /nfs/dbraw/zinc/65/30/18/1124653018.db2.gz GEQXFXUVBWUNFM-TZMCWYRMSA-N 1 0 264.369 3.694 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCCSC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872071921 1124674200 /nfs/dbraw/zinc/67/42/00/1124674200.db2.gz ZYEPXJPTWPXTIH-MNOVXSKESA-N 1 0 298.383 3.528 20 5 CHBDRO CC(C)C1([NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872074287 1124675228 /nfs/dbraw/zinc/67/52/28/1124675228.db2.gz WGFSZVLPZKVZMP-JTQLQIEISA-N 1 0 266.316 3.573 20 5 CHBDRO C[C@H]([NH2+]C1(C2CCC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872084383 1124678197 /nfs/dbraw/zinc/67/81/97/1124678197.db2.gz RPAVROGWLRRKKU-JTQLQIEISA-N 1 0 278.327 3.717 20 5 CHBDRO C[C@H]([NH2+]CCC(C)(C)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872085955 1124679765 /nfs/dbraw/zinc/67/97/65/1124679765.db2.gz RFFIYXAJKJJLAX-VIFPVBQESA-N 1 0 272.295 3.523 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC[C@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000872129508 1124690353 /nfs/dbraw/zinc/69/03/53/1124690353.db2.gz FTAKRJOYBMSPTR-TUAOUCFPSA-N 1 0 280.393 3.530 20 5 CHBDRO C[C@@H](CCC(F)(F)F)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872128252 1124690785 /nfs/dbraw/zinc/69/07/85/1124690785.db2.gz GSUZQAHKFKCUCU-UWVGGRQHSA-N 1 0 290.285 3.976 20 5 CHBDRO Cc1cc(C)c(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cn1 ZINC000873128962 1124738983 /nfs/dbraw/zinc/73/89/83/1124738983.db2.gz CTKZJTGCZMVMAM-UHFFFAOYSA-N 1 0 299.374 3.513 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C2(C)CC(F)(F)C2)cc1[N+](=O)[O-] ZINC000873198236 1124751161 /nfs/dbraw/zinc/75/11/61/1124751161.db2.gz ZWLUQOGFACFXDI-UHFFFAOYSA-N 1 0 298.333 3.996 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCC1(F)F ZINC000449491019 1124761339 /nfs/dbraw/zinc/76/13/39/1124761339.db2.gz DUSMHBOVERGBCZ-DGCLKSJQSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1csc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449482666 1124763890 /nfs/dbraw/zinc/76/38/90/1124763890.db2.gz ZGVBOLUSRFCIDF-LBPRGKRZSA-N 1 0 290.388 3.686 20 5 CHBDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC001307498831 1125001008 /nfs/dbraw/zinc/00/10/08/1125001008.db2.gz FMCGOISAPDAQRH-ZYHUDNBSSA-N 1 0 282.771 3.869 20 5 CHBDRO CSC(C)(C)CC[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000877130846 1125013509 /nfs/dbraw/zinc/01/35/09/1125013509.db2.gz PAMKTOQZRHDISZ-LLVKDONJSA-N 1 0 282.409 3.777 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1(C)CC(F)(F)C1 ZINC000877833339 1125090051 /nfs/dbraw/zinc/09/00/51/1125090051.db2.gz GQEBZOXORAYWPB-LLVKDONJSA-N 1 0 298.333 3.693 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@H]2c2ccccn2)cccc1[N+](=O)[O-] ZINC000530963490 1125189790 /nfs/dbraw/zinc/18/97/90/1125189790.db2.gz VRJBKOWPQMLUNE-QGZVFWFLSA-N 1 0 297.358 3.635 20 5 CHBDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000531441467 1125220033 /nfs/dbraw/zinc/22/00/33/1125220033.db2.gz NOXYHJJFFXODIL-KBXCAEBGSA-N 1 0 296.370 3.973 20 5 CHBDRO Cc1cncc([C@@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000879748644 1125229265 /nfs/dbraw/zinc/22/92/65/1125229265.db2.gz MLKAYRKCSURCDS-KRWDZBQOSA-N 1 0 297.358 3.635 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000169058497 1125370203 /nfs/dbraw/zinc/37/02/03/1125370203.db2.gz VWTJXGIBBKPULH-INIZCTEOSA-N 1 0 288.322 3.975 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2(C)CC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000883255211 1125385666 /nfs/dbraw/zinc/38/56/66/1125385666.db2.gz OEEGYXCXUKJVBJ-NSHDSACASA-N 1 0 298.333 3.989 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)CCSC)c1cccc([N+](=O)[O-])c1 ZINC000131650894 1125404205 /nfs/dbraw/zinc/40/42/05/1125404205.db2.gz DFSKYSCMGKJPRB-RISCZKNCSA-N 1 0 282.409 3.777 20 5 CHBDRO C[C@H]([N@H+](C)Cc1csc([N+](=O)[O-])c1)C(C)(C)C ZINC000532488982 1125406708 /nfs/dbraw/zinc/40/67/08/1125406708.db2.gz AVJLMPJRIBCWLN-VIFPVBQESA-N 1 0 256.371 3.523 20 5 CHBDRO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000883461913 1125411362 /nfs/dbraw/zinc/41/13/62/1125411362.db2.gz GFQWMGUEWHLBCD-MRXNPFEDSA-N 1 0 297.358 3.630 20 5 CHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000037864165 1129279986 /nfs/dbraw/zinc/27/99/86/1129279986.db2.gz AKBKPJSCSCNWQF-UHFFFAOYSA-N 1 0 284.359 3.662 20 5 CHBDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000766194758 1129282826 /nfs/dbraw/zinc/28/28/26/1129282826.db2.gz WXIDFYAKNZBPJC-QGZVFWFLSA-N 1 0 296.370 3.723 20 5 CHBDRO CCC[C@H]([NH2+]CC[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000038095972 1129334970 /nfs/dbraw/zinc/33/49/70/1129334970.db2.gz NJYJJEMDEPYCRE-CVEARBPZSA-N 1 0 292.379 3.595 20 5 CHBDRO CC(C)[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccnc1 ZINC000091407474 1129357963 /nfs/dbraw/zinc/35/79/63/1129357963.db2.gz XHPWFKFFSJQCPW-QGZVFWFLSA-N 1 0 299.374 3.519 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000766227557 1129387820 /nfs/dbraw/zinc/38/78/20/1129387820.db2.gz YHRQGTRJGCHCGJ-JHJVBQTASA-N 1 0 294.420 3.838 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC2(CCCC2)CC1 ZINC000738343453 1129394314 /nfs/dbraw/zinc/39/43/14/1129394314.db2.gz MOKBILIIUJYRQW-UHFFFAOYSA-N 1 0 292.354 3.890 20 5 CHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094774538 1129451603 /nfs/dbraw/zinc/45/16/03/1129451603.db2.gz JTDHEEBWYRQVLH-DGCLKSJQSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000741795666 1129454204 /nfs/dbraw/zinc/45/42/04/1129454204.db2.gz QKBHONMNCFYQCU-VXGBXAGGSA-N 1 0 280.343 3.744 20 5 CHBDRO CCCCCC[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000796116480 1129467352 /nfs/dbraw/zinc/46/73/52/1129467352.db2.gz UVOFAPMIWTVWNB-UHFFFAOYSA-N 1 0 264.369 3.649 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(CCCC2)C1 ZINC000743864070 1129542225 /nfs/dbraw/zinc/54/22/25/1129542225.db2.gz IBHKRVIDJLXQBF-ZDUSSCGKSA-N 1 0 274.364 3.922 20 5 CHBDRO CCC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC(C)C ZINC000746144555 1129627525 /nfs/dbraw/zinc/62/75/25/1129627525.db2.gz BQMLAIFYXRJNMG-UHFFFAOYSA-N 1 0 268.332 3.602 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCNc2ccccc2)cc1[N+](=O)[O-] ZINC000766516953 1129679035 /nfs/dbraw/zinc/67/90/35/1129679035.db2.gz ZJEKJISWFULGSR-AWEZNQCLSA-N 1 0 299.374 3.666 20 5 CHBDRO CC(C)[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168981770 1129686807 /nfs/dbraw/zinc/68/68/07/1129686807.db2.gz HGUAUMWNWMHEMD-KCXAZCMYSA-N 1 0 294.370 3.558 20 5 CHBDRO CC(C)[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001168985291 1129686809 /nfs/dbraw/zinc/68/68/09/1129686809.db2.gz SRQLPSZNDQFZQZ-KCXAZCMYSA-N 1 0 294.370 3.558 20 5 CHBDRO CC(C)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(Cl)c1 ZINC001168981220 1129686915 /nfs/dbraw/zinc/68/69/15/1129686915.db2.gz GUOMMXJGYUODBL-FZMZJTMJSA-N 1 0 296.798 3.610 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1F ZINC001168981841 1129686981 /nfs/dbraw/zinc/68/69/81/1129686981.db2.gz HPJFWGDRYHXHSB-XEZPLFJOSA-N 1 0 294.370 3.702 20 5 CHBDRO CCC(CC)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168965914 1129687696 /nfs/dbraw/zinc/68/76/96/1129687696.db2.gz DJXVBDKSJBDDLZ-HOCLYGCPSA-N 1 0 290.407 3.737 20 5 CHBDRO CCCCc1ccc(C[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001168965962 1129687939 /nfs/dbraw/zinc/68/79/39/1129687939.db2.gz FGMVWWHPUVXZEJ-IAGOWNOFSA-N 1 0 290.407 3.564 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(C)c1 ZINC001169000779 1129688653 /nfs/dbraw/zinc/68/86/53/1129688653.db2.gz BTBLPXINCKTMFS-USXIJHARSA-N 1 0 290.407 3.871 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)c(C)c1 ZINC001169003600 1129689115 /nfs/dbraw/zinc/68/91/15/1129689115.db2.gz ONQXRXUADVYYGG-BJJXKVORSA-N 1 0 294.370 3.620 20 5 CHBDRO CC1(C)C[NH+](Cc2ccccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001169002632 1129689403 /nfs/dbraw/zinc/68/94/03/1129689403.db2.gz BPGXAMQSMKRVEI-UHFFFAOYSA-N 1 0 276.380 3.853 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCCC[C@@H]2c2ccccc2)C1 ZINC001169006018 1129689440 /nfs/dbraw/zinc/68/94/40/1129689440.db2.gz FIPBYULVNOJYAP-HYVNUMGLSA-N 1 0 288.391 3.659 20 5 CHBDRO CC(C)[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)cc1 ZINC001168987182 1129690051 /nfs/dbraw/zinc/69/00/51/1129690051.db2.gz HGUAUMWNWMHEMD-UHOFOFEASA-N 1 0 294.370 3.558 20 5 CHBDRO CC(C)C[N@H+](Cc1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011215 1129690083 /nfs/dbraw/zinc/69/00/83/1129690083.db2.gz ILVYCMZQMZDTIA-DLBZAZTESA-N 1 0 290.407 3.590 20 5 CHBDRO CC[N@H+](Cc1ccc(Cl)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169039777 1129690574 /nfs/dbraw/zinc/69/05/74/1129690574.db2.gz TWABAGUDJOHTAM-HIFRSBDPSA-N 1 0 296.798 3.607 20 5 CHBDRO CC[N@H+](Cc1ccc(C)c(C)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169050084 1129692137 /nfs/dbraw/zinc/69/21/37/1129692137.db2.gz YLRCWSAUWKJNFP-DLBZAZTESA-N 1 0 290.407 3.571 20 5 CHBDRO CC(C)C[C@@H](C)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001169665266 1129744860 /nfs/dbraw/zinc/74/48/60/1129744860.db2.gz BGILCNVBTWHBCZ-CYBMUJFWSA-N 1 0 264.369 3.504 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001461381872 1129912914 /nfs/dbraw/zinc/91/29/14/1129912914.db2.gz KLULGXJADRHSNI-MFKMUULPSA-N 1 0 282.771 3.569 20 5 CHBDRO CCC(CC)[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CC1 ZINC000801515015 1129923608 /nfs/dbraw/zinc/92/36/08/1129923608.db2.gz SBJAQMUTJGTOSD-UHFFFAOYSA-N 1 0 280.343 3.887 20 5 CHBDRO COc1cc([C@H](C)[NH2+]Cc2cccs2)cc([N+](=O)[O-])c1 ZINC000903058562 1130107086 /nfs/dbraw/zinc/10/70/86/1130107086.db2.gz SARQTGPHPBTRQY-JTQLQIEISA-N 1 0 292.360 3.516 20 5 CHBDRO Cc1cscc1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000787293592 1130142636 /nfs/dbraw/zinc/14/26/36/1130142636.db2.gz BZNOXRDDSXIZOY-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO CC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCC1 ZINC000746675328 1130146026 /nfs/dbraw/zinc/14/60/26/1130146026.db2.gz SYPWIAVGGICTAA-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000903284167 1130146082 /nfs/dbraw/zinc/14/60/82/1130146082.db2.gz PVMVCAOZIORNFV-AAEUAGOBSA-N 1 0 294.420 3.920 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000903286890 1130147006 /nfs/dbraw/zinc/14/70/06/1130147006.db2.gz ISXIVUIAKXRSIW-VHSXEESVSA-N 1 0 290.285 3.976 20 5 CHBDRO CC[C@H]([NH2+]CCc1cccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000903415741 1130173195 /nfs/dbraw/zinc/17/31/95/1130173195.db2.gz LBVBHNGIFHTAKD-KRWDZBQOSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903427768 1130176023 /nfs/dbraw/zinc/17/60/23/1130176023.db2.gz JUWFZSMXHFILGS-SJKOYZFVSA-N 1 0 297.358 3.792 20 5 CHBDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000748820385 1130249594 /nfs/dbraw/zinc/24/95/94/1130249594.db2.gz YHZNOUUAWLCJSK-KRWDZBQOSA-N 1 0 296.370 3.989 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCC(C)(C)CC1 ZINC001254558339 1130265719 /nfs/dbraw/zinc/26/57/19/1130265719.db2.gz AAJAHOLDSMHQCR-CYBMUJFWSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)CSC(C)(C)C)cccc1[N+](=O)[O-] ZINC000790694150 1130326671 /nfs/dbraw/zinc/32/66/71/1130326671.db2.gz GVELSKSFVWKUMS-NSHDSACASA-N 1 0 296.436 3.913 20 5 CHBDRO CC(C)([NH2+]CC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC001170650916 1130662034 /nfs/dbraw/zinc/66/20/34/1130662034.db2.gz RJXJCYBCMHBGDQ-UHFFFAOYSA-N 1 0 276.380 4.000 20 5 CHBDRO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC000783635512 1130843730 /nfs/dbraw/zinc/84/37/30/1130843730.db2.gz VRWKAMOEPCXKJI-UHFFFAOYSA-N 1 0 268.744 3.526 20 5 CHBDRO C[N@@H+]1CCCC[C@@H]1CCOc1ccc([N+](=O)[O-])cc1Cl ZINC000798213012 1131030053 /nfs/dbraw/zinc/03/00/53/1131030053.db2.gz HVHGHKKSSFNUQV-LLVKDONJSA-N 1 0 298.770 3.501 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799193239 1131075659 /nfs/dbraw/zinc/07/56/59/1131075659.db2.gz MFESSYTUKCUMPJ-ZIAGYGMSSA-N 1 0 297.358 3.540 20 5 CHBDRO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000816646318 1131117119 /nfs/dbraw/zinc/11/71/19/1131117119.db2.gz BTWORNNSSHVNIU-NWDGAFQWSA-N 1 0 286.331 3.695 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H]2CCC[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC001202813084 1131436692 /nfs/dbraw/zinc/43/66/92/1131436692.db2.gz QSILICVUPSCNBS-CVEARBPZSA-N 1 0 288.391 3.819 20 5 CHBDRO CCc1ccc2cc(O[C@@H](C)C[N+](C)(C)C)ccc2c1 ZINC001228044465 1131795622 /nfs/dbraw/zinc/79/56/22/1131795622.db2.gz KEVZRXJABKJYGY-AWEZNQCLSA-N 1 0 272.412 3.876 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc2cc3ccccc3nc21 ZINC001228176995 1131823478 /nfs/dbraw/zinc/82/34/78/1131823478.db2.gz VXCJGPYJGCVKPW-CQSZACIVSA-N 1 0 295.406 3.862 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1ccc[nH]1 ZINC000773117921 1131948831 /nfs/dbraw/zinc/94/88/31/1131948831.db2.gz MHESHHIYFIQJGY-VXGBXAGGSA-N 1 0 273.336 3.643 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1ccc[nH]1 ZINC000773117918 1131949346 /nfs/dbraw/zinc/94/93/46/1131949346.db2.gz MHESHHIYFIQJGY-NEPJUHHUSA-N 1 0 273.336 3.643 20 5 CHBDRO O[C@@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)C[C@@H]1F ZINC001141722505 1132239630 /nfs/dbraw/zinc/23/96/30/1132239630.db2.gz AKNGCBNUALJHDC-RBUKOAKNSA-N 1 0 295.357 3.508 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cc(F)c(C(C)(C)C)c(F)c1 ZINC001231014353 1132242550 /nfs/dbraw/zinc/24/25/50/1132242550.db2.gz DSXCWSLZWPUCGI-NSHDSACASA-N 1 0 286.386 3.736 20 5 CHBDRO Cc1cc(Cl)c(O[C@H](C)C[N+](C)(C)C)c(Cl)c1 ZINC001231220638 1132272660 /nfs/dbraw/zinc/27/26/60/1132272660.db2.gz HXYRFARTEDBNNC-SNVBAGLBSA-N 1 0 277.215 3.775 20 5 CHBDRO C[N@H+](CC1CCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910450 1132347716 /nfs/dbraw/zinc/34/77/16/1132347716.db2.gz AAKAKLKSLMOWNC-INIZCTEOSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCC(C)(C)C1 ZINC001173221743 1132411476 /nfs/dbraw/zinc/41/14/76/1132411476.db2.gz POZHRKSTDKHDLT-GXTWGEPZSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC12CCCCC2 ZINC001173221360 1132411614 /nfs/dbraw/zinc/41/16/14/1132411614.db2.gz MLJUCRKYYUGGKW-XJKSGUPXSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001173222504 1132411861 /nfs/dbraw/zinc/41/18/61/1132411861.db2.gz SMLROWCUTQZBTF-CWRNSKLLSA-N 1 0 288.391 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1[C@H](C)CCC[C@H]1C ZINC001173224440 1132412429 /nfs/dbraw/zinc/41/24/29/1132412429.db2.gz FVQKGZHDZZNVPK-MGPQQGTHSA-N 1 0 276.380 3.789 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)C[C@@H]1C ZINC001173227600 1132412676 /nfs/dbraw/zinc/41/26/76/1132412676.db2.gz RFTMWBBNKNTULO-HZSPNIEDSA-N 1 0 276.380 3.646 20 5 CHBDRO CCCC1([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CCC1 ZINC001173224084 1132412742 /nfs/dbraw/zinc/41/27/42/1132412742.db2.gz LNGXMKXKLKAEOP-ZDUSSCGKSA-N 1 0 276.380 3.838 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)[C@@H]1C ZINC001173227893 1132412950 /nfs/dbraw/zinc/41/29/50/1132412950.db2.gz SHVXPKZHKMITSG-MCIONIFRSA-N 1 0 276.380 3.646 20 5 CHBDRO Cc1ccccc1C[N@@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225519 1132412965 /nfs/dbraw/zinc/41/29/65/1132412965.db2.gz CYOMSKJWNZWAHK-OAHLLOKOSA-N 1 0 298.386 3.966 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@](C)(F)CC1 ZINC001173229115 1132413918 /nfs/dbraw/zinc/41/39/18/1132413918.db2.gz PZRCPOGRUSSVTJ-CZUORRHYSA-N 1 0 294.370 3.740 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCC12CCC2 ZINC001173229444 1132414011 /nfs/dbraw/zinc/41/40/11/1132414011.db2.gz VANYKMTWTBMOJZ-CJNGLKHVSA-N 1 0 288.391 3.838 20 5 CHBDRO Cc1cccc(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173229190 1132414038 /nfs/dbraw/zinc/41/40/38/1132414038.db2.gz RISAZNYEYFHJRI-OAHLLOKOSA-N 1 0 298.386 3.966 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC001173209355 1132415998 /nfs/dbraw/zinc/41/59/98/1132415998.db2.gz BRKVBYYUIRLSAO-WCQYABFASA-N 1 0 298.333 3.551 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCC(F)(F)C1 ZINC001173209352 1132416459 /nfs/dbraw/zinc/41/64/59/1132416459.db2.gz BRKVBYYUIRLSAO-AAEUAGOBSA-N 1 0 298.333 3.551 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC[C@@H]1C ZINC001173213728 1132416847 /nfs/dbraw/zinc/41/68/47/1132416847.db2.gz HINYDLZUIBCMOD-WOSRLPQWSA-N 1 0 276.380 3.694 20 5 CHBDRO O=[N+]([O-])c1cccc(Nc2ccc(C3CC[NH2+]CC3)cc2)c1 ZINC001159598628 1132870802 /nfs/dbraw/zinc/87/08/02/1132870802.db2.gz WMRIKOYJFCJILR-UHFFFAOYSA-N 1 0 297.358 3.805 20 5 CHBDRO C1=C(Nc2ccc3cc4ccccc4cc3c2)C[NH2+]C1 ZINC001159715514 1132898504 /nfs/dbraw/zinc/89/85/04/1132898504.db2.gz ZOYXWRGTARGXIY-UHFFFAOYSA-N 1 0 260.340 3.892 20 5 CHBDRO Cc1c[nH+]ccc1Nc1cc2cccnc2c2ncccc12 ZINC001174539994 1132900719 /nfs/dbraw/zinc/90/07/19/1132900719.db2.gz VSSWKXJVZKXDJN-UHFFFAOYSA-N 1 0 286.338 3.652 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1N[C@@H]1CCCC[C@H]1F ZINC001162512717 1133083575 /nfs/dbraw/zinc/08/35/75/1133083575.db2.gz OQXGZEYSCZRQBL-NVXWUHKLSA-N 1 0 279.423 3.976 20 5 CHBDRO Cc1cccc([N+](=O)[O-])c1NCc1cccc(C[NH+](C)C)c1 ZINC001163994860 1133191212 /nfs/dbraw/zinc/19/12/12/1133191212.db2.gz RHFICUAUGQXHJW-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCCC12CC2 ZINC001203331865 1133315843 /nfs/dbraw/zinc/31/58/43/1133315843.db2.gz IQGACTUXOQUYSS-QSOAKEGCSA-N 1 0 286.375 3.920 20 5 CHBDRO CC1(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001205883426 1133627380 /nfs/dbraw/zinc/62/73/80/1133627380.db2.gz VASOJOXWFJTFRE-AWEZNQCLSA-N 1 0 274.364 3.574 20 5 CHBDRO O=[N+]([O-])c1cccc(Nc2cc[nH+]c(C3CC3)c2)c1F ZINC001210381294 1134204047 /nfs/dbraw/zinc/20/40/47/1134204047.db2.gz LIGMZPXTAOCDAN-UHFFFAOYSA-N 1 0 273.267 3.750 20 5 CHBDRO F[C@H]1C[NH2+]C[C@H]1OCc1c2ccccc2cc2ccccc21 ZINC001217779044 1134998923 /nfs/dbraw/zinc/99/89/23/1134998923.db2.gz RXPNBAIZWWFAOO-RBUKOAKNSA-N 1 0 295.357 3.820 20 5 CHBDRO F[C@H]1C[NH2+]C[C@@H]1OCc1c2ccccc2cc2ccccc21 ZINC001217781514 1134999310 /nfs/dbraw/zinc/99/93/10/1134999310.db2.gz RXPNBAIZWWFAOO-OALUTQOASA-N 1 0 295.357 3.820 20 5 CHBDRO C[C@@H]1C[C@@H](OCc2c3ccccc3nc3ccccc32)C[NH2+]1 ZINC001217787770 1134999572 /nfs/dbraw/zinc/99/95/72/1134999572.db2.gz VJRCVDLQPDBVFF-ZIAGYGMSSA-N 1 0 292.382 3.655 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@H]1CCCC[NH2+]C1 ZINC001217972005 1135033999 /nfs/dbraw/zinc/03/39/99/1135033999.db2.gz BJLCDMGCUZYRSV-HNNXBMFYSA-N 1 0 292.382 3.909 20 5 CHBDRO C[C@@H]1C[NH2+]C[C@H]1Oc1c2ccccc2c(O)c2ccccc21 ZINC001218035982 1135047688 /nfs/dbraw/zinc/04/76/88/1135047688.db2.gz QFPHQTSCBYVPNY-SJKOYZFVSA-N 1 0 293.366 3.685 20 5 CHBDRO C[C@@H]1CC[NH2+]C[C@H]1Oc1cccc2ccc3cccnc3c21 ZINC001218043313 1135049308 /nfs/dbraw/zinc/04/93/08/1135049308.db2.gz KLORAXFMKXOIGM-CXAGYDPISA-N 1 0 292.382 3.765 20 5 CHBDRO c1ccc2c(c1)nc(O[C@@H]1CCC13C[NH2+]C3)c1ccccc21 ZINC001218239513 1135072249 /nfs/dbraw/zinc/07/22/49/1135072249.db2.gz HEGMOBKYGYRLHE-QGZVFWFLSA-N 1 0 290.366 3.519 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@@H]3CCC34C[NH2+]C4)c12 ZINC001218240908 1135072769 /nfs/dbraw/zinc/07/27/69/1135072769.db2.gz PCLDBORKTONPFW-MRXNPFEDSA-N 1 0 290.366 3.519 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2O[C@H]1C=CC[NH2+]C1 ZINC001218338081 1135091262 /nfs/dbraw/zinc/09/12/62/1135091262.db2.gz SLZQHHSCFZDVNF-INIZCTEOSA-N 1 0 275.351 3.900 20 5 CHBDRO C[C@H]1C[NH2+]CC[C@H]1Oc1cccc2cc3ccccc3nc21 ZINC001218415753 1135101218 /nfs/dbraw/zinc/10/12/18/1135101218.db2.gz QAUFDPFOTLKTCH-SUMWQHHRSA-N 1 0 292.382 3.765 20 5 CHBDRO Cc1ccc(-c2ccc(CO[C@@H](C)C[N+](C)(C)C)cc2)nc1 ZINC001224150702 1135424725 /nfs/dbraw/zinc/42/47/25/1135424725.db2.gz ISQIUOURXGFHKB-INIZCTEOSA-N 1 0 299.438 3.668 20 5 CHBDRO C[N+](C)(C)CCCO[C@@H]1Cc2cccc3cccc1c23 ZINC001224620416 1135462690 /nfs/dbraw/zinc/46/26/90/1135462690.db2.gz YQSIKHUAIHBIJU-QGZVFWFLSA-N 1 0 270.396 3.550 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1ccc(Cl)c(C(F)(F)F)c1 ZINC001225670752 1135605992 /nfs/dbraw/zinc/60/59/92/1135605992.db2.gz FIHJRZHPDSOJBU-VIFPVBQESA-N 1 0 296.740 3.832 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc2[nH]c3ccccc3c21 ZINC001226256858 1135677966 /nfs/dbraw/zinc/67/79/66/1135677966.db2.gz ITLVVIKQLSXVQE-CYBMUJFWSA-N 1 0 283.395 3.795 20 5 CHBDRO Cc1ccc2ccccc2c1O[C@@H](C)C[N+](C)(C)C ZINC001226816671 1135745422 /nfs/dbraw/zinc/74/54/22/1135745422.db2.gz SUTGRTRONGFNJK-AWEZNQCLSA-N 1 0 258.385 3.622 20 5 CHBDRO Cc1ccc(OC2CC[NH+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC001226953082 1135766458 /nfs/dbraw/zinc/76/64/58/1135766458.db2.gz REQNHBZKYDICBH-UHFFFAOYSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000094322269 261184377 /nfs/dbraw/zinc/18/43/77/261184377.db2.gz HSQKIHKEPQIOHD-FZMZJTMJSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CC[C@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000574662218 335037962 /nfs/dbraw/zinc/03/79/62/335037962.db2.gz GKTAPTWOQKMOMQ-ZIAGYGMSSA-N 1 0 276.380 3.818 20 5 CHBDRO CCC[C@@H]([NH2+]CCCOC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000020198385 171062816 /nfs/dbraw/zinc/06/28/16/171062816.db2.gz SEJKYGMIRLVAKZ-MRXNPFEDSA-N 1 0 294.395 3.841 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cccs2)cc1[N+](=O)[O-] ZINC000020139596 171027301 /nfs/dbraw/zinc/02/73/01/171027301.db2.gz QICYECGTEOFGPR-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccs1)c1ccccc1[N+](=O)[O-] ZINC000020526071 171239060 /nfs/dbraw/zinc/23/90/60/171239060.db2.gz UXWMITGHUFRFSO-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO CC(C)CC[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000021516138 171312607 /nfs/dbraw/zinc/31/26/07/171312607.db2.gz RFJNISNVPBXWEE-GFCCVEGCSA-N 1 0 250.342 3.509 20 5 CHBDRO C[C@H]([NH2+]CCc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000035140917 172008433 /nfs/dbraw/zinc/00/84/33/172008433.db2.gz YACGOKBLETVZNN-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C(C2CC2)C2CC2)c1 ZINC000035368195 172159407 /nfs/dbraw/zinc/15/94/07/172159407.db2.gz YLSHXDJGXRUZEP-UHFFFAOYSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@H]1C[C@H](C)C[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000037403648 173180091 /nfs/dbraw/zinc/18/00/91/173180091.db2.gz FYBDOAZIZPKZET-QWRGUYRKSA-N 1 0 282.771 3.726 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC000417908182 227146969 /nfs/dbraw/zinc/14/69/69/227146969.db2.gz GBEKVNOSLGMOHX-WMZOPIPTSA-N 1 0 296.370 3.531 20 5 CHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CC2CC2)c2ccccc2)c1 ZINC000180063499 260092582 /nfs/dbraw/zinc/09/25/82/260092582.db2.gz MMQVCWFXXCMYHU-KRWDZBQOSA-N 1 0 282.343 3.684 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000426766153 260214016 /nfs/dbraw/zinc/21/40/16/260214016.db2.gz XGDXLKBVGJBSCW-SNPRPXQTSA-N 1 0 274.364 3.778 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC000090217584 260239689 /nfs/dbraw/zinc/23/96/89/260239689.db2.gz HYWNFSHSRLNHTQ-VXGBXAGGSA-N 1 0 262.353 3.742 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCCCCC1 ZINC000313547898 260302498 /nfs/dbraw/zinc/30/24/98/260302498.db2.gz RJKSQBRCJOLWJO-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO Cc1c(C[NH2+]C/C=C\c2ccccc2)cccc1[N+](=O)[O-] ZINC000313572245 260303207 /nfs/dbraw/zinc/30/32/07/260303207.db2.gz JFFJSXNVJZQBFV-TWGQIWQCSA-N 1 0 282.343 3.706 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)CC(C)(C)C ZINC000517901050 260316128 /nfs/dbraw/zinc/31/61/28/260316128.db2.gz GYELVTJXTHEZKB-UHFFFAOYSA-N 1 0 294.395 3.860 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H]1CC=CCC1 ZINC000518562611 260455104 /nfs/dbraw/zinc/45/51/04/260455104.db2.gz MQLYIFKMUZHFFU-SWLSCSKDSA-N 1 0 272.348 3.528 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1ccccn1 ZINC000152366808 261063544 /nfs/dbraw/zinc/06/35/44/261063544.db2.gz GPIOEYGOWKVQQX-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000514083984 261353786 /nfs/dbraw/zinc/35/37/86/261353786.db2.gz NOSKLCQGQBODCR-NSHDSACASA-N 1 0 268.382 3.667 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC(C)(C)C1 ZINC000497363414 262146712 /nfs/dbraw/zinc/14/67/12/262146712.db2.gz JHLHSUJBDIVVKZ-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO COCCC(C)(C)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000183929992 262253891 /nfs/dbraw/zinc/25/38/91/262253891.db2.gz KWHWLWQJVPPVII-CYBMUJFWSA-N 1 0 294.395 3.617 20 5 CHBDRO CCSCCC[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000311481160 262265963 /nfs/dbraw/zinc/26/59/63/262265963.db2.gz KWJQRHRMDNRDBI-AWEZNQCLSA-N 1 0 282.409 3.779 20 5 CHBDRO C[C@@H]([NH2+]C1CCC2(CC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000488440069 262320914 /nfs/dbraw/zinc/32/09/14/262320914.db2.gz IVPPMUYQGKXNAH-GFCCVEGCSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000186742163 262322837 /nfs/dbraw/zinc/32/28/37/262322837.db2.gz FIMHQRCZQRHDGP-GHMZBOCLSA-N 1 0 291.376 3.506 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccnc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000391167307 262385660 /nfs/dbraw/zinc/38/56/60/262385660.db2.gz JLPRYRDETSTCNG-KRWDZBQOSA-N 1 0 299.374 3.929 20 5 CHBDRO Cc1cccc(CCC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000285049890 263089691 /nfs/dbraw/zinc/08/96/91/263089691.db2.gz IVBCJPMKIVZNFK-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO CCC(C)(C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000189994323 264344896 /nfs/dbraw/zinc/34/48/96/264344896.db2.gz KHYIODNDLZOGRC-LLVKDONJSA-N 1 0 250.342 3.682 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)cc1 ZINC000282145711 264497071 /nfs/dbraw/zinc/49/70/71/264497071.db2.gz WNBWAAOFZKSQCA-GFCCVEGCSA-N 1 0 284.306 3.510 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1F ZINC000094837835 265263544 /nfs/dbraw/zinc/26/35/44/265263544.db2.gz YTWHBLKSKVUYJD-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000362925853 267061890 /nfs/dbraw/zinc/06/18/90/267061890.db2.gz VSRKEXVDYPJLRB-UHFFFAOYSA-N 1 0 299.305 3.505 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000572780345 327615881 /nfs/dbraw/zinc/61/58/81/327615881.db2.gz HUENQAGAWRSYEL-ZWNOBZJWSA-N 1 0 296.317 3.607 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000040675910 328015499 /nfs/dbraw/zinc/01/54/99/328015499.db2.gz QOFDDTVOMVAURZ-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC(C)(C)C1 ZINC000040675900 328015522 /nfs/dbraw/zinc/01/55/22/328015522.db2.gz FAZOZBXEJQEJMT-ZFWWWQNUSA-N 1 0 290.407 3.942 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000040675939 328015578 /nfs/dbraw/zinc/01/55/78/328015578.db2.gz JPHICFUYNIBHMZ-AWEZNQCLSA-N 1 0 290.388 3.940 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000395140701 328617122 /nfs/dbraw/zinc/61/71/22/328617122.db2.gz FNULXZYNAVJXJG-ZJQBRPOHSA-N 1 0 262.353 3.598 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1cccs1)C1CC1 ZINC000049956814 328379817 /nfs/dbraw/zinc/37/98/17/328379817.db2.gz KDCDHGFXKWYRAT-OAHLLOKOSA-N 1 0 288.372 3.897 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000050015516 328381842 /nfs/dbraw/zinc/38/18/42/328381842.db2.gz ZIDJGAPKMGMXCC-VXGBXAGGSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000070305649 328591631 /nfs/dbraw/zinc/59/16/31/328591631.db2.gz OIPPLYXMWAXAJR-RYUDHWBXSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@H]([NH2+]C(C1CC1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000037010525 326833993 /nfs/dbraw/zinc/83/39/93/326833993.db2.gz TVBXPCIZVHXMRZ-HNNXBMFYSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCSCC(C)C)cccc1[N+](=O)[O-] ZINC000537948687 326841744 /nfs/dbraw/zinc/84/17/44/326841744.db2.gz XZDKYGOUXCJQFV-ZDUSSCGKSA-N 1 0 296.436 3.943 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000537950777 326862746 /nfs/dbraw/zinc/86/27/46/326862746.db2.gz MCVBKELAJZUYEB-CHWSQXEVSA-N 1 0 276.380 3.552 20 5 CHBDRO O=[N+]([O-])c1ccc(NCC[NH+]2CCCCCC2)c(Cl)c1 ZINC000047848179 326931876 /nfs/dbraw/zinc/93/18/76/326931876.db2.gz KGAUMPFXOZUZNB-UHFFFAOYSA-N 1 0 297.786 3.536 20 5 CHBDRO CC(C)(C)CC(C)(C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000042254735 327236102 /nfs/dbraw/zinc/23/61/02/327236102.db2.gz FDNFQNKNZRPHIW-UHFFFAOYSA-N 1 0 278.396 3.942 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H]1CCCC12CCCC2 ZINC000559766220 327260059 /nfs/dbraw/zinc/26/00/59/327260059.db2.gz HGDHNLJPQAFFRT-INIZCTEOSA-N 1 0 288.391 3.840 20 5 CHBDRO CCC[C@H]([NH2+]CC1(SC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000193825329 329063372 /nfs/dbraw/zinc/06/33/72/329063372.db2.gz QQVLFZDJUYQXDN-AWEZNQCLSA-N 1 0 294.420 3.921 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC1(C)C ZINC000583106307 329312510 /nfs/dbraw/zinc/31/25/10/329312510.db2.gz HWBPDZSHIUKCSP-HMVFGEFZSA-N 1 0 274.364 3.776 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCCC23CCCC3)cc1 ZINC000392828651 329388094 /nfs/dbraw/zinc/38/80/94/329388094.db2.gz DPLVQXPNXVSQBO-INIZCTEOSA-N 1 0 288.391 3.840 20 5 CHBDRO Cc1cc(N)cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000423472507 330205200 /nfs/dbraw/zinc/20/52/00/330205200.db2.gz FZKVLKIWEXHVEM-CYBMUJFWSA-N 1 0 299.374 3.645 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cc(C)cc(N)c1)c1cccc([N+](=O)[O-])c1 ZINC000423482698 330206545 /nfs/dbraw/zinc/20/65/45/330206545.db2.gz RWSRYHKXOXQFGT-QGZVFWFLSA-N 1 0 299.374 3.726 20 5 CHBDRO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000527238487 330240630 /nfs/dbraw/zinc/24/06/30/330240630.db2.gz FPHXHJSRIYSFKY-RYUDHWBXSA-N 1 0 286.331 3.838 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)[C@@H]1C ZINC000035677663 330249189 /nfs/dbraw/zinc/24/91/89/330249189.db2.gz FXGRPIWSWBQPTA-XJKCOSOUSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CC1(C)C ZINC000536865478 330253551 /nfs/dbraw/zinc/25/35/51/330253551.db2.gz UGIVAWVADJAJOT-VXGBXAGGSA-N 1 0 262.353 3.600 20 5 CHBDRO C[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000536879155 330315426 /nfs/dbraw/zinc/31/54/26/330315426.db2.gz UCEIQTZOQXDJLO-FDQGKXFDSA-N 1 0 296.370 3.877 20 5 CHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000083601766 330482039 /nfs/dbraw/zinc/48/20/39/330482039.db2.gz KRZXDNOHHLYGCR-UHFFFAOYSA-N 1 0 290.388 3.724 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CC12CCCC2 ZINC000428535137 330527552 /nfs/dbraw/zinc/52/75/52/330527552.db2.gz KVWSXTMYIUGYJM-OVHOFWQVSA-N 1 0 286.375 3.920 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccccc1 ZINC000449061833 330896237 /nfs/dbraw/zinc/89/62/37/330896237.db2.gz HRMRWIBQLSVJEQ-KGLIPLIRSA-N 1 0 284.359 3.877 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449100127 330898974 /nfs/dbraw/zinc/89/89/74/330898974.db2.gz WEVGCAFRVBIWGN-AVGNSLFASA-N 1 0 264.369 3.550 20 5 CHBDRO CCC[C@H](CC)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449130250 330900938 /nfs/dbraw/zinc/90/09/38/330900938.db2.gz GEQXFXUVBWUNFM-OCCSQVGLSA-N 1 0 264.369 3.694 20 5 CHBDRO Cc1ccc(CC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000449141236 330901450 /nfs/dbraw/zinc/90/14/50/330901450.db2.gz KWLJUZVECQKEKV-HNNXBMFYSA-N 1 0 298.386 3.667 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)C1CCCC1 ZINC000449155698 330902271 /nfs/dbraw/zinc/90/22/71/330902271.db2.gz QDQGCYFLJJEXAZ-CHWSQXEVSA-N 1 0 276.380 3.694 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000449165653 330902877 /nfs/dbraw/zinc/90/28/77/330902877.db2.gz WVORAADRIUPJCY-BBRMVZONSA-N 1 0 299.374 3.662 20 5 CHBDRO CSCCCCC[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449256810 330910391 /nfs/dbraw/zinc/91/03/91/330910391.db2.gz KAGWWJHPKHHIRA-CYBMUJFWSA-N 1 0 296.436 3.649 20 5 CHBDRO COc1ccsc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449347448 330917041 /nfs/dbraw/zinc/91/70/41/330917041.db2.gz HJRMJWZQGARPDQ-JTQLQIEISA-N 1 0 292.360 3.516 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CCSCC1 ZINC000449351215 330917467 /nfs/dbraw/zinc/91/74/67/330917467.db2.gz ZUQHGYDNIZEHIX-NWDGAFQWSA-N 1 0 294.420 3.777 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000449440612 330925775 /nfs/dbraw/zinc/92/57/75/330925775.db2.gz LLSXTNBKCLJKGO-XNRPHZJLSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000449440614 330925779 /nfs/dbraw/zinc/92/57/79/330925779.db2.gz LLSXTNBKCLJKGO-XPKDYRNWSA-N 1 0 288.391 3.694 20 5 CHBDRO CC(C)([NH2+]C[C@H]1CCC(F)(F)C1)c1ccccc1[N+](=O)[O-] ZINC000451059548 331014128 /nfs/dbraw/zinc/01/41/28/331014128.db2.gz XDAZETKLXSAYOI-NSHDSACASA-N 1 0 298.333 3.855 20 5 CHBDRO CC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccsc1 ZINC000453166897 331096294 /nfs/dbraw/zinc/09/62/94/331096294.db2.gz CZTPLEZJDRWFMV-OAHLLOKOSA-N 1 0 290.388 3.940 20 5 CHBDRO CCC1([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000453273967 331109863 /nfs/dbraw/zinc/10/98/63/331109863.db2.gz ALAAVHOCQICSME-ZFWWWQNUSA-N 1 0 288.391 3.838 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(C3CCC3)CCC2)c(F)c1 ZINC000459746394 331297936 /nfs/dbraw/zinc/29/79/36/331297936.db2.gz NJZVOXCWBRKNTI-UHFFFAOYSA-N 1 0 278.327 3.546 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000459797139 331301648 /nfs/dbraw/zinc/30/16/48/331301648.db2.gz ZXBRGIAJEGPZQF-AVRGHOLYSA-N 1 0 274.364 3.742 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCCCF ZINC000462812917 331330520 /nfs/dbraw/zinc/33/05/20/331330520.db2.gz PCHDRBJOYOIPLI-DZGCQCFKSA-N 1 0 294.370 3.645 20 5 CHBDRO C[C@H]1Cc2ccccc2[C@@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000467985161 331426382 /nfs/dbraw/zinc/42/63/82/331426382.db2.gz RCYXJBNSPCDPSG-SCLBCKFNSA-N 1 0 296.370 3.660 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCCC1 ZINC000468640840 331438071 /nfs/dbraw/zinc/43/80/71/331438071.db2.gz IZNVJPCZIAQMID-XFXZXTDPSA-N 1 0 260.337 3.530 20 5 CHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000481165844 331799551 /nfs/dbraw/zinc/79/95/51/331799551.db2.gz ATGWJMBTPNOKDT-ZIAGYGMSSA-N 1 0 292.379 3.532 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000481231805 331801482 /nfs/dbraw/zinc/80/14/82/331801482.db2.gz IILSKUSAPIABIR-KBPBESRZSA-N 1 0 274.364 3.910 20 5 CHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000487186124 331958755 /nfs/dbraw/zinc/95/87/55/331958755.db2.gz AHUBBQIDMOTLBD-QMMMGPOBSA-N 1 0 288.269 3.502 20 5 CHBDRO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CS1 ZINC000488425023 332006498 /nfs/dbraw/zinc/00/64/98/332006498.db2.gz YZOMJIVVYXIWPB-WHOFXGATSA-N 1 0 294.420 3.776 20 5 CHBDRO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CS1 ZINC000488447816 332009914 /nfs/dbraw/zinc/00/99/14/332009914.db2.gz XUFMIGYYXFTNOQ-YWPYICTPSA-N 1 0 294.420 3.776 20 5 CHBDRO CC[N@H+](CC(C)C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000488597220 332019996 /nfs/dbraw/zinc/01/99/96/332019996.db2.gz ZONIVHQYAFHQMH-GFCCVEGCSA-N 1 0 250.342 3.634 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CC(C)C ZINC000489101410 332041452 /nfs/dbraw/zinc/04/14/52/332041452.db2.gz HBMUWTPYLQEDCI-LBPRGKRZSA-N 1 0 250.342 3.552 20 5 CHBDRO C[NH+](C)C1(CNc2ccc([N+](=O)[O-])cc2)CCCCCC1 ZINC000490059910 332079173 /nfs/dbraw/zinc/07/91/73/332079173.db2.gz OKXFLJVYRDMBSS-UHFFFAOYSA-N 1 0 291.395 3.661 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490551768 332091345 /nfs/dbraw/zinc/09/13/45/332091345.db2.gz ZJQKRJKTPPJZNU-BFQNTYOBSA-N 1 0 292.354 3.887 20 5 CHBDRO Cc1cc(C)c(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cn1 ZINC000575596074 335107530 /nfs/dbraw/zinc/10/75/30/335107530.db2.gz GBAFKFUQMIGTFT-CQSZACIVSA-N 1 0 299.374 3.766 20 5 CHBDRO C[C@H]1CC[C@H](C)[NH+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493354104 332436762 /nfs/dbraw/zinc/43/67/62/332436762.db2.gz BBEKFCKXHFUIIH-UWVGGRQHSA-N 1 0 268.744 3.621 20 5 CHBDRO Cc1ccc(C[NH2+]CC2CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000500442089 332609230 /nfs/dbraw/zinc/60/92/30/332609230.db2.gz RSSPFSOACWPLOC-UHFFFAOYSA-N 1 0 298.333 3.818 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1C[C@@H]1C ZINC000504899491 332723915 /nfs/dbraw/zinc/72/39/15/332723915.db2.gz HRPICUJFLLPNNO-YNEHKIRRSA-N 1 0 294.420 3.711 20 5 CHBDRO C[C@H]1CC[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000513106067 333004542 /nfs/dbraw/zinc/00/45/42/333004542.db2.gz GMPFRUQFOPVTTP-NHYWBVRUSA-N 1 0 286.331 3.743 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000311920645 333074550 /nfs/dbraw/zinc/07/45/50/333074550.db2.gz DQOGJFXGJMOFNX-BXUZGUMPSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC2(C)CCC2)cc1[N+](=O)[O-] ZINC000222211481 333177202 /nfs/dbraw/zinc/17/72/02/333177202.db2.gz RVHNNRWJICKKRN-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000189086153 333180503 /nfs/dbraw/zinc/18/05/03/333180503.db2.gz YVSVPPZFWXMSLK-IUODEOHRSA-N 1 0 274.364 3.968 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CCOC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000336894093 335122921 /nfs/dbraw/zinc/12/29/21/335122921.db2.gz LMKXCVYACRWSHX-HUUCEWRRSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)cc1 ZINC000303538200 333343385 /nfs/dbraw/zinc/34/33/85/333343385.db2.gz HJBADPFFVPEUBD-QGZVFWFLSA-N 1 0 286.375 3.917 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000524609368 333368367 /nfs/dbraw/zinc/36/83/67/333368367.db2.gz VEIFKNIRXQMRMY-OAHLLOKOSA-N 1 0 276.380 3.792 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC3(C2)CCCCC3)cc1 ZINC000525122339 333399985 /nfs/dbraw/zinc/39/99/85/333399985.db2.gz BVOQUJRCOMKAFS-UHFFFAOYSA-N 1 0 274.364 3.751 20 5 CHBDRO CC(C)(CC[NH2+]Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000328479235 333533583 /nfs/dbraw/zinc/53/35/83/333533583.db2.gz JUJWRWBFPVMEBO-UHFFFAOYSA-N 1 0 280.343 3.650 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000037668268 333536037 /nfs/dbraw/zinc/53/60/37/333536037.db2.gz GKPHNGYVRROJRL-RYUDHWBXSA-N 1 0 262.353 3.509 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1CCCC(F)(F)C1 ZINC000540625915 333739130 /nfs/dbraw/zinc/73/91/30/333739130.db2.gz WZGYUTGGGDTDRQ-BPJJOFIESA-N 1 0 296.317 3.776 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccoc1 ZINC000542775778 333839788 /nfs/dbraw/zinc/83/97/88/333839788.db2.gz AQYAECOIJJOZPC-JTQLQIEISA-N 1 0 294.738 3.735 20 5 CHBDRO Cc1cccc(C)c1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000130945761 333890618 /nfs/dbraw/zinc/89/06/18/333890618.db2.gz YXKXDHFSIJSBOF-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c(Cl)c1 ZINC000543859679 333903875 /nfs/dbraw/zinc/90/38/75/333903875.db2.gz RTIRHSSILIJWAQ-VXGBXAGGSA-N 1 0 294.782 3.870 20 5 CHBDRO CSCCCC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000133650069 334048846 /nfs/dbraw/zinc/04/88/46/334048846.db2.gz CMMUHZZXUYCRND-LBPRGKRZSA-N 1 0 282.409 3.697 20 5 CHBDRO CSCCCC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000133649870 334048899 /nfs/dbraw/zinc/04/88/99/334048899.db2.gz CMMUHZZXUYCRND-GFCCVEGCSA-N 1 0 282.409 3.697 20 5 CHBDRO C/C(=C/c1ccccc1)C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000236703660 334066113 /nfs/dbraw/zinc/06/61/13/334066113.db2.gz SCRFVVFTYFNREQ-KAMYIIQDSA-N 1 0 282.343 3.788 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCC(C)(C)O1 ZINC000547980614 334133194 /nfs/dbraw/zinc/13/31/94/334133194.db2.gz AUFKRYWJJHATJZ-OCCSQVGLSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCCC[C@@H]1C ZINC000548586794 334162995 /nfs/dbraw/zinc/16/29/95/334162995.db2.gz JNHRDIVDKOBTJL-ZDUSSCGKSA-N 1 0 262.353 3.668 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000550032828 334211750 /nfs/dbraw/zinc/21/17/50/334211750.db2.gz ZBERDLNXWTWHGK-GFCCVEGCSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1(C(C)C)CC1 ZINC000550274656 334218580 /nfs/dbraw/zinc/21/85/80/334218580.db2.gz NZOQBZQKOBOXAG-LBPRGKRZSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C2(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000551259836 334243130 /nfs/dbraw/zinc/24/31/30/334243130.db2.gz SMHBROAUTDZXPB-GFCCVEGCSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)[C@H]1CCCO1 ZINC000246405465 334256432 /nfs/dbraw/zinc/25/64/32/334256432.db2.gz MASNXKNYJDSSEK-UHOFOFEASA-N 1 0 292.379 3.511 20 5 CHBDRO CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C1CCCC1 ZINC000551827471 334263591 /nfs/dbraw/zinc/26/35/91/334263591.db2.gz SPGCGBQZLUXCBO-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000252454433 334380772 /nfs/dbraw/zinc/38/07/72/334380772.db2.gz FXGRPIWSWBQPTA-WWGRRREGSA-N 1 0 276.380 3.552 20 5 CHBDRO CC(C)C(C)(C)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000553434249 334384742 /nfs/dbraw/zinc/38/47/42/334384742.db2.gz SCPIDILESGBFNQ-CLFYSBASSA-N 1 0 262.353 3.632 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000567269583 334699845 /nfs/dbraw/zinc/69/98/45/334699845.db2.gz NNEPDTRZSMIGDL-IACUBPJLSA-N 1 0 280.343 3.835 20 5 CHBDRO CC(C)(C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000178677565 335444537 /nfs/dbraw/zinc/44/45/37/335444537.db2.gz RRLFAGZYJQGZLE-AWEZNQCLSA-N 1 0 276.380 3.552 20 5 CHBDRO CC[C@H](C)[C@@H](C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)OC ZINC000362978401 335865633 /nfs/dbraw/zinc/86/56/33/335865633.db2.gz ZUXRHXRRZIORPO-VBNZEHGJSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CC3CCC2CC3)cccc1[N+](=O)[O-] ZINC000380718508 336019879 /nfs/dbraw/zinc/01/98/79/336019879.db2.gz JBJWWDJXIQOWFA-SSDMNJCBSA-N 1 0 274.364 3.572 20 5 CHBDRO CC1(C)CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000380932525 336039788 /nfs/dbraw/zinc/03/97/88/336039788.db2.gz OQUJYGIRMMZEHJ-GFCCVEGCSA-N 1 0 280.343 3.792 20 5 CHBDRO COc1ccc(C[NH2+]C(C)(C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000383615535 336115630 /nfs/dbraw/zinc/11/56/30/336115630.db2.gz PHDADMZVMKLWAW-UHFFFAOYSA-N 1 0 280.368 3.518 20 5 CHBDRO C[C@H](CC(C)(C)C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000384637777 336128237 /nfs/dbraw/zinc/12/82/37/336128237.db2.gz AIIQFJGHVYDZOX-LLVKDONJSA-N 1 0 250.342 3.509 20 5 CHBDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000344632815 533819366 /nfs/dbraw/zinc/81/93/66/533819366.db2.gz SMXZDCQYTYKQPK-GFCCVEGCSA-N 1 0 288.347 3.607 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@H](C)CC2)cc1[N+](=O)[O-] ZINC000352801687 533928034 /nfs/dbraw/zinc/92/80/34/533928034.db2.gz TZCAQTLXUJBASE-LBPRGKRZSA-N 1 0 262.353 3.525 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]Cc2ccco2)c2cc([N+](=O)[O-])ccc21 ZINC000279227564 520525385 /nfs/dbraw/zinc/52/53/85/520525385.db2.gz ZRMXHZFVOHNKRC-OAHLLOKOSA-N 1 0 286.331 3.700 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H]1CCCCS1)c1cccc([N+](=O)[O-])c1 ZINC000156334943 522865083 /nfs/dbraw/zinc/86/50/83/522865083.db2.gz AKEPTQJTEBWTCR-HUUCEWRRSA-N 1 0 294.420 3.921 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000161630201 522919453 /nfs/dbraw/zinc/91/94/53/522919453.db2.gz SHRQPRHNBRZOMX-CABCVRRESA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]1C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000291489509 524568600 /nfs/dbraw/zinc/56/86/00/524568600.db2.gz GMCMBCZWTSJDFW-FUEXJSSKSA-N 1 0 296.317 3.585 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1C ZINC000048068871 524586414 /nfs/dbraw/zinc/58/64/14/524586414.db2.gz ZDCUYFLYWSTGNZ-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000280420541 525383942 /nfs/dbraw/zinc/38/39/42/525383942.db2.gz QQVJPFSLVMVRQT-WDEREUQCSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@@H]([NH2+]C[C@]1(C)CCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000126465916 525508390 /nfs/dbraw/zinc/50/83/90/525508390.db2.gz DFKJOHSUNGEICF-RISCZKNCSA-N 1 0 280.393 3.531 20 5 CHBDRO CSC[C@@H]1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000292453504 525653151 /nfs/dbraw/zinc/65/31/51/525653151.db2.gz PQTBXNRCVVKRHP-CHWSQXEVSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(CF)CC1 ZINC000295050746 526087929 /nfs/dbraw/zinc/08/79/29/526087929.db2.gz BJGIGBUCXSPFLL-GFCCVEGCSA-N 1 0 280.343 3.646 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCc2sccc21 ZINC000061329260 527400521 /nfs/dbraw/zinc/40/05/21/527400521.db2.gz SDHFXHUIEQTZJE-CYBMUJFWSA-N 1 0 288.372 3.824 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C1CCC(C(F)F)CC1 ZINC000282419818 527401363 /nfs/dbraw/zinc/40/13/63/527401363.db2.gz SOWVHQVREAZSCT-UHFFFAOYSA-N 1 0 284.306 3.508 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCC2=CCCCC2)c1 ZINC000013718154 567894066 /nfs/dbraw/zinc/89/40/66/567894066.db2.gz WYZGVMUTURQCTD-UHFFFAOYSA-N 1 0 260.337 3.575 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CC[C@H]2C2CC2)c(Cl)c1 ZINC000554089471 1120148974 /nfs/dbraw/zinc/14/89/74/1120148974.db2.gz SWJPOCREQHBVRP-JSGCOSHPSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@H]1CCCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001193509511 1122696199 /nfs/dbraw/zinc/69/61/99/1122696199.db2.gz ZZRDWWTWMDEWOO-NSHDSACASA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CC(C)(C)C ZINC000532550726 1125410874 /nfs/dbraw/zinc/41/08/74/1125410874.db2.gz AQEISARNYOVATF-LLVKDONJSA-N 1 0 250.342 3.634 20 5 CHBDRO CC(C)(C)[N@H+](Cc1ccccc1)Cc1cccnc1[N+](=O)[O-] ZINC000886042140 1125639310 /nfs/dbraw/zinc/63/93/10/1125639310.db2.gz WLLIMSURGAZVQU-UHFFFAOYSA-N 1 0 299.374 3.791 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000037494525 1125680250 /nfs/dbraw/zinc/68/02/50/1125680250.db2.gz SHZVTYZWXBCZDX-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1cccnc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000093159833 1125766565 /nfs/dbraw/zinc/76/65/65/1125766565.db2.gz OOIRMHPVNUCNFK-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO Cc1ccc(C[N@H+]2CCCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000482304837 1126750084 /nfs/dbraw/zinc/75/00/84/1126750084.db2.gz BCBPXTZLYSDICF-LBPRGKRZSA-N 1 0 262.353 3.525 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2coc3ccccc23)cc1 ZINC000159821481 1126753171 /nfs/dbraw/zinc/75/31/71/1126753171.db2.gz LVBWPAWKMFQVOS-UHFFFAOYSA-N 1 0 296.326 3.673 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000159945362 1126759459 /nfs/dbraw/zinc/75/94/59/1126759459.db2.gz QAMOILVOCULAON-UKRRQHHQSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[N@H+](CC1CCC1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000483131826 1126769034 /nfs/dbraw/zinc/76/90/34/1126769034.db2.gz RZXQNUSINSFEIT-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1cc2ccccc2cc1O[C@H](C)C[N+](C)(C)C ZINC001234106088 1130609264 /nfs/dbraw/zinc/60/92/64/1130609264.db2.gz NKLTYFGXCIGEPU-CQSZACIVSA-N 1 0 258.385 3.622 20 5 CHBDRO C[C@H](Cc1cccs1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000036992578 1126848780 /nfs/dbraw/zinc/84/87/80/1126848780.db2.gz PVZSVWOQLVOOQO-VXGBXAGGSA-N 1 0 290.388 3.938 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CCc1ccccn1 ZINC000182939866 1126879713 /nfs/dbraw/zinc/87/97/13/1126879713.db2.gz YMKGTUKCINQOIF-CQSZACIVSA-N 1 0 299.374 3.534 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCSCC1)c1ccc([N+](=O)[O-])cc1 ZINC000692465193 1130740292 /nfs/dbraw/zinc/74/02/92/1130740292.db2.gz MPGKOCHHJWVRHF-WCQYABFASA-N 1 0 280.393 3.531 20 5 CHBDRO CC[N@H+](CC(C)C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485718683 1126946048 /nfs/dbraw/zinc/94/60/48/1126946048.db2.gz SEZATZILKRFDEC-CYBMUJFWSA-N 1 0 264.369 3.942 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCCCCC1 ZINC000485797113 1126954052 /nfs/dbraw/zinc/95/40/52/1126954052.db2.gz XVNIURQAUACBGG-CYBMUJFWSA-N 1 0 262.353 3.840 20 5 CHBDRO CCCCCC1CCC(OCC[N+](C)(C)C)CC1 ZINC001224770435 1126980122 /nfs/dbraw/zinc/98/01/22/1126980122.db2.gz AUCVBMUAZIPJSI-UHFFFAOYSA-N 1 0 256.454 3.848 20 5 CHBDRO C[C@H](OCC[N+](C)(C)C)c1cccc2ccccc21 ZINC001224771964 1126984891 /nfs/dbraw/zinc/98/48/91/1126984891.db2.gz VBNVIAYEHJCQBC-AWEZNQCLSA-N 1 0 258.385 3.624 20 5 CHBDRO CC(C)CCC[C@H](C)CCO[C@H](C)C[N+](C)(C)C ZINC001224771811 1126984614 /nfs/dbraw/zinc/98/46/14/1126984614.db2.gz SABMXUYFAZFFEB-JKSUJKDBSA-N 1 0 258.470 3.950 20 5 CHBDRO CC[C@@H]([NH2+]C/C=C/c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000487266154 1127027292 /nfs/dbraw/zinc/02/72/92/1127027292.db2.gz IMKNGVQUXUGKPX-LAQIPUCWSA-N 1 0 297.358 3.744 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])ccc1F ZINC000271514060 1127087340 /nfs/dbraw/zinc/08/73/40/1127087340.db2.gz TXIGRNNISICSMM-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[NH2+]CCN(C)Cc1c2ccccc2cc2ccccc21 ZINC001204720297 1127138704 /nfs/dbraw/zinc/13/87/04/1127138704.db2.gz DFCGKGLQPGWTMS-UHFFFAOYSA-N 1 0 278.399 3.644 20 5 CHBDRO CC(C)=CCC[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000570941828 1127150018 /nfs/dbraw/zinc/15/00/18/1127150018.db2.gz PWNSSCQXPURLJP-AWEZNQCLSA-N 1 0 260.337 3.528 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1C=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000698194862 1127189543 /nfs/dbraw/zinc/18/95/43/1127189543.db2.gz HJSRWVVVRPQWRQ-ZFWWWQNUSA-N 1 0 260.337 3.744 20 5 CHBDRO Cc1ccnc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000285975208 1127250642 /nfs/dbraw/zinc/25/06/42/1127250642.db2.gz HJGHYRXNSFKUJA-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000590204438 1127251590 /nfs/dbraw/zinc/25/15/90/1127251590.db2.gz MMPXQBMFCIKLGR-HUUCEWRRSA-N 1 0 274.364 3.605 20 5 CHBDRO Cc1ccc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC001168400615 1127298376 /nfs/dbraw/zinc/29/83/76/1127298376.db2.gz BZSOBHUPGSWDDL-CWRNSKLLSA-N 1 0 288.391 3.914 20 5 CHBDRO CC1(F)CC([NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000591348196 1127299092 /nfs/dbraw/zinc/29/90/92/1127299092.db2.gz HJZDVZHHCPOKQX-NRAUKZCXSA-N 1 0 292.354 3.843 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC2=CCCC2)cc1[N+](=O)[O-] ZINC000592098264 1127335493 /nfs/dbraw/zinc/33/54/93/1127335493.db2.gz NHUNIHYRHNNCHA-LBPRGKRZSA-N 1 0 260.337 3.664 20 5 CHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C(C)C ZINC000355401587 1127338836 /nfs/dbraw/zinc/33/88/36/1127338836.db2.gz PMQQZSITQFEEGA-UHFFFAOYSA-N 1 0 280.368 3.612 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](C)CC(F)F)cccc1[N+](=O)[O-] ZINC000592392415 1127344382 /nfs/dbraw/zinc/34/43/82/1127344382.db2.gz SPBOBISJYHCXHR-GXSJLCMTSA-N 1 0 286.322 3.845 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)CC(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000592392353 1127344923 /nfs/dbraw/zinc/34/49/23/1127344923.db2.gz MQDJFYDQYSLIGL-VHSXEESVSA-N 1 0 272.295 3.537 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCS[C@H]2C)cc1[N+](=O)[O-] ZINC000592379124 1127345876 /nfs/dbraw/zinc/34/58/76/1127345876.db2.gz HIEQVVRNDIEGSE-FZMZJTMJSA-N 1 0 294.420 3.702 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCc2ccccc21 ZINC000594490966 1127418145 /nfs/dbraw/zinc/41/81/45/1127418145.db2.gz UYJOJZVPPKWAPE-SJORKVTESA-N 1 0 294.354 3.859 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594499288 1127418280 /nfs/dbraw/zinc/41/82/80/1127418280.db2.gz BYPWOVXROGIBRL-SMDDNHRTSA-N 1 0 262.353 3.606 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000594515399 1127420898 /nfs/dbraw/zinc/42/08/98/1127420898.db2.gz PPHCTDKFIAUEPD-OCCSQVGLSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H]2C[C@H]21)c1ccc([N+](=O)[O-])cc1 ZINC000594732235 1127429807 /nfs/dbraw/zinc/42/98/07/1127429807.db2.gz VOAVOQVSUWOVPH-ATVPRXPUSA-N 1 0 274.364 3.682 20 5 CHBDRO C[C@@]1(CC[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC1(F)F ZINC000594977374 1127438241 /nfs/dbraw/zinc/43/82/41/1127438241.db2.gz KZVLOCGDHDNECL-KXQLTZBTSA-N 1 0 296.317 3.633 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCC2(C)CC2)cccc1[N+](=O)[O-] ZINC000359008340 1127444265 /nfs/dbraw/zinc/44/42/65/1127444265.db2.gz WRQZVQUPULRRAL-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO CC[C@@H]([NH2+]CC1(C(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000359004629 1127444278 /nfs/dbraw/zinc/44/42/78/1127444278.db2.gz UOAUYXKRTLLHCL-GFCCVEGCSA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCC2(C)CC2)cc1[N+](=O)[O-] ZINC000359008336 1127444333 /nfs/dbraw/zinc/44/43/33/1127444333.db2.gz WQRKCOTXLCLULT-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C1CCC(F)CC1 ZINC000594988754 1127444555 /nfs/dbraw/zinc/44/45/55/1127444555.db2.gz DBGOLXDZHFYIHY-ZBOXLXRLSA-N 1 0 298.333 3.740 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CC=CCC1 ZINC000595005231 1127445163 /nfs/dbraw/zinc/44/51/63/1127445163.db2.gz FJNPBDMDEPQHDT-STQMWFEESA-N 1 0 290.363 3.610 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)c1ccccn1 ZINC000595051999 1127451152 /nfs/dbraw/zinc/45/11/52/1127451152.db2.gz ZZERNHVODBFYAP-ZIAGYGMSSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000595050140 1127451317 /nfs/dbraw/zinc/45/13/17/1127451317.db2.gz QDXLQVHWZOOIRL-GXTWGEPZSA-N 1 0 299.374 3.753 20 5 CHBDRO CC1(C)CC([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000595108413 1127453167 /nfs/dbraw/zinc/45/31/67/1127453167.db2.gz ZJYRKNCRFYBARN-HNNXBMFYSA-N 1 0 288.391 3.694 20 5 CHBDRO CC(C)CC1([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595094778 1127455510 /nfs/dbraw/zinc/45/55/10/1127455510.db2.gz IUYWUVOSLBPXKM-GFCCVEGCSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1noc(C[NH2+][C@H](CCC(C)C)C(C)(C)C)c1[N+](=O)[O-] ZINC000595420505 1127462272 /nfs/dbraw/zinc/46/22/72/1127462272.db2.gz GUHWNUCFJOPMHW-CYBMUJFWSA-N 1 0 297.399 3.832 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC2CC=CC2)cc1[N+](=O)[O-] ZINC000595418122 1127462300 /nfs/dbraw/zinc/46/23/00/1127462300.db2.gz CHSZKPWKCDIIOF-LBPRGKRZSA-N 1 0 260.337 3.520 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])C1CCCCC1 ZINC000595423187 1127462512 /nfs/dbraw/zinc/46/25/12/1127462512.db2.gz MKJBMBMBXDBPHL-CYBMUJFWSA-N 1 0 295.383 3.730 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CCF)C1 ZINC000595754387 1127475249 /nfs/dbraw/zinc/47/52/49/1127475249.db2.gz APBKLWMIZUGQNI-STQMWFEESA-N 1 0 280.343 3.727 20 5 CHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)C1CCC(F)CC1 ZINC000595817663 1127475824 /nfs/dbraw/zinc/47/58/24/1127475824.db2.gz AUZFNDIKSYYTOE-GRTSSRMGSA-N 1 0 294.370 3.644 20 5 CHBDRO C[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000360028749 1127487273 /nfs/dbraw/zinc/48/72/73/1127487273.db2.gz XJNHDQXMVKAZBX-AOOOYVTPSA-N 1 0 268.744 3.621 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000596650701 1127515124 /nfs/dbraw/zinc/51/51/24/1127515124.db2.gz KEFNRRGBCXFKBF-APPDUMDISA-N 1 0 297.358 3.515 20 5 CHBDRO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CC1CCC1 ZINC000361480952 1127566675 /nfs/dbraw/zinc/56/66/75/1127566675.db2.gz IBJWOGISOMKFDP-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@H]1CC[C@@H]1[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602651885 1127600438 /nfs/dbraw/zinc/60/04/38/1127600438.db2.gz AEVDWYOWZAOVHF-KWQFWETISA-N 1 0 288.269 3.502 20 5 CHBDRO CCCc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])s1 ZINC000598641295 1127629907 /nfs/dbraw/zinc/62/99/07/1127629907.db2.gz QPTKAXNQXPHZCY-UHFFFAOYSA-N 1 0 290.388 3.899 20 5 CHBDRO CC(C)(C)C[C@@H]1C[C@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000593661301 1127649817 /nfs/dbraw/zinc/64/98/17/1127649817.db2.gz XDNSISZQVRGBTO-WDEREUQCSA-N 1 0 268.382 3.571 20 5 CHBDRO CC(C)C[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C ZINC000603438462 1127649829 /nfs/dbraw/zinc/64/98/29/1127649829.db2.gz XTZLOYUVADDZGP-LBPRGKRZSA-N 1 0 299.802 3.636 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCc2ccc(Cl)s2)c1 ZINC000061115389 1127650581 /nfs/dbraw/zinc/65/05/81/1127650581.db2.gz NWNCOYNFGDZPNC-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2CC=CC2)cccc1[N+](=O)[O-] ZINC000599065821 1127654213 /nfs/dbraw/zinc/65/42/13/1127654213.db2.gz RIAKRSIEFWRRLU-LBPRGKRZSA-N 1 0 260.337 3.520 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1CC=CC1 ZINC000599063510 1127654330 /nfs/dbraw/zinc/65/43/30/1127654330.db2.gz CIZYVTJGMXYJQE-LBPRGKRZSA-N 1 0 260.337 3.520 20 5 CHBDRO CCC[C@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)OCC ZINC000599061676 1127654802 /nfs/dbraw/zinc/65/48/02/1127654802.db2.gz QZLXHBVTCMYNLG-DZGCQCFKSA-N 1 0 294.395 3.759 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](C1CC1)C1CCCCC1 ZINC000061163085 1127659178 /nfs/dbraw/zinc/65/91/78/1127659178.db2.gz CFFVPZYHWBTKNG-UHFFFAOYSA-N 1 0 274.364 3.892 20 5 CHBDRO Cc1sccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296045124 1127661454 /nfs/dbraw/zinc/66/14/54/1127661454.db2.gz OFZOUYAZRHNHNQ-JTQLQIEISA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C2(C3CCC3)CC2)cccc1[N+](=O)[O-] ZINC000593721353 1127665969 /nfs/dbraw/zinc/66/59/69/1127665969.db2.gz PKOLVSMKOVZFRB-LBPRGKRZSA-N 1 0 274.364 3.887 20 5 CHBDRO CC[N@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000603837810 1127675398 /nfs/dbraw/zinc/67/53/98/1127675398.db2.gz IFVJOYWUQQJUBS-UHFFFAOYSA-N 1 0 284.359 3.925 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000603843508 1127675564 /nfs/dbraw/zinc/67/55/64/1127675564.db2.gz GFRCSGVYCPTQHQ-ZDUSSCGKSA-N 1 0 262.353 3.525 20 5 CHBDRO C[C@@H]1CCC[C@H]([N@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000603873871 1127679829 /nfs/dbraw/zinc/67/98/29/1127679829.db2.gz JAXMJRSVWSNIIP-CJNGLKHVSA-N 1 0 276.380 3.648 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCC(C)(F)F)cccc1[N+](=O)[O-] ZINC000297311633 1127692978 /nfs/dbraw/zinc/69/29/78/1127692978.db2.gz MWPPCCJNZMDHCH-JTQLQIEISA-N 1 0 272.295 3.599 20 5 CHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1ccsc1[N+](=O)[O-] ZINC000604433516 1127705661 /nfs/dbraw/zinc/70/56/61/1127705661.db2.gz SWXRDDQBUULGPO-LBPRGKRZSA-N 1 0 297.424 3.723 20 5 CHBDRO CCC(CC)[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000604434809 1127705680 /nfs/dbraw/zinc/70/56/80/1127705680.db2.gz QTDRVSPHHXFPBS-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO CCC(CC)[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C1CC1 ZINC000604434831 1127705751 /nfs/dbraw/zinc/70/57/51/1127705751.db2.gz YJLNABALQPOBGK-UHFFFAOYSA-N 1 0 292.379 3.756 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000604484441 1127706508 /nfs/dbraw/zinc/70/65/08/1127706508.db2.gz NECXRDKVRCWMHH-KRWDZBQOSA-N 1 0 298.342 3.638 20 5 CHBDRO CCN(Cc1cccc(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000061799826 1127718411 /nfs/dbraw/zinc/71/84/11/1127718411.db2.gz SOILPMNKDBGHFG-UHFFFAOYSA-N 1 0 288.322 3.756 20 5 CHBDRO C[C@@H]1CC[C@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000230417776 1127753550 /nfs/dbraw/zinc/75/35/50/1127753550.db2.gz QXAQJMFPQQRXDS-MNOVXSKESA-N 1 0 282.771 3.774 20 5 CHBDRO C[C@@H]1CCC[C@@H]1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000230672706 1127770837 /nfs/dbraw/zinc/77/08/37/1127770837.db2.gz QEPMIIYCXQPYFS-GHMZBOCLSA-N 1 0 282.771 3.774 20 5 CHBDRO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000466903937 1127949600 /nfs/dbraw/zinc/94/96/00/1127949600.db2.gz BALZSDCOPXRKLB-FZMZJTMJSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000540152678 1127965229 /nfs/dbraw/zinc/96/52/29/1127965229.db2.gz KZDBLQZUEIVKGC-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000468044374 1127990049 /nfs/dbraw/zinc/99/00/49/1127990049.db2.gz HLKREVCOIUKOLK-WCBMZHEXSA-N 1 0 290.285 3.895 20 5 CHBDRO CC[N@H+](CCC1CC1)Cc1ccc([N+](=O)[O-])cc1C ZINC000544942477 1127991321 /nfs/dbraw/zinc/99/13/21/1127991321.db2.gz YMPKGISDXGRWNX-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccsc1 ZINC000468635538 1128014150 /nfs/dbraw/zinc/01/41/50/1128014150.db2.gz QKYBBTSMKMWLOR-KPKJPENVSA-N 1 0 288.372 3.849 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CC=CCC1 ZINC000468650538 1128015360 /nfs/dbraw/zinc/01/53/60/1128015360.db2.gz YUBCSTGZFDHHMP-IPJDOKCGSA-N 1 0 286.375 3.944 20 5 CHBDRO Cc1cccc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000541388676 1128020485 /nfs/dbraw/zinc/02/04/85/1128020485.db2.gz CMLJBHTZMKEULQ-QGZVFWFLSA-N 1 0 296.370 3.893 20 5 CHBDRO C[C@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000541587451 1128030032 /nfs/dbraw/zinc/03/00/32/1128030032.db2.gz HFTRLBLVYRZKMA-AWEZNQCLSA-N 1 0 284.359 3.563 20 5 CHBDRO C[C@H]([N@H+](C)Cc1c(F)cccc1[N+](=O)[O-])C(C)(C)C ZINC000609144530 1128049482 /nfs/dbraw/zinc/04/94/82/1128049482.db2.gz BYJFFFOBQXUBCO-JTQLQIEISA-N 1 0 268.332 3.600 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC2(CCC2)C1 ZINC000470179404 1128064656 /nfs/dbraw/zinc/06/46/56/1128064656.db2.gz XEFBYCZGELMXCN-UVTDQMKNSA-N 1 0 286.375 3.874 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000470179227 1128065335 /nfs/dbraw/zinc/06/53/35/1128065335.db2.gz URHSLBGGJUBKFZ-WQMJKPAKSA-N 1 0 286.375 3.730 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC=C(F)C1 ZINC000470203429 1128065699 /nfs/dbraw/zinc/06/56/99/1128065699.db2.gz PZXRHEZBRUMHHZ-WQLSENKSSA-N 1 0 276.311 3.557 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492633265 1128107307 /nfs/dbraw/zinc/10/73/07/1128107307.db2.gz UWXLCGLNNJIKJD-ZDUSSCGKSA-N 1 0 292.379 3.758 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC=C(C)CC1 ZINC000492784150 1128113153 /nfs/dbraw/zinc/11/31/53/1128113153.db2.gz OMBNNKYGOQDDMY-CYBMUJFWSA-N 1 0 260.337 3.616 20 5 CHBDRO CCC(C)(C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000074320918 1128125802 /nfs/dbraw/zinc/12/58/02/1128125802.db2.gz MLOQBSIVJNZPAX-UHFFFAOYSA-N 1 0 250.342 3.524 20 5 CHBDRO CC(C)[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761507756 1128131783 /nfs/dbraw/zinc/13/17/83/1128131783.db2.gz VXKFNMQSBFABNS-JTQLQIEISA-N 1 0 270.760 3.725 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761506005 1128132335 /nfs/dbraw/zinc/13/23/35/1128132335.db2.gz LNUQOKILWMNWKK-SNVBAGLBSA-N 1 0 270.760 3.869 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609195426 1128170841 /nfs/dbraw/zinc/17/08/41/1128170841.db2.gz ORDLVCDIBNYRGF-AWEZNQCLSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1cccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000032252264 1128265180 /nfs/dbraw/zinc/26/51/80/1128265180.db2.gz KZEGVDKVDBOOQJ-UHFFFAOYSA-N 1 0 270.332 3.535 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000495369146 1128276084 /nfs/dbraw/zinc/27/60/84/1128276084.db2.gz OJHPLUDDURPALI-CYBMUJFWSA-N 1 0 284.787 3.815 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(F)nc1)c1cccc([N+](=O)[O-])c1 ZINC000930208262 1128307738 /nfs/dbraw/zinc/30/77/38/1128307738.db2.gz LJLNXYHFSLZNSD-MNOVXSKESA-N 1 0 289.310 3.541 20 5 CHBDRO Cc1cc(NC2CC(C)(C)[NH2+]C(C)(C)C2)ccc1[N+](=O)[O-] ZINC000301083296 1128322313 /nfs/dbraw/zinc/32/23/13/1128322313.db2.gz HANUWJMFOIZTTR-UHFFFAOYSA-N 1 0 291.395 3.624 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000930593195 1128326260 /nfs/dbraw/zinc/32/62/60/1128326260.db2.gz FPXAWOZRLKILOI-ZNIXKSQXSA-N 1 0 296.317 3.537 20 5 CHBDRO CC[C@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)F ZINC000932179274 1128398766 /nfs/dbraw/zinc/39/87/66/1128398766.db2.gz YBXMHHQKHLNGRO-MNOVXSKESA-N 1 0 286.322 3.927 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000917096886 1128480959 /nfs/dbraw/zinc/48/09/59/1128480959.db2.gz HKIPXWYTNBDCGR-DOMZBBRYSA-N 1 0 276.380 3.914 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C1CC=CC1 ZINC000130505677 1128493908 /nfs/dbraw/zinc/49/39/08/1128493908.db2.gz IHXOKNYQBWPKIY-BBRMVZONSA-N 1 0 286.375 3.614 20 5 CHBDRO CCCC[N@H+](CC)Cc1ccc([N+](=O)[O-])cc1C ZINC000569858833 1128610702 /nfs/dbraw/zinc/61/07/02/1128610702.db2.gz QATQQPSALSSNDB-UHFFFAOYSA-N 1 0 250.342 3.525 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@H](F)C1 ZINC000570720115 1128630421 /nfs/dbraw/zinc/63/04/21/1128630421.db2.gz ZVLDHTVUGOKUKC-SNPRPXQTSA-N 1 0 294.370 3.786 20 5 CHBDRO [NH3+]CC1(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC000600789329 1128682057 /nfs/dbraw/zinc/68/20/57/1128682057.db2.gz UTEWVTHOOPSEBQ-UHFFFAOYSA-N 1 0 282.343 3.543 20 5 CHBDRO Cc1ncc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000601150204 1128701413 /nfs/dbraw/zinc/70/14/13/1128701413.db2.gz YAAMGSQFMJXJNY-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2C)s1 ZINC000601149407 1128701566 /nfs/dbraw/zinc/70/15/66/1128701566.db2.gz JYDXLLWPCLMUNU-JTQLQIEISA-N 1 0 291.376 3.519 20 5 CHBDRO Cc1c(C[NH2+]CCC2=CCCCC2)cccc1[N+](=O)[O-] ZINC000048348185 1128702212 /nfs/dbraw/zinc/70/22/12/1128702212.db2.gz LJUDQQQAZNVJLA-UHFFFAOYSA-N 1 0 274.364 3.883 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCC12CC2)c1ccc([N+](=O)[O-])cc1 ZINC000601289234 1128708915 /nfs/dbraw/zinc/70/89/15/1128708915.db2.gz JYHOESUIAUWXET-RISCZKNCSA-N 1 0 260.337 3.578 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1(C)CCCC1 ZINC000609419911 1128714248 /nfs/dbraw/zinc/71/42/48/1128714248.db2.gz LGIKDVSBLRQKOD-UHFFFAOYSA-N 1 0 292.379 3.663 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])C(C)(C)C ZINC000578337681 1128714412 /nfs/dbraw/zinc/71/44/12/1128714412.db2.gz NSQZYRBQIDUQCB-MFKMUULPSA-N 1 0 262.353 3.606 20 5 CHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609672505 1128721392 /nfs/dbraw/zinc/72/13/92/1128721392.db2.gz HLZRRCDVNYGBBU-RHSMWYFYSA-N 1 0 296.370 3.973 20 5 CHBDRO CC(C)C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000609705255 1128722870 /nfs/dbraw/zinc/72/28/70/1128722870.db2.gz MIOCLTRSAIVUQF-UHFFFAOYSA-N 1 0 282.771 3.869 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCC(C)(C)C ZINC000610089215 1128738612 /nfs/dbraw/zinc/73/86/12/1128738612.db2.gz LMSSECWQPZYNDD-UHFFFAOYSA-N 1 0 294.395 3.909 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001307686303 1117928770 /nfs/dbraw/zinc/92/87/70/1117928770.db2.gz SPJRODKFXSNRBZ-MEBBXXQBSA-N 1 0 298.333 3.884 20 5 CHBDRO CC(C)(CC[NH2+]Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000336890646 1118151926 /nfs/dbraw/zinc/15/19/26/1118151926.db2.gz NQBFKDFGQUVUBZ-UHFFFAOYSA-N 1 0 268.382 3.572 20 5 CHBDRO Cc1cc(N[C@H]2C[N@@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000536021127 1118299559 /nfs/dbraw/zinc/29/95/59/1118299559.db2.gz BBHQKJBIJVHULZ-INIZCTEOSA-N 1 0 297.358 3.502 20 5 CHBDRO Cc1ccsc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000091437035 1118579834 /nfs/dbraw/zinc/57/98/34/1118579834.db2.gz CWLMRFXGSCAGCH-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2CC(C)(C)C2)cc1[N+](=O)[O-] ZINC000395309747 1118761925 /nfs/dbraw/zinc/76/19/25/1118761925.db2.gz XQGLQMFJKDASAR-NSHDSACASA-N 1 0 262.353 3.742 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H]1CCC[C@H]1CCCF ZINC000510671355 1118785501 /nfs/dbraw/zinc/78/55/01/1118785501.db2.gz ZLHCIONWOLPDSG-ZFWWWQNUSA-N 1 0 294.370 3.645 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000610796090 1118872374 /nfs/dbraw/zinc/87/23/74/1118872374.db2.gz GSVLYKUBARXWBY-PWSUYJOCSA-N 1 0 250.342 3.742 20 5 CHBDRO CCC[C@@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000610796077 1118872574 /nfs/dbraw/zinc/87/25/74/1118872574.db2.gz DYNVJEWWPMYOMR-NEPJUHHUSA-N 1 0 250.342 3.742 20 5 CHBDRO Cc1occc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000610805276 1118893486 /nfs/dbraw/zinc/89/34/86/1118893486.db2.gz PSNYXMHDALZNQM-LLVKDONJSA-N 1 0 274.320 3.655 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000084987747 1119016354 /nfs/dbraw/zinc/01/63/54/1119016354.db2.gz BUMQIQGFRFJRJM-IPYPFGDCSA-N 1 0 276.380 3.552 20 5 CHBDRO CCc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)o1 ZINC000478476881 1119069809 /nfs/dbraw/zinc/06/98/09/1119069809.db2.gz CYWHFVMYADOXPQ-LBPRGKRZSA-N 1 0 288.347 3.909 20 5 CHBDRO CC(C)[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000158724909 1119153151 /nfs/dbraw/zinc/15/31/51/1119153151.db2.gz NBTPSHGWSMOKKH-UHFFFAOYSA-N 1 0 274.320 3.695 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC=CCC3)o2)cc1 ZINC000611521120 1119164841 /nfs/dbraw/zinc/16/48/41/1119164841.db2.gz AIDLFHSBLSFTDZ-UHFFFAOYSA-N 1 0 284.315 3.617 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC001307660723 1128828038 /nfs/dbraw/zinc/82/80/38/1128828038.db2.gz SFDXKINVFSPGBB-CJNGLKHVSA-N 1 0 292.379 3.532 20 5 CHBDRO CC1(C)CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000000019146 1119295240 /nfs/dbraw/zinc/29/52/40/1119295240.db2.gz NFXKBHAAVPRMTH-UHFFFAOYSA-N 1 0 276.380 3.649 20 5 CHBDRO CC[N@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1 ZINC000248254224 1119337117 /nfs/dbraw/zinc/33/71/17/1119337117.db2.gz NLMMGGYLKAGBLI-UHFFFAOYSA-N 1 0 276.361 3.678 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC[C@@H](F)C1 ZINC000515059663 1119607666 /nfs/dbraw/zinc/60/76/66/1119607666.db2.gz NLKFMKROESKHEV-XQQFMLRXSA-N 1 0 280.343 3.835 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccsc1 ZINC000612576476 1119800201 /nfs/dbraw/zinc/80/02/01/1119800201.db2.gz HOFQXJQEDOKSJU-UHFFFAOYSA-N 1 0 276.361 3.597 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@H]2CCCCC2(F)F)cs1 ZINC000295085669 1119852629 /nfs/dbraw/zinc/85/26/29/1119852629.db2.gz ITHYHQXIBWSBFA-SNVBAGLBSA-N 1 0 290.335 3.571 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCC[C@H]3C[C@H]32)c1 ZINC000694333532 1119858772 /nfs/dbraw/zinc/85/87/72/1119858772.db2.gz WLOLQWQPUGMNMF-MRCXROJRSA-N 1 0 280.755 3.526 20 5 CHBDRO CC(C)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000103173321 1120068565 /nfs/dbraw/zinc/06/85/65/1120068565.db2.gz HDDGNZNFGLOKCZ-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO C[C@H](c1cccnc1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350390726 1120074626 /nfs/dbraw/zinc/07/46/26/1120074626.db2.gz KZWLLEZXCVFUJX-DEBLGDTFSA-N 1 0 297.358 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCSC(C)C ZINC000554377535 1120159540 /nfs/dbraw/zinc/15/95/40/1120159540.db2.gz OSAQXNFWPAYVHV-GFCCVEGCSA-N 1 0 282.409 3.695 20 5 CHBDRO C[C@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000086887711 1120223978 /nfs/dbraw/zinc/22/39/78/1120223978.db2.gz KNAFOQAXNSFZEI-JSGCOSHPSA-N 1 0 262.353 3.653 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+](CC2CC2)CC2CC2)c(Cl)c1 ZINC000542930482 1120259084 /nfs/dbraw/zinc/25/90/84/1120259084.db2.gz NGFZLFYRWMXOIH-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO CC[C@H](C)C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000481077480 1120262910 /nfs/dbraw/zinc/26/29/10/1120262910.db2.gz QEUZHCNFOMJOTG-LBPRGKRZSA-N 1 0 262.353 3.605 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000020084130 1120279449 /nfs/dbraw/zinc/27/94/49/1120279449.db2.gz XUUKKMFFDJOXQQ-OAHLLOKOSA-N 1 0 274.320 3.819 20 5 CHBDRO Cc1cccc([C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000541388095 1120323182 /nfs/dbraw/zinc/32/31/82/1120323182.db2.gz ZRJBWRAHASTTMW-KRWDZBQOSA-N 1 0 296.370 3.893 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@]12C[C@H]1CCCC2 ZINC000709097753 1120325219 /nfs/dbraw/zinc/32/52/19/1120325219.db2.gz SACZWRUPGVNPHL-BJJXKVORSA-N 1 0 274.364 3.653 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccc(C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000161613715 1120403732 /nfs/dbraw/zinc/40/37/32/1120403732.db2.gz IDYHLYMNYWPCRX-QGZVFWFLSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000313860254 1120413446 /nfs/dbraw/zinc/41/34/46/1120413446.db2.gz VVJWJCZDIMKBQO-SJCJKPOMSA-N 1 0 282.343 3.933 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000313860255 1120413625 /nfs/dbraw/zinc/41/36/25/1120413625.db2.gz VVJWJCZDIMKBQO-SJKOYZFVSA-N 1 0 282.343 3.933 20 5 CHBDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000313860256 1120413954 /nfs/dbraw/zinc/41/39/54/1120413954.db2.gz VVJWJCZDIMKBQO-YVEFUNNKSA-N 1 0 282.343 3.933 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2C2CCCC2)c(F)c1 ZINC000313868536 1120415314 /nfs/dbraw/zinc/41/53/14/1120415314.db2.gz YIMVJLZQEWVHCG-MRXNPFEDSA-N 1 0 292.354 3.889 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000314288469 1120429766 /nfs/dbraw/zinc/42/97/66/1120429766.db2.gz XBCCIWYEVUTQLM-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000020091137 1120492888 /nfs/dbraw/zinc/49/28/88/1120492888.db2.gz CIVBBNBGBMVLEU-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO C[C@@H](c1cccs1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000053428462 1120497727 /nfs/dbraw/zinc/49/77/27/1120497727.db2.gz IYFGTEMPODXBFK-NSHDSACASA-N 1 0 276.361 3.849 20 5 CHBDRO Cc1ccc(NCCCCC[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000555229856 1120559361 /nfs/dbraw/zinc/55/93/61/1120559361.db2.gz PEUNLDGODAZLQE-UHFFFAOYSA-N 1 0 291.395 3.581 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000500369145 1120598448 /nfs/dbraw/zinc/59/84/48/1120598448.db2.gz GJVNZPVOLKNABR-CYBMUJFWSA-N 1 0 298.333 3.818 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCSC2(CCC2)C1 ZINC000922842886 1120609411 /nfs/dbraw/zinc/60/94/11/1120609411.db2.gz QNYXWRULNVAJMR-CYBMUJFWSA-N 1 0 292.404 3.503 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000132457368 1120691372 /nfs/dbraw/zinc/69/13/72/1120691372.db2.gz QHSWJXQQUZSBAO-DZGCQCFKSA-N 1 0 294.420 3.921 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)o1 ZINC000044730371 1120731384 /nfs/dbraw/zinc/73/13/84/1120731384.db2.gz QTVDIAZWDCDPOS-GFCCVEGCSA-N 1 0 288.347 3.964 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3c2cccc3F)cc1 ZINC000111158746 1120746873 /nfs/dbraw/zinc/74/68/73/1120746873.db2.gz WEAWQAVFKLBCHJ-MRXNPFEDSA-N 1 0 286.306 3.511 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000051634439 1120963814 /nfs/dbraw/zinc/96/38/14/1120963814.db2.gz DTYGGLZBWLAAHD-INIZCTEOSA-N 1 0 288.322 3.975 20 5 CHBDRO CCc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000584665531 1120967087 /nfs/dbraw/zinc/96/70/87/1120967087.db2.gz PRNIDHXJYIPKTN-QGZVFWFLSA-N 1 0 296.370 3.934 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CSC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000354019482 1121017729 /nfs/dbraw/zinc/01/77/29/1121017729.db2.gz YVWJWEDDEIXNOT-CQDKDKBSSA-N 1 0 294.420 3.777 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000343979484 1121028930 /nfs/dbraw/zinc/02/89/30/1121028930.db2.gz NHZJAMIEMQLFRY-IUODEOHRSA-N 1 0 285.347 3.792 20 5 CHBDRO Cc1cc(N[C@H]2CC=CCC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000228485333 1121030099 /nfs/dbraw/zinc/03/00/99/1121030099.db2.gz YAZVRPKYFHVXKQ-LBPRGKRZSA-N 1 0 283.331 3.972 20 5 CHBDRO C[C@H]([NH2+]C[C@@]1(C)CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000134110779 1121056059 /nfs/dbraw/zinc/05/60/59/1121056059.db2.gz DHRFDHZLAJZAJW-SMDDNHRTSA-N 1 0 280.393 3.531 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1C ZINC000059403225 1121062520 /nfs/dbraw/zinc/06/25/20/1121062520.db2.gz NJVZTEFEEKYYGH-UHFFFAOYSA-N 1 0 298.386 3.968 20 5 CHBDRO C[C@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000512178396 1121141780 /nfs/dbraw/zinc/14/17/80/1121141780.db2.gz ILQNTWSNVKUJGR-PODYEWJSSA-N 1 0 274.364 3.730 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000500495112 1121286709 /nfs/dbraw/zinc/28/67/09/1121286709.db2.gz ATXMEDJRPDBCNW-HNNXBMFYSA-N 1 0 276.380 3.914 20 5 CHBDRO CC[C@H]([NH2+][C@@H](CC)[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000246376233 1121295464 /nfs/dbraw/zinc/29/54/64/1121295464.db2.gz JSHPTOIXFZQDJX-HRCADAONSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000042857647 1121318760 /nfs/dbraw/zinc/31/87/60/1121318760.db2.gz JVHYJTFUOJQSRF-TZMCWYRMSA-N 1 0 262.353 3.511 20 5 CHBDRO CCc1cccnc1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175898971 1121492101 /nfs/dbraw/zinc/49/21/01/1121492101.db2.gz HFUSNSUQYHNAHK-PKNBQFBNSA-N 1 0 269.304 3.635 20 5 CHBDRO Cc1c(C[N@H+]2CC[C@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000466705815 1121556583 /nfs/dbraw/zinc/55/65/83/1121556583.db2.gz ADCYIHVEGIUGKC-CQSZACIVSA-N 1 0 276.380 3.771 20 5 CHBDRO CC1(C)CCC[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000063067152 1121623128 /nfs/dbraw/zinc/62/31/28/1121623128.db2.gz PSMPTXSDQMBFBG-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CCC[C@H](C)[NH2+][C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000611248318 1121632129 /nfs/dbraw/zinc/63/21/29/1121632129.db2.gz RSHNUAPFPTZGIL-NWDGAFQWSA-N 1 0 280.368 3.833 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000611293072 1121635146 /nfs/dbraw/zinc/63/51/46/1121635146.db2.gz AEOMFMCUDYEGIZ-BRLPQQTGSA-N 1 0 297.358 3.662 20 5 CHBDRO O=[N+]([O-])c1ccsc1NCCCCC[NH+]1CCCCC1 ZINC000611412100 1121646116 /nfs/dbraw/zinc/64/61/16/1121646116.db2.gz RPMMERRFQOWFKX-UHFFFAOYSA-N 1 0 297.424 3.724 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC2(CC2)CC1 ZINC000611516844 1121654052 /nfs/dbraw/zinc/65/40/52/1121654052.db2.gz SRNXLLSZKIPXPR-CYBMUJFWSA-N 1 0 274.364 3.840 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000611516948 1121654228 /nfs/dbraw/zinc/65/42/28/1121654228.db2.gz QAEBHUAKZBSNKK-WDEREUQCSA-N 1 0 284.306 3.551 20 5 CHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000542632229 1121714075 /nfs/dbraw/zinc/71/40/75/1121714075.db2.gz PQTFPNCDPKUVED-CQSZACIVSA-N 1 0 262.353 3.749 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCC23CCC3)cc1[N+](=O)[O-] ZINC000619723955 1129008494 /nfs/dbraw/zinc/00/84/94/1129008494.db2.gz GXXFUCSTSVFQNQ-DOMZBBRYSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000037770575 1129008726 /nfs/dbraw/zinc/00/87/26/1129008726.db2.gz QQGSWWRZPMYRAA-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC23CCC3)cc1[N+](=O)[O-] ZINC000619723957 1129009044 /nfs/dbraw/zinc/00/90/44/1129009044.db2.gz GXXFUCSTSVFQNQ-SWLSCSKDSA-N 1 0 274.364 3.887 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cc(Cl)cs2)cc1[N+](=O)[O-] ZINC001179386275 1121875260 /nfs/dbraw/zinc/87/52/60/1121875260.db2.gz KBIVTCXQMHWABU-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO CCC(CC)C[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC001179686567 1121898328 /nfs/dbraw/zinc/89/83/28/1121898328.db2.gz ZYTWWKQYVWSBMH-LBPRGKRZSA-N 1 0 264.369 3.724 20 5 CHBDRO Cc1ccnc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000616749140 1121935130 /nfs/dbraw/zinc/93/51/30/1121935130.db2.gz SHCGGYBHHHURDI-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc[nH]1 ZINC000774265560 1122149830 /nfs/dbraw/zinc/14/98/30/1122149830.db2.gz FTIJCYKLIRPLTK-BZNIZROVSA-N 1 0 285.347 3.651 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccc[nH]1 ZINC000774265558 1122150127 /nfs/dbraw/zinc/15/01/27/1122150127.db2.gz FTIJCYKLIRPLTK-BDJLRTHQSA-N 1 0 285.347 3.651 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@]23C[C@H]2CCC3)cc1Cl ZINC001183938491 1122245879 /nfs/dbraw/zinc/24/58/79/1122245879.db2.gz DEXRJSRKUKOIRO-RISCZKNCSA-N 1 0 280.755 3.528 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CCC(C)C)cc1[N+](=O)[O-] ZINC000504919570 1122309588 /nfs/dbraw/zinc/30/95/88/1122309588.db2.gz LHZMHIWKMUFLLT-GFCCVEGCSA-N 1 0 280.368 3.690 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@H]12 ZINC000515548294 1122509386 /nfs/dbraw/zinc/50/93/86/1122509386.db2.gz RHIXYHKHOLELLH-KBRIMQKVSA-N 1 0 288.391 3.995 20 5 CHBDRO C[C@H]1CCCC[C@@H]1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001191521338 1122604414 /nfs/dbraw/zinc/60/44/14/1122604414.db2.gz PTNYHDIHEHTMDF-DZGCQCFKSA-N 1 0 288.391 3.779 20 5 CHBDRO C[C@H]1CCCC[C@H]1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001191521341 1122604735 /nfs/dbraw/zinc/60/47/35/1122604735.db2.gz PTNYHDIHEHTMDF-ZFWWWQNUSA-N 1 0 288.391 3.779 20 5 CHBDRO Cc1cccc(C[N@@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000506205313 1122690986 /nfs/dbraw/zinc/69/09/86/1122690986.db2.gz RMSVGEHDMAONOH-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCCC3(CCCC3)C2)c1 ZINC000438368485 1122694892 /nfs/dbraw/zinc/69/48/92/1122694892.db2.gz BNPZTRJPODXYAD-UHFFFAOYSA-N 1 0 274.364 3.751 20 5 CHBDRO CC(C)C(C)(C)C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000438369924 1122697248 /nfs/dbraw/zinc/69/72/48/1122697248.db2.gz AGSFWZAMPNRKGL-VQHVLOKHSA-N 1 0 276.380 3.880 20 5 CHBDRO CCc1ccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC001193743772 1122712241 /nfs/dbraw/zinc/71/22/41/1122712241.db2.gz UKJAEOVZPHOTLS-UHFFFAOYSA-N 1 0 298.386 3.832 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H]1CC=CCC1 ZINC000506741886 1122819032 /nfs/dbraw/zinc/81/90/32/1122819032.db2.gz CARHOOMEKFPMDU-KGLIPLIRSA-N 1 0 274.364 3.944 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)C(C)(C)C ZINC001195712692 1122884532 /nfs/dbraw/zinc/88/45/32/1122884532.db2.gz NKCKNYOQVQCTLB-GFCCVEGCSA-N 1 0 294.395 3.906 20 5 CHBDRO COc1cc(C[N@H+](C(C)C)C2CCC2)c([N+](=O)[O-])cc1F ZINC000184262519 1122885939 /nfs/dbraw/zinc/88/59/39/1122885939.db2.gz FIGLOTPINIBIPA-UHFFFAOYSA-N 1 0 296.342 3.505 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000426822127 1122917661 /nfs/dbraw/zinc/91/76/61/1122917661.db2.gz ZZFLYCVNWQJXRZ-RYUDHWBXSA-N 1 0 294.782 3.870 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OCC ZINC000506993993 1122917670 /nfs/dbraw/zinc/91/76/70/1122917670.db2.gz CCWPKMYHXNZIFS-LBPRGKRZSA-N 1 0 280.368 3.614 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)c1cccs1 ZINC000543616611 1122944417 /nfs/dbraw/zinc/94/44/17/1122944417.db2.gz JNRGQOQKDFHARO-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000086887712 1122944849 /nfs/dbraw/zinc/94/48/49/1122944849.db2.gz KNAFOQAXNSFZEI-TZMCWYRMSA-N 1 0 262.353 3.653 20 5 CHBDRO CCCC1(CCC)CCC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001197514496 1122958059 /nfs/dbraw/zinc/95/80/59/1122958059.db2.gz NEDNVKQNDYCWRL-UHFFFAOYSA-N 1 0 291.395 3.925 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H](C3CCCC3)C2)c1 ZINC001198706125 1123008605 /nfs/dbraw/zinc/00/86/05/1123008605.db2.gz OJTBEGGSPXFGHV-MRXNPFEDSA-N 1 0 288.391 3.997 20 5 CHBDRO CCN(Cc1occc1C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000839661686 1123222629 /nfs/dbraw/zinc/22/26/29/1123222629.db2.gz QBGQGOFABFZQPY-UHFFFAOYSA-N 1 0 292.310 3.657 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1C=CCC1 ZINC000850506424 1123276726 /nfs/dbraw/zinc/27/67/26/1123276726.db2.gz APYGBMQFXDEAJL-STQMWFEESA-N 1 0 292.404 3.774 20 5 CHBDRO CC(C)[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccco1 ZINC000346321944 1123678275 /nfs/dbraw/zinc/67/82/75/1123678275.db2.gz UFAYBNSLFJOTDX-UHFFFAOYSA-N 1 0 288.347 3.641 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCC2(CC2)CC1 ZINC000860069153 1123720250 /nfs/dbraw/zinc/72/02/50/1123720250.db2.gz DUWBTEZRSQFAEQ-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC1(C)CC1 ZINC000475189837 1123813530 /nfs/dbraw/zinc/81/35/30/1123813530.db2.gz ICNFJBRMPHRKRE-JLHYYAGUSA-N 1 0 274.364 3.778 20 5 CHBDRO C[C@H]([NH2+]CCCCOC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000475312055 1123838751 /nfs/dbraw/zinc/83/87/51/1123838751.db2.gz KBSZLFTXYJLENK-ZDUSSCGKSA-N 1 0 294.395 3.841 20 5 CHBDRO C[C@H]([NH2+]C1(C2CC2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000717905607 1129151624 /nfs/dbraw/zinc/15/16/24/1129151624.db2.gz ZAAIWFQQCMBVOI-NSHDSACASA-N 1 0 260.337 3.578 20 5 CHBDRO CC[C@@H](C)C[C@@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000088297607 1124006335 /nfs/dbraw/zinc/00/63/35/1124006335.db2.gz SCBDJBIRBSPMER-VXGBXAGGSA-N 1 0 280.368 3.518 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1C ZINC000525636062 1124451291 /nfs/dbraw/zinc/45/12/91/1124451291.db2.gz DBJLNJRZWIYSKV-GHMZBOCLSA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000525637135 1124451672 /nfs/dbraw/zinc/45/16/72/1124451672.db2.gz ZVKMQFGYLFLHPB-OLZOCXBDSA-N 1 0 262.353 3.605 20 5 CHBDRO CCC(CC)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000134446948 1124480191 /nfs/dbraw/zinc/48/01/91/1124480191.db2.gz PPLYRIXIRHECGO-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO CC1(C)C[C@@H]1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447578503 1124498118 /nfs/dbraw/zinc/49/81/18/1124498118.db2.gz FWKPSFJQEFCSJP-DOMZBBRYSA-N 1 0 274.364 3.608 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C3=CCC[NH2+]CC3)nc12 ZINC001238934706 1131274136 /nfs/dbraw/zinc/27/41/36/1131274136.db2.gz CNSNSPHPBXHCIH-UHFFFAOYSA-N 1 0 275.355 3.550 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CCC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872084385 1124678570 /nfs/dbraw/zinc/67/85/70/1124678570.db2.gz RPAVROGWLRRKKU-SNVBAGLBSA-N 1 0 278.327 3.717 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CCCCC1(F)F ZINC000449376911 1124715987 /nfs/dbraw/zinc/71/59/87/1124715987.db2.gz NGEJUZUCMVWVOL-CYBMUJFWSA-N 1 0 298.333 3.818 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccsc1 ZINC000873011774 1124733787 /nfs/dbraw/zinc/73/37/87/1124733787.db2.gz GAOZHVBDSXHLBM-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1CCCC1(F)F ZINC000449491243 1124758512 /nfs/dbraw/zinc/75/85/12/1124758512.db2.gz FYJWYMZDNQDWLV-BPJJOFIESA-N 1 0 296.317 3.633 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCC1=CCCCC1 ZINC000020093753 1124805042 /nfs/dbraw/zinc/80/50/42/1124805042.db2.gz HJSHFRJBDHVYSZ-UHFFFAOYSA-N 1 0 260.337 3.575 20 5 CHBDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000531441449 1125219984 /nfs/dbraw/zinc/21/99/84/1125219984.db2.gz GBYIDNQVIQDRSZ-WMLDXEAASA-N 1 0 296.370 3.973 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC12CCCC2 ZINC000428535140 1125289602 /nfs/dbraw/zinc/28/96/02/1125289602.db2.gz KVWSXTMYIUGYJM-RCBBPTIPSA-N 1 0 286.375 3.920 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000129899342 1125353104 /nfs/dbraw/zinc/35/31/04/1125353104.db2.gz XYTQUJPSKNBSPV-NEPJUHHUSA-N 1 0 262.353 3.600 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)CCSC)c1cccc([N+](=O)[O-])c1 ZINC000131650509 1125404247 /nfs/dbraw/zinc/40/42/47/1125404247.db2.gz DFSKYSCMGKJPRB-FZMZJTMJSA-N 1 0 282.409 3.777 20 5 CHBDRO C[C@H](C[NH2+][C@@H]1CCCSCC1)c1ccccc1[N+](=O)[O-] ZINC000897461444 1125423990 /nfs/dbraw/zinc/42/39/90/1125423990.db2.gz PCIKGUMDMGEHAE-CHWSQXEVSA-N 1 0 294.420 3.574 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000734152219 1129296333 /nfs/dbraw/zinc/29/63/33/1129296333.db2.gz HLTFWLKLIKNNIA-ZDUSSCGKSA-N 1 0 294.370 3.992 20 5 CHBDRO C[C@@H](C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000734509749 1129310789 /nfs/dbraw/zinc/31/07/89/1129310789.db2.gz LIPFUWKJNFZEDG-XOVSCCBYSA-N 1 0 276.380 3.880 20 5 CHBDRO CC1CCC([N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774520 1129451627 /nfs/dbraw/zinc/45/16/27/1129451627.db2.gz XFJKVPBITUYPIX-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccsc1 ZINC000094773688 1129452030 /nfs/dbraw/zinc/45/20/30/1129452030.db2.gz SWCOHYAPXCXEHE-SECBINFHSA-N 1 0 280.324 3.646 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c1 ZINC000303529718 1129546825 /nfs/dbraw/zinc/54/68/25/1129546825.db2.gz FORHGTGTOUTXSV-QGZVFWFLSA-N 1 0 286.375 3.917 20 5 CHBDRO Cc1ccc(C[C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000303755047 1129556470 /nfs/dbraw/zinc/55/64/70/1129556470.db2.gz MUKMBMWHXWWOQF-OAHLLOKOSA-N 1 0 298.386 3.966 20 5 CHBDRO CC(F)(F)CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168858691 1129677977 /nfs/dbraw/zinc/67/79/77/1129677977.db2.gz GAKVOTKQRYRVTK-UHFFFAOYSA-N 1 0 298.333 3.995 20 5 CHBDRO CC(C)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(Cl)c1 ZINC001168981224 1129686881 /nfs/dbraw/zinc/68/68/81/1129686881.db2.gz GUOMMXJGYUODBL-SMDDNHRTSA-N 1 0 296.798 3.610 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(F)c1 ZINC001168980724 1129687012 /nfs/dbraw/zinc/68/70/12/1129687012.db2.gz GACPRARHDJTQGM-WQVCFCJDSA-N 1 0 294.370 3.702 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001168979498 1129687054 /nfs/dbraw/zinc/68/70/54/1129687054.db2.gz YRYILSXOBWFOSK-KBUPBQIOSA-N 1 0 282.428 3.626 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)c(C)c1 ZINC001169003603 1129689020 /nfs/dbraw/zinc/68/90/20/1129689020.db2.gz ONQXRXUADVYYGG-XPKDYRNWSA-N 1 0 294.370 3.620 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C)cc1 ZINC001169006295 1129689385 /nfs/dbraw/zinc/68/93/85/1129689385.db2.gz XEHWNLJIZFVRSL-HYVNUMGLSA-N 1 0 290.407 3.871 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1Cl ZINC001168988574 1129690006 /nfs/dbraw/zinc/69/00/06/1129690006.db2.gz SNQBJMSURXUFQV-OBJOEFQTSA-N 1 0 296.798 3.744 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1Cl ZINC001168988646 1129690188 /nfs/dbraw/zinc/69/01/88/1129690188.db2.gz UADYFJYDKQNEFQ-HUBLWGQQSA-N 1 0 296.798 3.826 20 5 CHBDRO CC[C@H](c1ccccc1)[N@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169040124 1129690497 /nfs/dbraw/zinc/69/04/97/1129690497.db2.gz YAXHZEHYVCNEAN-NUEKZKHPSA-N 1 0 276.380 3.515 20 5 CHBDRO Cc1ccc([C@@H]2CCC[N@@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169025020 1129691390 /nfs/dbraw/zinc/69/13/90/1129691390.db2.gz ILURVVJBSNOLED-XIRDDKMYSA-N 1 0 288.391 3.577 20 5 CHBDRO CC[N@H+](CCO)Cc1c2ccccc2cc2ccccc21 ZINC000768140801 1129836285 /nfs/dbraw/zinc/83/62/85/1129836285.db2.gz KVNUGVUVHBPBJA-UHFFFAOYSA-N 1 0 279.383 3.807 20 5 CHBDRO CNc1ccccc1C[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000902672465 1130035801 /nfs/dbraw/zinc/03/58/01/1130035801.db2.gz XKTWRZJYYHMPFR-ZDUSSCGKSA-N 1 0 299.374 3.530 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000903244732 1130135293 /nfs/dbraw/zinc/13/52/93/1130135293.db2.gz CGXNQMRFGWMRIE-XJKSGUPXSA-N 1 0 299.374 3.834 20 5 CHBDRO CC(C)CC[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746662075 1130138544 /nfs/dbraw/zinc/13/85/44/1130138544.db2.gz REULPNUSDPNEPQ-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000903287346 1130146486 /nfs/dbraw/zinc/14/64/86/1130146486.db2.gz OJXFOHCZPMFTAZ-RISCZKNCSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2ncccc21)c1ccc([N+](=O)[O-])cc1 ZINC000903286935 1130146803 /nfs/dbraw/zinc/14/68/03/1130146803.db2.gz JQNYPPLNLDOWKN-SJKOYZFVSA-N 1 0 297.358 3.718 20 5 CHBDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000903338540 1130161188 /nfs/dbraw/zinc/16/11/88/1130161188.db2.gz IQXNDGQYVOCLBT-SJCJKPOMSA-N 1 0 297.358 3.792 20 5 CHBDRO CC[C@@H]([NH2+]CCc1cccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000903415742 1130173101 /nfs/dbraw/zinc/17/31/01/1130173101.db2.gz LBVBHNGIFHTAKD-QGZVFWFLSA-N 1 0 299.374 3.582 20 5 CHBDRO CC[C@@H]1CC[C@H](C)[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001170281139 1130477896 /nfs/dbraw/zinc/47/78/96/1130477896.db2.gz VVOLLXKWZHHDSD-QWHCGFSZSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@H]1CC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000793347760 1130548385 /nfs/dbraw/zinc/54/83/85/1130548385.db2.gz ZJWHYMAORJICPD-QWRGUYRKSA-N 1 0 282.771 3.774 20 5 CHBDRO C[C@@H]1CC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000793347759 1130548885 /nfs/dbraw/zinc/54/88/85/1130548885.db2.gz ZJWHYMAORJICPD-MNOVXSKESA-N 1 0 282.771 3.774 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cc(Cl)ccc1C(F)(F)F ZINC001234193286 1130614878 /nfs/dbraw/zinc/61/48/78/1130614878.db2.gz JVGXBISCHLZNPM-VIFPVBQESA-N 1 0 296.740 3.832 20 5 CHBDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000695154933 1130792588 /nfs/dbraw/zinc/79/25/88/1130792588.db2.gz YASWOCZGMPOHNF-SNVBAGLBSA-N 1 0 268.332 3.648 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815584269 1131004011 /nfs/dbraw/zinc/00/40/11/1131004011.db2.gz ZHQPIKZOAMREKH-NWDGAFQWSA-N 1 0 291.395 3.796 20 5 CHBDRO CC1(C)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1(C)C ZINC001116444159 1131146737 /nfs/dbraw/zinc/14/67/37/1131146737.db2.gz SWURKPVAFWNFSV-VQHVLOKHSA-N 1 0 274.364 3.728 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844436102 1131563606 /nfs/dbraw/zinc/56/36/06/1131563606.db2.gz GQIKIGALNHFCQW-FZMZJTMJSA-N 1 0 296.317 3.777 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc2ccccc2c1Cl ZINC001228254974 1131840470 /nfs/dbraw/zinc/84/04/70/1131840470.db2.gz CJLCAURKYDBAOS-GFCCVEGCSA-N 1 0 278.803 3.967 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H]1Cc2ccccc21 ZINC001649155611 1131971175 /nfs/dbraw/zinc/97/11/75/1131971175.db2.gz KKLKAXNGTWJUMM-OAHLLOKOSA-N 1 0 296.370 3.641 20 5 CHBDRO C[C@H]([NH2+]CC[C@@H]1CCCS1)c1ccc([N+](=O)[O-])cc1 ZINC000715753803 1131990893 /nfs/dbraw/zinc/99/08/93/1131990893.db2.gz KOGBIXCOERWQRQ-FZMZJTMJSA-N 1 0 280.393 3.531 20 5 CHBDRO CCCCCC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000037177116 1132006177 /nfs/dbraw/zinc/00/61/77/1132006177.db2.gz PMOPUULWSIOMML-GFCCVEGCSA-N 1 0 250.342 3.826 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cc(O)ccc1-c1ccccc1 ZINC001229833997 1132122348 /nfs/dbraw/zinc/12/23/48/1132122348.db2.gz SISDHAMHOMBWSH-CQSZACIVSA-O 1 0 286.395 3.533 20 5 CHBDRO C[C@H](C[NH+](C)C)Oc1nccc2c3ccccc3ccc21 ZINC001230202760 1132159697 /nfs/dbraw/zinc/15/96/97/1132159697.db2.gz CNDCIJHHYWTTHQ-CYBMUJFWSA-N 1 0 280.371 3.717 20 5 CHBDRO Cc1c(Cl)ccc2ccc(O[C@@H](C)C[N+](C)(C)C)nc21 ZINC001231392430 1132289091 /nfs/dbraw/zinc/28/90/91/1132289091.db2.gz UVYUOYXNULSWMH-NSHDSACASA-N 1 0 293.818 3.670 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)(C)C ZINC001172899998 1132347008 /nfs/dbraw/zinc/34/70/08/1132347008.db2.gz RBICNVMNICDFER-WFASDCNBSA-N 1 0 290.407 3.866 20 5 CHBDRO CC[C@H](C)[N@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172906303 1132347052 /nfs/dbraw/zinc/34/70/52/1132347052.db2.gz XAQBKBACKQGTJS-WFASDCNBSA-N 1 0 276.380 3.573 20 5 CHBDRO CCC(C)(C)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172896202 1132360039 /nfs/dbraw/zinc/36/00/39/1132360039.db2.gz BLPPREYTGFLGLU-CQSZACIVSA-N 1 0 276.380 3.620 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1CCCC1)CC2 ZINC001172896021 1132360101 /nfs/dbraw/zinc/36/01/01/1132360101.db2.gz KZFHJOIPZAXFFO-MRXNPFEDSA-N 1 0 288.391 3.622 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCC1(C)C ZINC001173217759 1132411374 /nfs/dbraw/zinc/41/13/74/1132411374.db2.gz FQWMREAUXIWYOR-WFASDCNBSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCC(C)(C)C ZINC001173217605 1132411455 /nfs/dbraw/zinc/41/14/55/1132411455.db2.gz XEQWXRZBEOMSDT-LBPRGKRZSA-N 1 0 264.369 3.552 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)C1CCCCC1 ZINC001173220410 1132411927 /nfs/dbraw/zinc/41/19/27/1132411927.db2.gz AAFBSUBGLDGPHU-CYBMUJFWSA-N 1 0 276.380 3.790 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001173223101 1132412652 /nfs/dbraw/zinc/41/26/52/1132412652.db2.gz XRQXYDQSGOXQRC-BMFZPTHFSA-N 1 0 288.391 3.648 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCC(C)(C)C1 ZINC001173226186 1132412906 /nfs/dbraw/zinc/41/29/06/1132412906.db2.gz VWVWAZNRNNIANX-ZFWWWQNUSA-N 1 0 290.407 3.942 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1Cc2ccccc2C1 ZINC001173230039 1132413596 /nfs/dbraw/zinc/41/35/96/1132413596.db2.gz XLJDGYWGGDDJCJ-CYBMUJFWSA-N 1 0 282.343 3.542 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001173233716 1132413742 /nfs/dbraw/zinc/41/37/42/1132413742.db2.gz MLBDIBLCQIOCAQ-KMFMINBZSA-N 1 0 288.391 3.790 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)[C@H](C)C1 ZINC001173230485 1132414196 /nfs/dbraw/zinc/41/41/96/1132414196.db2.gz YJKMVHSBWKVOHC-KFWWJZLASA-N 1 0 290.407 3.894 20 5 CHBDRO Cc1ccccc1C[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173213012 1132415992 /nfs/dbraw/zinc/41/59/92/1132415992.db2.gz CDRUQFWLRDYNEH-CQSZACIVSA-N 1 0 284.359 3.624 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCCCCC1 ZINC001173213823 1132416579 /nfs/dbraw/zinc/41/65/79/1132416579.db2.gz HXOMYFPRCFVCKZ-CYBMUJFWSA-N 1 0 276.380 3.838 20 5 CHBDRO Cc1cc(NCCC[NH+](C(C)C)C(C)C)c([N+](=O)[O-])s1 ZINC001162692604 1133103791 /nfs/dbraw/zinc/10/37/91/1133103791.db2.gz LPHNZILYEGEOOW-UHFFFAOYSA-N 1 0 299.440 3.886 20 5 CHBDRO C[C@H](CC1CC1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001205006919 1133515774 /nfs/dbraw/zinc/51/57/74/1133515774.db2.gz AORDMFBXUYRUOH-SNVBAGLBSA-N 1 0 282.771 3.569 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](C3CCC3)C2)cc1Cl ZINC001206288964 1133683978 /nfs/dbraw/zinc/68/39/78/1133683978.db2.gz YIFDPLKSFIWYQO-CYBMUJFWSA-N 1 0 294.782 3.870 20 5 CHBDRO C[NH+](C)Cc1ccccc1Nc1cccc([N+](=O)[O-])c1F ZINC001210386644 1134205426 /nfs/dbraw/zinc/20/54/26/1134205426.db2.gz YYSWQZDQTWXFJI-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO Cc1ccc(Nc2cccc(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC001213665731 1134475368 /nfs/dbraw/zinc/47/53/68/1134475368.db2.gz IQVKAOMWLSTXLO-UHFFFAOYSA-N 1 0 285.347 3.708 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000403591538 1134808339 /nfs/dbraw/zinc/80/83/39/1134808339.db2.gz FCEIPIVWJPDJGF-MEWXFMAXSA-N 1 0 274.364 3.824 20 5 CHBDRO C[NH2+][C@H]1C[C@@H](OCc2c3ccccc3nc3ccccc32)C1 ZINC001217762038 1134994972 /nfs/dbraw/zinc/99/49/72/1134994972.db2.gz AKBIFZHBFDHRRT-OKILXGFUSA-N 1 0 292.382 3.655 20 5 CHBDRO C[NH2+][C@H]1C[C@@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001217955960 1135031553 /nfs/dbraw/zinc/03/15/53/1135031553.db2.gz NTFKCHILNUQPCI-GASCZTMLSA-N 1 0 278.355 3.517 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@@H]3CCC[NH2+]C3)cc2c1 ZINC001217961583 1135032057 /nfs/dbraw/zinc/03/20/57/1135032057.db2.gz FHCSIAJCBDOWRL-OAHLLOKOSA-N 1 0 278.355 3.519 20 5 CHBDRO C[C@@H]1C[NH2+]C[C@@H]1Oc1c2ccccc2c(O)c2ccccc21 ZINC001217965582 1135032776 /nfs/dbraw/zinc/03/27/76/1135032776.db2.gz QFPHQTSCBYVPNY-PXAZEXFGSA-N 1 0 293.366 3.685 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@@H]3CCC[NH2+]CC3)c12 ZINC001217995970 1135038495 /nfs/dbraw/zinc/03/84/95/1135038495.db2.gz SHLZSWIGXJDFFQ-MRXNPFEDSA-N 1 0 292.382 3.909 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1OC1CC2(C[NH2+]C2)C1 ZINC001218056933 1135050853 /nfs/dbraw/zinc/05/08/53/1135050853.db2.gz WQAMQQUMWILJQZ-UHFFFAOYSA-N 1 0 290.366 3.519 20 5 CHBDRO C[C@@H]1C[C@@H](Oc2cccc3ccc4cccnc4c32)CC[NH2+]1 ZINC001218058003 1135051145 /nfs/dbraw/zinc/05/11/45/1135051145.db2.gz VJDVLLIJOKJNOD-CJNGLKHVSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H]1C[NH2+]CC[C@@H]1Oc1cccc2ccc3cccnc3c21 ZINC001218419716 1135102151 /nfs/dbraw/zinc/10/21/51/1135102151.db2.gz OXYJVOJWCQVXTN-BBRMVZONSA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000316526963 1135167103 /nfs/dbraw/zinc/16/71/03/1135167103.db2.gz ZGEZSPWKQSPIRO-PIGZYNQJSA-N 1 0 297.358 3.515 20 5 CHBDRO C[C@@H](OCC[N+](C)(C)C)c1ccc(Cl)cc1Cl ZINC001224775709 1135481226 /nfs/dbraw/zinc/48/12/26/1135481226.db2.gz NESMHYOHXFGXHG-SNVBAGLBSA-N 1 0 277.215 3.777 20 5 CHBDRO CC(=O)c1ccc2ccccc2c1O[C@@H](C)C[N+](C)(C)C ZINC001226031510 1135654805 /nfs/dbraw/zinc/65/48/05/1135654805.db2.gz WECPOCMMBMIWIT-ZDUSSCGKSA-N 1 0 286.395 3.516 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1nc(Cl)c(Cl)cc1Cl ZINC001226888762 1135756165 /nfs/dbraw/zinc/75/61/65/1135756165.db2.gz JBXYDTXPMIZIBJ-ZETCQYMHSA-N 1 0 298.621 3.515 20 5 CHBDRO CC[C@H](C)c1ccc(O[C@@H](C)C[N+](C)(C)C)cc1 ZINC001227329892 1135822558 /nfs/dbraw/zinc/82/25/58/1135822558.db2.gz MZWYJDUXKPPALQ-KBPBESRZSA-N 1 0 250.406 3.674 20 5 CHBDRO C[C@H]([NH2+]CC1(C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000104447439 186006262 /nfs/dbraw/zinc/00/62/62/186006262.db2.gz LBGIGNZFXDUYMN-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO CCC(C)(C)C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000574862877 335052953 /nfs/dbraw/zinc/05/29/53/335052953.db2.gz YOPLAPLOYGZAID-GFCCVEGCSA-N 1 0 264.369 3.990 20 5 CHBDRO COc1ccc(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000519968914 260035363 /nfs/dbraw/zinc/03/53/63/260035363.db2.gz VXLRSALXGJSINS-GXTWGEPZSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355078909 227375919 /nfs/dbraw/zinc/37/59/19/227375919.db2.gz BVVKVBWRXAHYFW-MXWKQRLJSA-N 1 0 268.382 3.523 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000020128016 171014288 /nfs/dbraw/zinc/01/42/88/171014288.db2.gz WSWYVZMKQGLVSP-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C2CCCCC2)cc1[N+](=O)[O-] ZINC000021018602 171290077 /nfs/dbraw/zinc/29/00/77/171290077.db2.gz OOHUIHOWDAFRPP-GFCCVEGCSA-N 1 0 262.353 3.887 20 5 CHBDRO C[C@@H]([NH2+]CCC1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000037739636 173659861 /nfs/dbraw/zinc/65/98/61/173659861.db2.gz OQFVTHKKRZRVBC-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3occc3c2)cc1 ZINC000352778286 227211526 /nfs/dbraw/zinc/21/15/26/227211526.db2.gz GJQYRHBVFWAOFK-UHFFFAOYSA-N 1 0 282.299 3.631 20 5 CHBDRO Cc1ccc(F)cc1CN(C)Cc1ccccc1[N+](=O)[O-] ZINC000179933392 260080654 /nfs/dbraw/zinc/08/06/54/260080654.db2.gz WCSIZVGPKZMYOB-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO C[C@@H](NCc1csc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000037771887 260116291 /nfs/dbraw/zinc/11/62/91/260116291.db2.gz JCCPVUGWLMOAGL-MRVPVSSYSA-N 1 0 298.314 3.785 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000312606426 260177675 /nfs/dbraw/zinc/17/76/75/260177675.db2.gz TVYCGKBTUZIBSH-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC2CCC1CC2)c1ccccc1[N+](=O)[O-] ZINC000312896528 260219572 /nfs/dbraw/zinc/21/95/72/260219572.db2.gz XRPHIOVZYSILBD-XZNOPERXSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C1CCCC1 ZINC000449155701 260260278 /nfs/dbraw/zinc/26/02/78/260260278.db2.gz QDQGCYFLJJEXAZ-STQMWFEESA-N 1 0 276.380 3.694 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000090217457 260339145 /nfs/dbraw/zinc/33/91/45/260339145.db2.gz GGOMYABLVDLPCO-ZJUUUORDSA-N 1 0 290.285 3.895 20 5 CHBDRO CC(C)C1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000090230562 260339826 /nfs/dbraw/zinc/33/98/26/260339826.db2.gz PAPCDUHYUKYGEU-LBPRGKRZSA-N 1 0 262.353 3.682 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426773464 260351783 /nfs/dbraw/zinc/35/17/83/260351783.db2.gz JUAKLAKNOVVOIS-MCIONIFRSA-N 1 0 274.364 3.778 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000131381238 260402921 /nfs/dbraw/zinc/40/29/21/260402921.db2.gz QQWZZVRZEFRQBS-UHFFFAOYSA-N 1 0 292.285 3.822 20 5 CHBDRO CC(C)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000410068979 260459100 /nfs/dbraw/zinc/45/91/00/260459100.db2.gz MFYHXMYCELUJCO-UHFFFAOYSA-N 1 0 288.347 3.991 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1cccnc1 ZINC000158517687 261166057 /nfs/dbraw/zinc/16/60/57/261166057.db2.gz FLZIHZHMYFWMOH-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000525786445 262236258 /nfs/dbraw/zinc/23/62/58/262236258.db2.gz JPEMDEYOVTYTBF-HNNXBMFYSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000020473274 262240183 /nfs/dbraw/zinc/24/01/83/262240183.db2.gz RDJURVWEWDZUDC-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1nccs1 ZINC000186733409 262320809 /nfs/dbraw/zinc/32/08/09/262320809.db2.gz OEXDRXCKDQIDRI-QWRGUYRKSA-N 1 0 291.376 3.506 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1C[C@@H](OC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414138721 262809170 /nfs/dbraw/zinc/80/91/70/262809170.db2.gz HPQAXYLJQLKHBE-VNQPRFMTSA-N 1 0 292.379 3.592 20 5 CHBDRO CC[NH2+]Cc1cccc(NCc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000414873751 263087640 /nfs/dbraw/zinc/08/76/40/263087640.db2.gz XQVQUEFKBZZUQS-UHFFFAOYSA-N 1 0 299.374 3.625 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000330695813 264005631 /nfs/dbraw/zinc/00/56/31/264005631.db2.gz DFGUSUJVFWNWPY-SMDDNHRTSA-N 1 0 292.379 3.592 20 5 CHBDRO Cc1cc(NC[C@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000071948324 264260938 /nfs/dbraw/zinc/26/09/38/264260938.db2.gz RRWMKVFFJAHGBS-QGZVFWFLSA-N 1 0 299.374 3.618 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCCCCC1 ZINC000519161531 265347273 /nfs/dbraw/zinc/34/72/73/265347273.db2.gz SCHSMNIJDFJCLK-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO C[NH+](C)[C@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000301519121 265981959 /nfs/dbraw/zinc/98/19/59/265981959.db2.gz HEDNKWHLYPBCCO-QWRGUYRKSA-N 1 0 297.786 3.533 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC12CCC2 ZINC000357023182 266233703 /nfs/dbraw/zinc/23/37/03/266233703.db2.gz LBCBCZSYUCGPCK-GFCCVEGCSA-N 1 0 292.354 3.746 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1c2ccccc2O[C@H]1C ZINC000367402349 267071439 /nfs/dbraw/zinc/07/14/39/267071439.db2.gz QWYDVUYDCVCCPG-SJCJKPOMSA-N 1 0 298.342 3.515 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000020148561 267274244 /nfs/dbraw/zinc/27/42/44/267274244.db2.gz QQBWXDTZJFJFNA-JTQLQIEISA-N 1 0 262.334 3.507 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580240077 327746687 /nfs/dbraw/zinc/74/66/87/327746687.db2.gz BFMYYOQJNXVENO-VXGBXAGGSA-N 1 0 289.379 3.643 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(C3CC3)cc2)cc1 ZINC000094519078 327954814 /nfs/dbraw/zinc/95/48/14/327954814.db2.gz ONFVBRJGNDXWFC-UHFFFAOYSA-N 1 0 282.343 3.762 20 5 CHBDRO C[C@H]1CCC[C@@](CNc2ccccc2[N+](=O)[O-])([NH+](C)C)C1 ZINC000040669966 328015282 /nfs/dbraw/zinc/01/52/82/328015282.db2.gz YYMITHVCKPSMSE-XJKSGUPXSA-N 1 0 291.395 3.517 20 5 CHBDRO Cc1ccccc1[C@@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000040675892 328015585 /nfs/dbraw/zinc/01/55/85/328015585.db2.gz JOIZQSOZUPWSBQ-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO Cc1ccc(C[N@@H+](CC2CC2)C(C)C)cc1[N+](=O)[O-] ZINC000534337050 328049241 /nfs/dbraw/zinc/04/92/41/328049241.db2.gz NOCXVANVRRQZOE-UHFFFAOYSA-N 1 0 262.353 3.524 20 5 CHBDRO CSC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000193804165 329062880 /nfs/dbraw/zinc/06/28/80/329062880.db2.gz LEJURAHYSXLUNL-NSHDSACASA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000227309566 329271906 /nfs/dbraw/zinc/27/19/06/329271906.db2.gz OOEQGYJVOSITPQ-ZYHUDNBSSA-N 1 0 268.382 3.715 20 5 CHBDRO CC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000388759633 328300562 /nfs/dbraw/zinc/30/05/62/328300562.db2.gz DLVPKPCASIBTPS-YWPYICTPSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H](C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000534513141 328304966 /nfs/dbraw/zinc/30/49/66/328304966.db2.gz KKHLUWKPFFWFEL-AWEZNQCLSA-N 1 0 296.370 3.757 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000049119631 328339878 /nfs/dbraw/zinc/33/98/78/328339878.db2.gz MIODRWHIKCJBCE-ZBFHGGJFSA-N 1 0 276.380 3.696 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303681240 328357624 /nfs/dbraw/zinc/35/76/24/328357624.db2.gz JCMLRCIOENVNIA-UKPHBRMFSA-N 1 0 288.391 3.790 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000049529159 328367779 /nfs/dbraw/zinc/36/77/79/328367779.db2.gz FSCMEKYPUPQGCK-LBPRGKRZSA-N 1 0 276.361 3.897 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000049963607 328380040 /nfs/dbraw/zinc/38/00/40/328380040.db2.gz ORRBCIZXFJILSS-ZDUSSCGKSA-N 1 0 270.760 3.772 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963577 328380087 /nfs/dbraw/zinc/38/00/87/328380087.db2.gz ZTSMYMWLRJQCTQ-VHSXEESVSA-N 1 0 270.760 3.772 20 5 CHBDRO CC(C)C[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963337 328380099 /nfs/dbraw/zinc/38/00/99/328380099.db2.gz AWOZTPLAGMBFGM-JTQLQIEISA-N 1 0 270.760 3.772 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000558222020 327079529 /nfs/dbraw/zinc/07/95/29/327079529.db2.gz KRNDPUXAIMKAOV-KBPBESRZSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1=CCCCC1 ZINC000449377152 327181204 /nfs/dbraw/zinc/18/12/04/327181204.db2.gz RILPZJSWIGZNQO-ZDUSSCGKSA-N 1 0 274.364 3.616 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1OCCC[NH+]1CCCCC1 ZINC000570359746 327585475 /nfs/dbraw/zinc/58/54/75/327585475.db2.gz JYENJXIGGVTTPL-UHFFFAOYSA-N 1 0 298.770 3.503 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCSC(C)C)cc1[N+](=O)[O-] ZINC000389146452 328629247 /nfs/dbraw/zinc/62/92/47/328629247.db2.gz UNXRJEYAYQSXJI-GFCCVEGCSA-N 1 0 282.409 3.695 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000532198007 328704811 /nfs/dbraw/zinc/70/48/11/328704811.db2.gz PFZCHTLYDOUUHW-INIZCTEOSA-N 1 0 288.347 3.780 20 5 CHBDRO Cc1cc(C)cc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000042277203 328763931 /nfs/dbraw/zinc/76/39/31/328763931.db2.gz MVPHLHKJWUOXPI-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO CC1(C)CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000514100240 328829921 /nfs/dbraw/zinc/82/99/21/328829921.db2.gz UNIJXWYUVACFMZ-ALCCZGGFSA-N 1 0 274.364 3.730 20 5 CHBDRO CCCCC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429232209 329137552 /nfs/dbraw/zinc/13/75/52/329137552.db2.gz ARILVDRVUHHVRJ-UHFFFAOYSA-N 1 0 250.342 3.610 20 5 CHBDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000174352855 329157679 /nfs/dbraw/zinc/15/76/79/329157679.db2.gz KSQKMLOTRUSIDM-UONOGXRCSA-N 1 0 294.420 3.701 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000179705902 329207974 /nfs/dbraw/zinc/20/79/74/329207974.db2.gz BYDKOAOHBCJEBN-INIZCTEOSA-N 1 0 299.374 3.579 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1cncc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000181827550 329237683 /nfs/dbraw/zinc/23/76/83/329237683.db2.gz IQZUREFEPMTGPB-QGZVFWFLSA-N 1 0 299.374 3.929 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCC1(C)C ZINC000583106308 329312535 /nfs/dbraw/zinc/31/25/35/329312535.db2.gz HWBPDZSHIUKCSP-LMRWQKIVSA-N 1 0 274.364 3.776 20 5 CHBDRO CC(C)C1([NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000379456087 329555721 /nfs/dbraw/zinc/55/57/21/329555721.db2.gz OWASHVLXHQEUSY-UHFFFAOYSA-N 1 0 268.744 3.526 20 5 CHBDRO COc1cc(C[NH2+]C2[C@H](C)CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000564070662 329663310 /nfs/dbraw/zinc/66/33/10/329663310.db2.gz YZQUSEISOFHPOO-VXGBXAGGSA-N 1 0 292.379 3.518 20 5 CHBDRO CC1(C2CC2)CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000572207875 329955156 /nfs/dbraw/zinc/95/51/56/329955156.db2.gz RCDAVYRAOMRJDI-UHFFFAOYSA-N 1 0 274.364 3.607 20 5 CHBDRO CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CCO1 ZINC000421854585 330088510 /nfs/dbraw/zinc/08/85/10/330088510.db2.gz KWLSFCFZUOAPOR-MELADBBJSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H]([NH2+]CC1=CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000379587892 330139460 /nfs/dbraw/zinc/13/94/60/330139460.db2.gz NOWBSDLIAHTPBD-LBPRGKRZSA-N 1 0 260.337 3.746 20 5 CHBDRO CC(C)c1ccc(C[NH+]2[C@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000527238790 330240613 /nfs/dbraw/zinc/24/06/13/330240613.db2.gz VQDGSMRFOFYDEX-VXGBXAGGSA-N 1 0 262.353 3.701 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccccc2Cl)cc1 ZINC000035677572 330249228 /nfs/dbraw/zinc/24/92/28/330249228.db2.gz RALVTQCGXMFCCL-UHFFFAOYSA-N 1 0 290.750 3.581 20 5 CHBDRO C[C@H]([NH2+]CCc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000036778547 330265025 /nfs/dbraw/zinc/26/50/25/330265025.db2.gz OIFPTSAMKNNWJV-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000036878824 330310286 /nfs/dbraw/zinc/31/02/86/330310286.db2.gz SGUNCOARFZFMRU-INIZCTEOSA-N 1 0 282.343 3.680 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC12CC2 ZINC000424332531 330342661 /nfs/dbraw/zinc/34/26/61/330342661.db2.gz WTLGBFBTRCNERC-SMDDNHRTSA-N 1 0 292.404 3.608 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@H]1C1CCC1 ZINC000424335461 330343210 /nfs/dbraw/zinc/34/32/10/330343210.db2.gz WQGJCGWKJSXHPD-UHOFOFEASA-N 1 0 288.391 3.694 20 5 CHBDRO CC[C@H]1CCC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000071120265 330352065 /nfs/dbraw/zinc/35/20/65/330352065.db2.gz DMAMXXAIVRHYMV-ZFWWWQNUSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccccc1CC[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449057025 330895923 /nfs/dbraw/zinc/89/59/23/330895923.db2.gz AGKPHLLAGGRBSK-HNNXBMFYSA-N 1 0 298.386 3.667 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1cccs1 ZINC000449065701 330896612 /nfs/dbraw/zinc/89/66/12/330896612.db2.gz VSDSEYNDHIKLIY-RYUDHWBXSA-N 1 0 290.388 3.938 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000162717444 330952544 /nfs/dbraw/zinc/95/25/44/330952544.db2.gz WNKVWCBTGBDNRN-CYBMUJFWSA-N 1 0 262.353 3.572 20 5 CHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CCCCCF)C2)cc1 ZINC000451545546 331033483 /nfs/dbraw/zinc/03/34/83/331033483.db2.gz HRSMHMLYXWQSLI-OAHLLOKOSA-N 1 0 294.370 3.914 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470173825 331035620 /nfs/dbraw/zinc/03/56/20/331035620.db2.gz GCONPAXSKGHBMN-WVUXNXBLSA-N 1 0 274.364 3.873 20 5 CHBDRO COC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CCCC1 ZINC000453224382 331103529 /nfs/dbraw/zinc/10/35/29/331103529.db2.gz NACXRCUAJRPWKJ-CYBMUJFWSA-N 1 0 292.379 3.513 20 5 CHBDRO C[C@H]([NH2+]CCC1CC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000453417364 331130426 /nfs/dbraw/zinc/13/04/26/331130426.db2.gz KHBIZJLSAPOJCW-JTQLQIEISA-N 1 0 284.306 3.681 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]C1CC2(CCC2)C1 ZINC000459452141 331282034 /nfs/dbraw/zinc/28/20/34/331282034.db2.gz BVYYFTGZXSXXBS-UHFFFAOYSA-N 1 0 294.782 3.713 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CCC2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000459783251 331300706 /nfs/dbraw/zinc/30/07/06/331300706.db2.gz YTMAGIOPHNARNS-GFCCVEGCSA-N 1 0 274.364 3.968 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2C[C@@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000462768151 331328152 /nfs/dbraw/zinc/32/81/52/331328152.db2.gz XMSSKBYSJWCHQV-CVEARBPZSA-N 1 0 288.391 3.962 20 5 CHBDRO CCC1(CC)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)CCS1 ZINC000464582682 331363162 /nfs/dbraw/zinc/36/31/62/331363162.db2.gz XDLKVVBOONWGHA-UHFFFAOYSA-N 1 0 294.420 3.702 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000464772607 331367163 /nfs/dbraw/zinc/36/71/63/331367163.db2.gz IESLJUJPBWYMQW-HNNXBMFYSA-N 1 0 280.343 3.746 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000464774804 331367381 /nfs/dbraw/zinc/36/73/81/331367381.db2.gz IXYSNECXRPMPIL-MRXNPFEDSA-N 1 0 292.379 3.616 20 5 CHBDRO CC(C)[C@H]1C[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CCS1 ZINC000464774711 331367445 /nfs/dbraw/zinc/36/74/45/331367445.db2.gz PZZIPVWKMKMHTI-SWLSCSKDSA-N 1 0 294.420 3.729 20 5 CHBDRO C[C@@H]1Cc2ccccc2[C@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000467985159 331426388 /nfs/dbraw/zinc/42/63/88/331426388.db2.gz RCYXJBNSPCDPSG-ACJLOTCBSA-N 1 0 296.370 3.660 20 5 CHBDRO CC1=CCC[C@H](C)[C@H]1C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468003094 331426536 /nfs/dbraw/zinc/42/65/36/331426536.db2.gz HPPIDHCTGHWSSP-HOCLYGCPSA-N 1 0 288.391 3.719 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@H]1C1CCC1)c1ccccc1[N+](=O)[O-] ZINC000510699615 332912271 /nfs/dbraw/zinc/91/22/71/332912271.db2.gz ZQNFEMZUTSPEOS-TUKIKUTGSA-N 1 0 274.364 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c(F)c1 ZINC000478383517 331704974 /nfs/dbraw/zinc/70/49/74/331704974.db2.gz JZZRJFLEAGSJMB-YRGRVCCFSA-N 1 0 292.354 3.792 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2c3ccccc3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000478499225 331707494 /nfs/dbraw/zinc/70/74/94/331707494.db2.gz DMQHIDBADAGMJP-XIKOKIGWSA-N 1 0 296.370 3.926 20 5 CHBDRO COc1cc(C[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000481171553 331799694 /nfs/dbraw/zinc/79/96/94/331799694.db2.gz FHYKBECNDNCWBU-OUCADQQQSA-N 1 0 292.379 3.518 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000481179811 331800119 /nfs/dbraw/zinc/80/01/19/331800119.db2.gz JOQKUOLOGKJLGD-RISCZKNCSA-N 1 0 280.343 3.792 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000487186122 331958766 /nfs/dbraw/zinc/95/87/66/331958766.db2.gz AHUBBQIDMOTLBD-MRVPVSSYSA-N 1 0 288.269 3.502 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC(C)(C)C1 ZINC000490092080 332081207 /nfs/dbraw/zinc/08/12/07/332081207.db2.gz XYACLOMXGBMLBM-LBPRGKRZSA-N 1 0 262.353 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCSC(C)(C)C1 ZINC000490099147 332081333 /nfs/dbraw/zinc/08/13/33/332081333.db2.gz GCPLOAWAMKNQBA-GFCCVEGCSA-N 1 0 294.420 3.792 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc2c(c1)CCCC2 ZINC000490577502 332093400 /nfs/dbraw/zinc/09/34/00/332093400.db2.gz GLPUURTZZJNWQU-UHFFFAOYSA-N 1 0 296.370 3.763 20 5 CHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCCC1 ZINC000491091614 332147874 /nfs/dbraw/zinc/14/78/74/332147874.db2.gz POWWUDKSPVYVHE-UHFFFAOYSA-N 1 0 280.343 3.887 20 5 CHBDRO Cc1cccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000492441973 332397513 /nfs/dbraw/zinc/39/75/13/332397513.db2.gz OOBWEKGCYUNWLD-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC[C@H]1C ZINC000501902431 332642622 /nfs/dbraw/zinc/64/26/22/332642622.db2.gz WHRGCKHGWHRXEZ-XUJVJEKNSA-N 1 0 262.353 3.742 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc3occc3c2)cc1 ZINC000512021221 332950782 /nfs/dbraw/zinc/95/07/82/332950782.db2.gz CGEANWZSRKMMDP-UHFFFAOYSA-N 1 0 296.326 3.673 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000513117799 333005190 /nfs/dbraw/zinc/00/51/90/333005190.db2.gz VIBWVHVJJGFEEQ-FZMZJTMJSA-N 1 0 262.353 3.606 20 5 CHBDRO Cc1ccc([C@@H](CNc2ccccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000520866866 333107081 /nfs/dbraw/zinc/10/70/81/333107081.db2.gz FAMLVSHBDAEIFF-QGZVFWFLSA-N 1 0 299.374 3.618 20 5 CHBDRO C[C@H]1CCC[C@@H](C[NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000218940059 333138638 /nfs/dbraw/zinc/13/86/38/333138638.db2.gz BWXQPKVWGTVYCH-UONOGXRCSA-N 1 0 276.380 3.553 20 5 CHBDRO CC[C@@H]([NH2+]CC1(CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000222209785 333177115 /nfs/dbraw/zinc/17/71/15/333177115.db2.gz RBFAZDNOIJLDJD-CQSZACIVSA-N 1 0 262.353 3.826 20 5 CHBDRO CCC[C@@H]([NH2+][C@H](C)c1cn[nH]c1)c1cccc([N+](=O)[O-])c1 ZINC000222451953 333194004 /nfs/dbraw/zinc/19/40/04/333194004.db2.gz GJEACAIXRGJABG-IAQYHMDHSA-N 1 0 288.351 3.510 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000222503853 333195002 /nfs/dbraw/zinc/19/50/02/333195002.db2.gz SZCGAHQZXRTWFN-YRGRVCCFSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000230144500 333314832 /nfs/dbraw/zinc/31/48/32/333314832.db2.gz XSYKZSGCQPFHKZ-UHFFFAOYSA-N 1 0 282.771 3.774 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000523702137 333340179 /nfs/dbraw/zinc/34/01/79/333340179.db2.gz VPKZBJSQIJHCCM-UHFFFAOYSA-N 1 0 284.359 3.659 20 5 CHBDRO CC1=C[C@H](C)C[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000235382471 333368609 /nfs/dbraw/zinc/36/86/09/333368609.db2.gz CWWGPMPREORCQL-WFASDCNBSA-N 1 0 274.364 3.677 20 5 CHBDRO C/C(=C/c1ccccc1)C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000236703094 333374935 /nfs/dbraw/zinc/37/49/35/333374935.db2.gz WEFMTZDAXYUZHH-KAMYIIQDSA-N 1 0 282.343 3.788 20 5 CHBDRO CC[C@@H](Cc1ccccc1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000237030431 333377076 /nfs/dbraw/zinc/37/70/76/333377076.db2.gz QGRJEXIBQAOGDB-KRWDZBQOSA-N 1 0 298.386 3.748 20 5 CHBDRO C[C@H](CCC(C)(C)C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000237377816 333379289 /nfs/dbraw/zinc/37/92/89/333379289.db2.gz JSNKZCGQIZTSCM-GFCCVEGCSA-N 1 0 264.369 3.899 20 5 CHBDRO CC(C)=CCC[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000537992597 333569787 /nfs/dbraw/zinc/56/97/87/333569787.db2.gz YJZMQSSPZSKQDG-ZDUSSCGKSA-N 1 0 262.353 3.819 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2CC2(C)C)cccc1[N+](=O)[O-] ZINC000540174592 333717791 /nfs/dbraw/zinc/71/77/91/333717791.db2.gz GARJQGHLKBKQML-VXGBXAGGSA-N 1 0 262.353 3.600 20 5 CHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1ccoc1 ZINC000540184560 333718996 /nfs/dbraw/zinc/71/89/96/333718996.db2.gz RMGZCXIPUHBNAQ-ZDUSSCGKSA-N 1 0 288.347 3.861 20 5 CHBDRO CCCC[C@@H](CC)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000069378683 333760022 /nfs/dbraw/zinc/76/00/22/333760022.db2.gz DDUBGTBQPWKGDD-CYBMUJFWSA-N 1 0 250.342 3.653 20 5 CHBDRO C[C@@H]([NH2+]CCC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000129617263 333782808 /nfs/dbraw/zinc/78/28/08/333782808.db2.gz BMKUNLFZCABZJH-LLVKDONJSA-N 1 0 250.342 3.682 20 5 CHBDRO CC(C)([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000542572797 333832482 /nfs/dbraw/zinc/83/24/82/333832482.db2.gz CVDBTOZAEONURN-UHFFFAOYSA-N 1 0 276.361 3.681 20 5 CHBDRO CC(C)C[NH+](Cc1ccc([N+](=O)[O-])cc1)CC(C)C ZINC000071809128 333879775 /nfs/dbraw/zinc/87/97/75/333879775.db2.gz DFQUSXSLJXXTDH-UHFFFAOYSA-N 1 0 264.369 3.709 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCC(C)(C)C1 ZINC000544612623 333940355 /nfs/dbraw/zinc/94/03/55/333940355.db2.gz KGLQBCNBMAMZFV-CYBMUJFWSA-N 1 0 262.353 3.572 20 5 CHBDRO CC[N@H+](CCC1CC1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000546227427 334020736 /nfs/dbraw/zinc/02/07/36/334020736.db2.gz WWDYSRBNMFDMFQ-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000546888687 334054151 /nfs/dbraw/zinc/05/41/51/334054151.db2.gz UJOCRWVYJNKHKX-UWVGGRQHSA-N 1 0 290.285 3.976 20 5 CHBDRO CCC[C@H](C)C[NH2+]C(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000547284849 334075988 /nfs/dbraw/zinc/07/59/88/334075988.db2.gz OJBNCNGACYXDDE-LBPRGKRZSA-N 1 0 264.369 3.856 20 5 CHBDRO CS[C@@H]1CCCC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000134579514 334095858 /nfs/dbraw/zinc/09/58/58/334095858.db2.gz JBRZOIIFKBTPMS-CQSZACIVSA-N 1 0 294.420 3.621 20 5 CHBDRO CS[C@H]1CCCC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000134579489 334095944 /nfs/dbraw/zinc/09/59/44/334095944.db2.gz JBRZOIIFKBTPMS-AWEZNQCLSA-N 1 0 294.420 3.621 20 5 CHBDRO CCC(C)(C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000547771647 334116630 /nfs/dbraw/zinc/11/66/30/334116630.db2.gz QADNVARDCFTWMK-UHFFFAOYSA-N 1 0 270.760 3.869 20 5 CHBDRO Cc1ccc(C[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)s1 ZINC000078003604 334120255 /nfs/dbraw/zinc/12/02/55/334120255.db2.gz LLAJAULQBKDRLS-NSHDSACASA-N 1 0 290.388 3.686 20 5 CHBDRO CCC(CC)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000135461100 334130555 /nfs/dbraw/zinc/13/05/55/334130555.db2.gz CNRUNNWGNSMSQF-LLVKDONJSA-N 1 0 250.342 3.682 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]2F)cc1[N+](=O)[O-] ZINC000551307576 334245983 /nfs/dbraw/zinc/24/59/83/334245983.db2.gz RPENSCGBTLEPLK-UHTWSYAYSA-N 1 0 296.342 3.535 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CC2CCC1CC2 ZINC000552083809 334287022 /nfs/dbraw/zinc/28/70/22/334287022.db2.gz YZIUKKGGDOCMQN-UPNUJQIASA-N 1 0 286.375 3.776 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@@H]1C ZINC000552086312 334287578 /nfs/dbraw/zinc/28/75/78/334287578.db2.gz CFMOLMLVSOJSSX-XQQFMLRXSA-N 1 0 294.420 3.854 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC000250926500 334353364 /nfs/dbraw/zinc/35/33/64/334353364.db2.gz WSVTZAUYTFNXFE-UXIGCNINSA-N 1 0 276.380 3.818 20 5 CHBDRO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000553102596 334361694 /nfs/dbraw/zinc/36/16/94/334361694.db2.gz VZSVDTWNSYFGIY-ZDUSSCGKSA-N 1 0 292.379 3.532 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCCSC1 ZINC000554363280 334424671 /nfs/dbraw/zinc/42/46/71/334424671.db2.gz IEXGYDOJGBJVPU-QWHCGFSZSA-N 1 0 294.420 3.697 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CC12CCCC2 ZINC000555665805 334486486 /nfs/dbraw/zinc/48/64/86/334486486.db2.gz XTZSOAAWBLSMRH-DOMZBBRYSA-N 1 0 274.364 3.887 20 5 CHBDRO CC(C)[N@H+](CCCCCF)Cc1ccc([N+](=O)[O-])cc1 ZINC000577198726 335321404 /nfs/dbraw/zinc/32/14/04/335321404.db2.gz KEJKMPKWMPNABG-UHFFFAOYSA-N 1 0 282.359 3.945 20 5 CHBDRO CCC1([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCCC1 ZINC000382539802 336093030 /nfs/dbraw/zinc/09/30/30/336093030.db2.gz CROHRPNJXADOEQ-UHFFFAOYSA-N 1 0 266.316 3.546 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H](C1CC1)C1CCC1 ZINC000581677113 336127352 /nfs/dbraw/zinc/12/73/52/336127352.db2.gz QUHWKCHOIKWAHG-WBVHZDCISA-N 1 0 286.375 3.750 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000387153588 336186629 /nfs/dbraw/zinc/18/66/29/336186629.db2.gz PTZIRENFOVPIJU-CABCVRRESA-N 1 0 274.364 3.968 20 5 CHBDRO CCC[C@H]([NH2+]C1CC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000277219446 521154004 /nfs/dbraw/zinc/15/40/04/521154004.db2.gz XMWLFEPEGAOSSS-ZDUSSCGKSA-N 1 0 284.306 3.823 20 5 CHBDRO CCC[C@H]([NH2+]CC[C@H](C)F)c1cccc([N+](=O)[O-])c1 ZINC000340465756 521159500 /nfs/dbraw/zinc/15/95/00/521159500.db2.gz XLVCVHXXUIIMTE-FZMZJTMJSA-N 1 0 268.332 3.774 20 5 CHBDRO CC[C@H]([NH2+]Cc1scnc1C)c1cccc([N+](=O)[O-])c1 ZINC000071212545 522676208 /nfs/dbraw/zinc/67/62/08/522676208.db2.gz NEVHMALHUMJJMO-ZDUSSCGKSA-N 1 0 291.376 3.601 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000037010511 522742368 /nfs/dbraw/zinc/74/23/68/522742368.db2.gz ZBVJFJFYGXWTKP-DOMZBBRYSA-N 1 0 285.347 3.792 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000037668235 524584266 /nfs/dbraw/zinc/58/42/66/524584266.db2.gz BFDVIQBQYORTPV-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2c3ccccc3O[C@H]2C)cc1[N+](=O)[O-] ZINC000288574740 524602301 /nfs/dbraw/zinc/60/23/01/524602301.db2.gz NIIPCCVUXFFHEH-SJCJKPOMSA-N 1 0 298.342 3.515 20 5 CHBDRO C[C@H]([NH2+]CCCCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000127224328 525333658 /nfs/dbraw/zinc/33/36/58/525333658.db2.gz WQDHYCHQOAXURK-JTQLQIEISA-N 1 0 290.285 3.978 20 5 CHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000062726613 525369286 /nfs/dbraw/zinc/36/92/86/525369286.db2.gz ACNIMBXTNBJTMS-NSHDSACASA-N 1 0 276.361 3.550 20 5 CHBDRO Cc1cc2cc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3)ccc2[nH]1 ZINC000353121153 525641285 /nfs/dbraw/zinc/64/12/85/525641285.db2.gz RUTYJUHYKDFQOE-UHFFFAOYSA-N 1 0 295.342 3.674 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CCCS2)cc1[N+](=O)[O-] ZINC000122050518 525924123 /nfs/dbraw/zinc/92/41/23/525924123.db2.gz IVLVYQIXNICSDB-WFASDCNBSA-N 1 0 294.420 3.840 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)C1(C)CC1 ZINC000355083158 528612255 /nfs/dbraw/zinc/61/22/55/528612255.db2.gz SIMBJVBMMBLFNT-GFCCVEGCSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@@H](C)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000215663649 1118915750 /nfs/dbraw/zinc/91/57/50/1118915750.db2.gz BCYTUWDFYXRLTQ-GFCCVEGCSA-N 1 0 262.353 3.605 20 5 CHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC(C)(C)C ZINC000092217602 1120095803 /nfs/dbraw/zinc/09/58/03/1120095803.db2.gz ALTCYMIKYZDZKZ-VQHVLOKHSA-N 1 0 262.353 3.586 20 5 CHBDRO CC[C@@H](C)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000215664270 1120660834 /nfs/dbraw/zinc/66/08/34/1120660834.db2.gz LADPTGRPFOEBKT-GFCCVEGCSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)CCSC)c1cccc([N+](=O)[O-])c1 ZINC000131651103 1125403949 /nfs/dbraw/zinc/40/39/49/1125403949.db2.gz DFSKYSCMGKJPRB-BXUZGUMPSA-N 1 0 282.409 3.777 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCOC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000119271562 1125531193 /nfs/dbraw/zinc/53/11/93/1125531193.db2.gz VHSXQGWNFIXUBX-STQMWFEESA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886205089 1125661013 /nfs/dbraw/zinc/66/10/13/1125661013.db2.gz ZLNNMXKYECYVTL-CZUORRHYSA-N 1 0 297.358 3.573 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000348388417 1125684474 /nfs/dbraw/zinc/68/44/74/1125684474.db2.gz GSJOONBDQCLZIK-OBJOEFQTSA-N 1 0 266.316 3.526 20 5 CHBDRO CCCCC[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000042308111 1126733851 /nfs/dbraw/zinc/73/38/51/1126733851.db2.gz SHWHUAKIDXXJHB-GFCCVEGCSA-N 1 0 280.368 3.662 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CC1CC1)CC1CCC1 ZINC000483273428 1126777164 /nfs/dbraw/zinc/77/71/64/1126777164.db2.gz YPQZTEOCPIUVMX-UHFFFAOYSA-N 1 0 274.364 3.607 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cncc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000181844768 1126861839 /nfs/dbraw/zinc/86/18/39/1126861839.db2.gz MYBZCGQOPZBJFI-MRXNPFEDSA-N 1 0 285.347 3.539 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)c1ccco1 ZINC000183258335 1126883633 /nfs/dbraw/zinc/88/36/33/1126883633.db2.gz ZHAVKCQADGAHAX-GFCCVEGCSA-N 1 0 274.320 3.689 20 5 CHBDRO CC[C@H](C)C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000487198281 1127023654 /nfs/dbraw/zinc/02/36/54/1127023654.db2.gz VRPOCVYWHPGWKG-VIFPVBQESA-N 1 0 290.285 3.749 20 5 CHBDRO CC[C@H](C)C[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000487291785 1127030624 /nfs/dbraw/zinc/03/06/24/1127030624.db2.gz RZMRUPQBBCPLQX-NWDGAFQWSA-N 1 0 250.342 3.634 20 5 CHBDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000570248423 1127082138 /nfs/dbraw/zinc/08/21/38/1127082138.db2.gz MEBPJNAPJZNBHL-QGZVFWFLSA-N 1 0 299.374 3.881 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271486007 1127085602 /nfs/dbraw/zinc/08/56/02/1127085602.db2.gz DWSOLOBGHXOZCF-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccncc1C)c1cccc([N+](=O)[O-])c1 ZINC000271511816 1127087965 /nfs/dbraw/zinc/08/79/65/1127087965.db2.gz NXGUGZWLSONDDT-QGZVFWFLSA-N 1 0 299.374 3.582 20 5 CHBDRO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC(C)(C)C ZINC000045073474 1127179206 /nfs/dbraw/zinc/17/92/06/1127179206.db2.gz ZXTGYCCAPKDRBK-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@H](CF)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000588930774 1127207300 /nfs/dbraw/zinc/20/73/00/1127207300.db2.gz RPTZOMMSAUOTMR-SNVBAGLBSA-N 1 0 294.351 3.771 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCSC(C)C ZINC000588926835 1127207307 /nfs/dbraw/zinc/20/73/07/1127207307.db2.gz FQNHJMMYPUDIRI-UKTHLTGXSA-N 1 0 294.420 3.729 20 5 CHBDRO CC[C@H](CSC)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589206621 1127216228 /nfs/dbraw/zinc/21/62/28/1127216228.db2.gz YBHGOOWJDCYQKO-IUCKJTJTSA-N 1 0 294.420 3.681 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000590378135 1127256741 /nfs/dbraw/zinc/25/67/41/1127256741.db2.gz IQNGWCQZFRHOQW-HNNXBMFYSA-N 1 0 274.364 3.525 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CC=CCC1)CCC2 ZINC000193001766 1127255145 /nfs/dbraw/zinc/25/51/45/1127255145.db2.gz QTMGCCBTYAMDRH-XJKSGUPXSA-N 1 0 272.348 3.671 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2CCCSC2)cccc1[N+](=O)[O-] ZINC000287124121 1127290440 /nfs/dbraw/zinc/29/04/40/1127290440.db2.gz RIJUVAOAYZAPCZ-CHWSQXEVSA-N 1 0 294.420 3.697 20 5 CHBDRO Cc1cccc(CCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000287616629 1127311181 /nfs/dbraw/zinc/31/11/81/1127311181.db2.gz SSVCLRXQSFXGPN-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC12CCCC2 ZINC000593038289 1127369060 /nfs/dbraw/zinc/36/90/60/1127369060.db2.gz GSALWGWHWMPCLD-UHFFFAOYSA-N 1 0 290.363 3.512 20 5 CHBDRO CC(C)O[C@H]1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000593056118 1127370327 /nfs/dbraw/zinc/37/03/27/1127370327.db2.gz YHKSOAUMOWQJOS-KGLIPLIRSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H]([NH2+]CC1CCC(F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000592401571 1127376672 /nfs/dbraw/zinc/37/66/72/1127376672.db2.gz YSNUQBSFSXMLLH-DCBWTQNWSA-N 1 0 280.343 3.774 20 5 CHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000358196871 1127407700 /nfs/dbraw/zinc/40/77/00/1127407700.db2.gz FKNCDYVWYKFOIK-CQSZACIVSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000358351835 1127416816 /nfs/dbraw/zinc/41/68/16/1127416816.db2.gz LLTPHQRRRHOFBO-PXAZEXFGSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000358366236 1127417743 /nfs/dbraw/zinc/41/77/43/1127417743.db2.gz KDWNTMFNGPOUTF-SJCJKPOMSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccsc1 ZINC000594504370 1127418855 /nfs/dbraw/zinc/41/88/55/1127418855.db2.gz OAPQENSOCVNNGI-IINYFYTJSA-N 1 0 288.372 3.994 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000358408201 1127419975 /nfs/dbraw/zinc/41/99/75/1127419975.db2.gz SBQJEXZGCHWPQT-ZIAGYGMSSA-N 1 0 299.374 3.580 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CCCCC1 ZINC000595006371 1127445929 /nfs/dbraw/zinc/44/59/29/1127445929.db2.gz JLZQTFXNTXEKMY-NSHDSACASA-N 1 0 278.352 3.587 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3[C@@H]4CCC[C@@H]43)o2)cc1 ZINC000594983766 1127443850 /nfs/dbraw/zinc/44/38/50/1127443850.db2.gz FEZMLMBXWNITHF-QLPKVWCKSA-N 1 0 298.342 3.743 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCc2ccco2)c(Cl)c1 ZINC000594997931 1127445191 /nfs/dbraw/zinc/44/51/91/1127445191.db2.gz SDXJQHIWIISGSD-UHFFFAOYSA-N 1 0 294.738 3.564 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000595049830 1127451131 /nfs/dbraw/zinc/45/11/31/1127451131.db2.gz PHDRIJIBWVIFFE-XJKSGUPXSA-N 1 0 299.374 3.834 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CC2(CCC2)C1 ZINC000595045780 1127451309 /nfs/dbraw/zinc/45/13/09/1127451309.db2.gz HAXFQABLUQJGTM-NSHDSACASA-N 1 0 290.363 3.587 20 5 CHBDRO CCSC1(C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595100252 1127452401 /nfs/dbraw/zinc/45/24/01/1127452401.db2.gz QQLHIWAADDDRAS-AWEZNQCLSA-N 1 0 294.420 3.921 20 5 CHBDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000359303807 1127457432 /nfs/dbraw/zinc/45/74/32/1127457432.db2.gz PTNWVJMWCGBYRL-FZMZJTMJSA-N 1 0 280.393 3.668 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCCOC(C)(C)C)cccc1[N+](=O)[O-] ZINC000595075733 1127453156 /nfs/dbraw/zinc/45/31/56/1127453156.db2.gz BNBQKCMEXMGAGR-ZDUSSCGKSA-N 1 0 294.395 3.759 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC[C@]2(C)CC2(F)F)cccc1[N+](=O)[O-] ZINC000595082278 1127453357 /nfs/dbraw/zinc/45/33/57/1127453357.db2.gz XNDWHBWBQWOTQP-SMDDNHRTSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@@]1(C)CC1(F)F ZINC000595081568 1127453379 /nfs/dbraw/zinc/45/33/79/1127453379.db2.gz SDLSIFDAGSEGRF-FZMZJTMJSA-N 1 0 298.333 3.989 20 5 CHBDRO C[C@@]1(CC[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1(F)F ZINC000595081635 1127453416 /nfs/dbraw/zinc/45/34/16/1127453416.db2.gz TXSSTPFPXLNOHR-GXTWGEPZSA-N 1 0 296.317 3.607 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)cccc1[N+](=O)[O-] ZINC000595082276 1127453638 /nfs/dbraw/zinc/45/36/38/1127453638.db2.gz XNDWHBWBQWOTQP-FZMZJTMJSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC[C@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000595079106 1127453651 /nfs/dbraw/zinc/45/36/51/1127453651.db2.gz CVWHLXXWLMHQOH-SMDDNHRTSA-N 1 0 298.333 3.989 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595090734 1127454106 /nfs/dbraw/zinc/45/41/06/1127454106.db2.gz FNVJUUKBNFXVNF-BXKDBHETSA-N 1 0 284.306 3.537 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1C(C)(C)C1(F)F ZINC000595090372 1127454359 /nfs/dbraw/zinc/45/43/59/1127454359.db2.gz BBJUWTVKFKYANQ-MFKMUULPSA-N 1 0 298.333 3.845 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)cccc1[N+](=O)[O-] ZINC000595095012 1127455371 /nfs/dbraw/zinc/45/53/71/1127455371.db2.gz SVBTUVWBWKMKNN-GXFFZTMASA-N 1 0 298.333 3.845 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2=CCCC2)cc1[N+](=O)[O-] ZINC000595097347 1127456120 /nfs/dbraw/zinc/45/61/20/1127456120.db2.gz TVHGBBFOXXBFDU-GFCCVEGCSA-N 1 0 290.363 3.754 20 5 CHBDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000359298115 1127457048 /nfs/dbraw/zinc/45/70/48/1127457048.db2.gz KSKOVKBKHOPDOR-LRDDRELGSA-N 1 0 292.354 3.746 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593119388 1127475272 /nfs/dbraw/zinc/47/52/72/1127475272.db2.gz XESNILICCWUTCK-BXUZGUMPSA-N 1 0 296.317 3.695 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC2CC1(c1ccccc1)C2 ZINC000595907391 1127480006 /nfs/dbraw/zinc/48/00/06/1127480006.db2.gz KBMBUFGNFLBCFW-UHFFFAOYSA-N 1 0 294.354 3.716 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC3CC2(c2ccccc2)C3)c1 ZINC000595911135 1127479447 /nfs/dbraw/zinc/47/94/47/1127479447.db2.gz NQLZPCQHYDVZFR-UHFFFAOYSA-N 1 0 294.354 3.716 20 5 CHBDRO CCCCC[C@H]1CCCC[N@@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595870735 1127479640 /nfs/dbraw/zinc/47/96/40/1127479640.db2.gz KCZYFOYQZUZDEX-ZDUSSCGKSA-N 1 0 295.383 3.826 20 5 CHBDRO CC(C)(C[NH2+]Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000596063554 1127482017 /nfs/dbraw/zinc/48/20/17/1127482017.db2.gz NSLDEAZYUTWWBW-UHFFFAOYSA-N 1 0 290.285 3.663 20 5 CHBDRO CC(C)(C[NH2+]Cc1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000596064110 1127482319 /nfs/dbraw/zinc/48/23/19/1127482319.db2.gz SKCAYEBZTYMNTO-UHFFFAOYSA-N 1 0 290.285 3.663 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCC23CC3)cc1[N+](=O)[O-] ZINC000597059371 1127526566 /nfs/dbraw/zinc/52/65/66/1127526566.db2.gz JTPJIEZLOMQVIE-WFASDCNBSA-N 1 0 274.364 3.887 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H](CCF)C1 ZINC000597212102 1127534315 /nfs/dbraw/zinc/53/43/15/1127534315.db2.gz RSKQSCWYAMMDAT-GBXSZLQWSA-N 1 0 292.354 3.680 20 5 CHBDRO CC(C)([NH2+]CC1CCSCC1)c1ccccc1[N+](=O)[O-] ZINC000602675214 1127602167 /nfs/dbraw/zinc/60/21/67/1127602167.db2.gz ZGTOYAKLXSMRAX-UHFFFAOYSA-N 1 0 294.420 3.563 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000361922460 1127599443 /nfs/dbraw/zinc/59/94/43/1127599443.db2.gz IXTUJTIYGDQQOK-BLLLJJGKSA-N 1 0 288.347 3.860 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000297197732 1127690593 /nfs/dbraw/zinc/69/05/93/1127690593.db2.gz FUVYCUBLECBRRC-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CCCC(C)(F)F)cccc1[N+](=O)[O-] ZINC000297224890 1127691639 /nfs/dbraw/zinc/69/16/39/1127691639.db2.gz HLIFLPIAFDPNNB-NSHDSACASA-N 1 0 286.322 3.989 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC12CCC2)c1ccc([N+](=O)[O-])cc1 ZINC000297338902 1127693637 /nfs/dbraw/zinc/69/36/37/1127693637.db2.gz OJXFOHCZPMFTAZ-FZMZJTMJSA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1ccccc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000061760090 1127715726 /nfs/dbraw/zinc/71/57/26/1127715726.db2.gz ZWCBBZDGOSLOIP-UHFFFAOYSA-N 1 0 270.332 3.535 20 5 CHBDRO CCC(CC)(C[NH2+]Cc1csc([N+](=O)[O-])c1)SC ZINC000230707705 1127772338 /nfs/dbraw/zinc/77/23/38/1127772338.db2.gz ZGSQJDHTEHMXCP-UHFFFAOYSA-N 1 0 288.438 3.668 20 5 CHBDRO CCC(CC)(C[NH2+]Cc1cccc([N+](=O)[O-])c1)SC ZINC000230708027 1127772415 /nfs/dbraw/zinc/77/24/15/1127772415.db2.gz GKTQJYBBWOTDLF-UHFFFAOYSA-N 1 0 282.409 3.606 20 5 CHBDRO CCC(CC)(C[NH2+]Cc1ccccc1[N+](=O)[O-])SC ZINC000230708454 1127772475 /nfs/dbraw/zinc/77/24/75/1127772475.db2.gz AOLGCXUKJKZXGG-UHFFFAOYSA-N 1 0 282.409 3.606 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000063618922 1127852206 /nfs/dbraw/zinc/85/22/06/1127852206.db2.gz RNXJVFABCRIOFG-AWEZNQCLSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)CC2CCC2)cccc1[N+](=O)[O-] ZINC000231884381 1127859136 /nfs/dbraw/zinc/85/91/36/1127859136.db2.gz TWZZSOBIGCWORI-LLVKDONJSA-N 1 0 262.353 3.572 20 5 CHBDRO CC1(C)C[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000608836432 1127889625 /nfs/dbraw/zinc/88/96/25/1127889625.db2.gz GQOUXUSJLQMDJB-OAHLLOKOSA-N 1 0 286.331 3.743 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C)(C)CC1 ZINC000608886190 1127893952 /nfs/dbraw/zinc/89/39/52/1127893952.db2.gz HREXWENQAIMHKP-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO CCC[NH+](CCC)CCCNc1ccc([N+](=O)[O-])cc1F ZINC000609075403 1127914778 /nfs/dbraw/zinc/91/47/78/1127914778.db2.gz WVDHOZKZPXICGW-UHFFFAOYSA-N 1 0 297.374 3.658 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC(C)(C)C1 ZINC000467283492 1127962757 /nfs/dbraw/zinc/96/27/57/1127962757.db2.gz WALBVOBYRNBQLV-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC1CC1 ZINC000540174724 1127965515 /nfs/dbraw/zinc/96/55/15/1127965515.db2.gz WBVIARFTKNIIID-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO COC[C@H](CC(C)C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000540222023 1127970330 /nfs/dbraw/zinc/97/03/30/1127970330.db2.gz LUGLCZNKRKJSRY-ZFWWWQNUSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CC2 ZINC000468004661 1127987558 /nfs/dbraw/zinc/98/75/58/1127987558.db2.gz MBOXIOCWEHDRGN-QGZVFWFLSA-N 1 0 296.370 3.723 20 5 CHBDRO CC(C)[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000324061620 1128005397 /nfs/dbraw/zinc/00/53/97/1128005397.db2.gz BVPCYXPBWQOHJU-ABAIWWIYSA-N 1 0 262.353 3.680 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC1(C)C ZINC000468634658 1128014485 /nfs/dbraw/zinc/01/44/85/1128014485.db2.gz GYESPZHANZEXPA-VDBIKXPHSA-N 1 0 274.364 3.634 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CCCC(F)(F)C1 ZINC000541774304 1128039058 /nfs/dbraw/zinc/03/90/58/1128039058.db2.gz FKZWTQVGTAQNQK-LBPRGKRZSA-N 1 0 284.306 3.571 20 5 CHBDRO CC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C(C)C ZINC000470175011 1128064752 /nfs/dbraw/zinc/06/47/52/1128064752.db2.gz XPXLXIXXLRYZRP-LCYFTJDESA-N 1 0 262.353 3.728 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CC(C)C ZINC000470173288 1128064823 /nfs/dbraw/zinc/06/48/23/1128064823.db2.gz AJMIRXTWTXYPOL-MDWZMJQESA-N 1 0 262.353 3.586 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](C)C1 ZINC000470175900 1128064878 /nfs/dbraw/zinc/06/48/78/1128064878.db2.gz TUGRBAIGFWBRIG-CKXDQPNJSA-N 1 0 274.364 3.730 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC12CCC2 ZINC000470181600 1128065025 /nfs/dbraw/zinc/06/50/25/1128065025.db2.gz FQPCZUDGIPIONT-JLHYYAGUSA-N 1 0 272.348 3.627 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC(C)(C)C1 ZINC000470179261 1128065382 /nfs/dbraw/zinc/06/53/82/1128065382.db2.gz VJZQCDPPSSYIRX-UKTHLTGXSA-N 1 0 274.364 3.730 20 5 CHBDRO CCOc1cc(C[N@H+](C)[C@@H](C)C2CCC2)ccc1[N+](=O)[O-] ZINC000492748630 1128111862 /nfs/dbraw/zinc/11/18/62/1128111862.db2.gz NDGMWBJQLKRNHS-LBPRGKRZSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccccn1 ZINC000152426401 1128122322 /nfs/dbraw/zinc/12/23/22/1128122322.db2.gz VLDHYWDYNWSWFC-KGLIPLIRSA-N 1 0 299.374 3.662 20 5 CHBDRO CCC[C@@H](CC)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519925 1128133160 /nfs/dbraw/zinc/13/31/60/1128133160.db2.gz LPSMDPLHVOYTAP-LLVKDONJSA-N 1 0 270.760 3.917 20 5 CHBDRO CC[C@@H](C[C@@](C)(O)CC)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000926834577 1128197240 /nfs/dbraw/zinc/19/72/40/1128197240.db2.gz HBPLJNYLLCKQLZ-XEZPLFJOSA-N 1 0 294.395 3.575 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccccc1[N+](=O)[O-] ZINC000930235346 1128310278 /nfs/dbraw/zinc/31/02/78/1128310278.db2.gz NASUPAMHVMXMIL-DJIHRAIXSA-N 1 0 296.317 3.537 20 5 CHBDRO C[N@H+](CCCC(C)(F)F)CCc1ccccc1[N+](=O)[O-] ZINC000930438883 1128318890 /nfs/dbraw/zinc/31/88/90/1128318890.db2.gz DUIGGCQYPJLETK-UHFFFAOYSA-N 1 0 286.322 3.505 20 5 CHBDRO CC1CCC([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000035368108 1128328355 /nfs/dbraw/zinc/32/83/55/1128328355.db2.gz STUKMRIKDHZBCX-UHFFFAOYSA-N 1 0 282.771 3.917 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000562057256 1128375042 /nfs/dbraw/zinc/37/50/42/1128375042.db2.gz SEIBDFAPEWIIFV-ZDUSSCGKSA-N 1 0 264.369 3.648 20 5 CHBDRO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CCCCCC1 ZINC000916995241 1128467251 /nfs/dbraw/zinc/46/72/51/1128467251.db2.gz IAQAVGVYDNPWRF-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000564081519 1128492408 /nfs/dbraw/zinc/49/24/08/1128492408.db2.gz WOFLUAGZGPDZFJ-ZFWWWQNUSA-N 1 0 297.358 3.540 20 5 CHBDRO COc1cc(C[NH2+][C@H]2[C@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000564070660 1128492486 /nfs/dbraw/zinc/49/24/86/1128492486.db2.gz YZQUSEISOFHPOO-ATCWAGBWSA-N 1 0 292.379 3.518 20 5 CHBDRO CC(C)c1ccc(C[N@H+](C)[C@H]2CCSC2)cc1[N+](=O)[O-] ZINC000130567184 1128586417 /nfs/dbraw/zinc/58/64/17/1128586417.db2.gz LDQIBJIFTJAJST-ZDUSSCGKSA-N 1 0 294.420 3.656 20 5 CHBDRO CC(C)[C@@H]1CC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000556893217 1128634322 /nfs/dbraw/zinc/63/43/22/1128634322.db2.gz RCCKZVUZHVKONF-UONOGXRCSA-N 1 0 296.798 3.815 20 5 CHBDRO CC1(C)C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]2CCC[C@@H]21 ZINC000557055458 1128664259 /nfs/dbraw/zinc/66/42/59/1128664259.db2.gz NEUDQBYXNCUSSX-NWDGAFQWSA-N 1 0 280.393 3.667 20 5 CHBDRO Cc1ccc(-c2ccc([C@@H]3CCC[NH2+]3)cc2)cc1[N+](=O)[O-] ZINC000600791049 1128681952 /nfs/dbraw/zinc/68/19/52/1128681952.db2.gz OVUXJCDCBPQGRY-INIZCTEOSA-N 1 0 282.343 3.995 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)o1 ZINC000601305175 1128708655 /nfs/dbraw/zinc/70/86/55/1128708655.db2.gz VZVQDZJBNVCDNH-INIZCTEOSA-N 1 0 286.331 3.663 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCCC12CC2 ZINC000601289369 1128708868 /nfs/dbraw/zinc/70/88/68/1128708868.db2.gz MFZFCWPQSATVRH-ZFWWWQNUSA-N 1 0 272.348 3.504 20 5 CHBDRO CC(C)=CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350240 1128713830 /nfs/dbraw/zinc/71/38/30/1128713830.db2.gz XVVCOABKVSVITI-UHFFFAOYSA-N 1 0 262.353 3.771 20 5 CHBDRO CC(C)(C[NH2+]Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000609770399 1128724462 /nfs/dbraw/zinc/72/44/62/1128724462.db2.gz PUOSMAKTBIXDME-UHFFFAOYSA-N 1 0 298.386 3.953 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609766669 1128725470 /nfs/dbraw/zinc/72/54/70/1128725470.db2.gz AEJKBDZHCUQNDT-LBPRGKRZSA-N 1 0 280.343 3.746 20 5 CHBDRO Cc1ccc(CC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000609894439 1128731431 /nfs/dbraw/zinc/73/14/31/1128731431.db2.gz KFUJCJJXNJVSFO-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO C[C@@H](CC[NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000578952416 1128733965 /nfs/dbraw/zinc/73/39/65/1128733965.db2.gz QNOMOZWQSRNJBT-HNNXBMFYSA-N 1 0 298.386 3.921 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610215475 1117882267 /nfs/dbraw/zinc/88/22/67/1117882267.db2.gz YFNVAUZJTUMUNJ-NEPJUHHUSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@H](C)CCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000610215378 1117882384 /nfs/dbraw/zinc/88/23/84/1117882384.db2.gz JQAJFDHREYJADX-CHWSQXEVSA-N 1 0 276.380 3.914 20 5 CHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610215477 1117882663 /nfs/dbraw/zinc/88/26/63/1117882663.db2.gz YFNVAUZJTUMUNJ-RYUDHWBXSA-N 1 0 280.343 3.744 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000336807768 1117938702 /nfs/dbraw/zinc/93/87/02/1117938702.db2.gz ABVUWFXYVBFTEE-DFBGVHRSSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1cccc(Nc2c[nH+]ccc2N2CCCCC2)c1 ZINC001204450070 1118075712 /nfs/dbraw/zinc/07/57/12/1118075712.db2.gz JEHYVLWKGKRFOV-UHFFFAOYSA-N 1 0 298.346 3.724 20 5 CHBDRO O=[N+]([O-])c1cccc(Nc2cccc(C[NH+]3CCCC3)c2)c1 ZINC001204456332 1118085968 /nfs/dbraw/zinc/08/59/68/1118085968.db2.gz KUUKJVNVUUNMDX-UHFFFAOYSA-N 1 0 297.358 3.934 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)Cc2ccco2)cccc1[N+](=O)[O-] ZINC000764773450 1118112361 /nfs/dbraw/zinc/11/23/61/1118112361.db2.gz IRGBOCFARJPDAQ-YPMHNXCESA-N 1 0 288.347 3.778 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)Cc1ccco1 ZINC000764774206 1118113286 /nfs/dbraw/zinc/11/32/86/1118113286.db2.gz NWNWVNCPTPSJSL-QWHCGFSZSA-N 1 0 288.347 3.778 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCC(F)(F)C1 ZINC000615721949 1128760898 /nfs/dbraw/zinc/76/08/98/1128760898.db2.gz MNRVKJVMIHEPOD-HJTPGIPUSA-N 1 0 296.317 3.776 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C1CC1 ZINC000615720421 1128761070 /nfs/dbraw/zinc/76/10/70/1128761070.db2.gz AGVAKCUPAONIAO-YQCJOKCJSA-N 1 0 274.364 3.634 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1NC[C@H](c1ccccc1)[NH+](C)C ZINC000301446452 1118236492 /nfs/dbraw/zinc/23/64/92/1118236492.db2.gz PXMNIOFVLDPAEC-QGZVFWFLSA-N 1 0 299.374 3.618 20 5 CHBDRO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCCC1 ZINC000083168698 1118243526 /nfs/dbraw/zinc/24/35/26/1118243526.db2.gz NPVUXUGCABUYBU-UHFFFAOYSA-N 1 0 289.335 3.501 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H]2CCCC23CC3)cc1[N+](=O)[O-] ZINC000706272352 1118267824 /nfs/dbraw/zinc/26/78/24/1118267824.db2.gz ZZYKWIYNOBNAML-CQSZACIVSA-N 1 0 274.364 3.573 20 5 CHBDRO CC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000090909797 1118688282 /nfs/dbraw/zinc/68/82/82/1118688282.db2.gz RDGSFWFIMVPWHX-CQSZACIVSA-N 1 0 290.388 3.940 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@H]1C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000510688133 1118786744 /nfs/dbraw/zinc/78/67/44/1118786744.db2.gz QNLBESCUZXVSKF-KNXALSJPSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1ccc(C[NH2+]C2CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000341713807 1118809229 /nfs/dbraw/zinc/80/92/29/1118809229.db2.gz GQAHMOCDISRFGE-UHFFFAOYSA-N 1 0 284.306 3.571 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](C)c2ccncc2)cccc1[N+](=O)[O-] ZINC000610831192 1118898851 /nfs/dbraw/zinc/89/88/51/1118898851.db2.gz JLBWDVJZDNZFSK-OCCSQVGLSA-N 1 0 299.374 3.753 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](C[C@@H]2CC=CCC2)C2CC2)c1 ZINC000215663528 1118915664 /nfs/dbraw/zinc/91/56/64/1118915664.db2.gz ZLHKXOMTLAVLDI-CQSZACIVSA-N 1 0 286.375 3.916 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1C[C@@H](C)S[C@H](C)C1 ZINC000538709416 1118949679 /nfs/dbraw/zinc/94/96/79/1118949679.db2.gz IFYUSMBOHYSBDO-UPJWGTAASA-N 1 0 294.420 3.790 20 5 CHBDRO CCC[C@]1(C)CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001167508870 1118968671 /nfs/dbraw/zinc/96/86/71/1118968671.db2.gz JLUAUGADUSBKOL-MRXNPFEDSA-N 1 0 276.380 3.997 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000084988170 1119015675 /nfs/dbraw/zinc/01/56/75/1119015675.db2.gz NGYKTDFHMOIXOS-MBNYWOFBSA-N 1 0 262.353 3.509 20 5 CHBDRO CC(C)SCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000338276223 1119061564 /nfs/dbraw/zinc/06/15/64/1119061564.db2.gz BPAOBPSRGRAXFC-UHFFFAOYSA-N 1 0 294.420 3.701 20 5 CHBDRO CC[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000402479518 1119125121 /nfs/dbraw/zinc/12/51/21/1119125121.db2.gz IZKORSCDBWJHQN-JTQLQIEISA-N 1 0 290.285 3.663 20 5 CHBDRO C[C@@H]([NH2+]CC1(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000480192817 1119397278 /nfs/dbraw/zinc/39/72/78/1119397278.db2.gz FYGCIVXAITXKFN-CQSZACIVSA-N 1 0 296.370 3.977 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCC[C@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000340521609 1119493033 /nfs/dbraw/zinc/49/30/33/1119493033.db2.gz ARSKLKJTAZNXCQ-QLFBSQMISA-N 1 0 280.343 3.916 20 5 CHBDRO CCC[C@H](C[NH2+][C@H](CCC)c1cccc([N+](=O)[O-])c1)OC ZINC000378842759 1119573741 /nfs/dbraw/zinc/57/37/41/1119573741.db2.gz PYTOXEUKHMBPDY-HZPDHXFCSA-N 1 0 294.395 3.841 20 5 CHBDRO Cc1ncc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000179136779 1119597772 /nfs/dbraw/zinc/59/77/72/1119597772.db2.gz MGKXVVGQVSFTGD-ZJUUUORDSA-N 1 0 291.376 3.772 20 5 CHBDRO C[C@H]1CCCC[C@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC001307660725 1128860219 /nfs/dbraw/zinc/86/02/19/1128860219.db2.gz SFDXKINVFSPGBB-XJKSGUPXSA-N 1 0 292.379 3.532 20 5 CHBDRO CC1([NH2+]Cc2ccc([N+](=O)[O-])cc2)CCC(F)(F)CC1 ZINC000612192040 1119748066 /nfs/dbraw/zinc/74/80/66/1119748066.db2.gz MHTQLISHXNMKDM-UHFFFAOYSA-N 1 0 284.306 3.652 20 5 CHBDRO COC1CCC([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000414167071 1119923674 /nfs/dbraw/zinc/92/36/74/1119923674.db2.gz FVSXSZKLBBHJMP-HSBZDZAISA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H]([NH2+]CC[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000180266602 1119966389 /nfs/dbraw/zinc/96/63/89/1119966389.db2.gz BGBQBRFHGWCAQR-HOTGVXAUSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)C1(OC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000414300577 1119970932 /nfs/dbraw/zinc/97/09/32/1119970932.db2.gz AOXTVVHVQKBWGO-IUODEOHRSA-N 1 0 292.379 3.593 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000310848236 1119980785 /nfs/dbraw/zinc/98/07/85/1119980785.db2.gz CQOHPZZIEPGDLQ-GFCCVEGCSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1C[C@H]1c1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000414327962 1119985128 /nfs/dbraw/zinc/98/51/28/1119985128.db2.gz BYCIFHZHSIBURM-RBSFLKMASA-N 1 0 286.331 3.785 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1C[C@H]1c1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000414327960 1119985368 /nfs/dbraw/zinc/98/53/68/1119985368.db2.gz BYCIFHZHSIBURM-QLFBSQMISA-N 1 0 286.331 3.785 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@H]1c1ccco1)CCC2 ZINC000414353277 1119995670 /nfs/dbraw/zinc/99/56/70/1119995670.db2.gz VMYYLGGRSRMSPU-OWCLPIDISA-N 1 0 298.342 3.711 20 5 CHBDRO Cc1occc1C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000414354881 1119996336 /nfs/dbraw/zinc/99/63/36/1119996336.db2.gz ATNXHJUACFXELN-UHFFFAOYSA-N 1 0 288.347 3.609 20 5 CHBDRO C[C@@H](c1cccnc1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350390727 1120074857 /nfs/dbraw/zinc/07/48/57/1120074857.db2.gz KZWLLEZXCVFUJX-PIZKADEWSA-N 1 0 297.358 3.696 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C)CC[C@H]1C ZINC000542701425 1120121808 /nfs/dbraw/zinc/12/18/08/1120121808.db2.gz FDIKXQCYPQTBHL-DGCLKSJQSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000542700437 1120123337 /nfs/dbraw/zinc/12/33/37/1120123337.db2.gz RTZGYYVFMFPOJB-UHFFFAOYSA-N 1 0 284.359 3.925 20 5 CHBDRO CCC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC000159008618 1120231024 /nfs/dbraw/zinc/23/10/24/1120231024.db2.gz YXQAFXFHHIFQFS-INIZCTEOSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@@H](c1ccccc1)N(C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000103465208 1120252629 /nfs/dbraw/zinc/25/26/29/1120252629.db2.gz VVLFGMMILRAUNU-LBPRGKRZSA-N 1 0 288.322 3.927 20 5 CHBDRO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC1CC1 ZINC000542932451 1120260374 /nfs/dbraw/zinc/26/03/74/1120260374.db2.gz ATAGDKWVTDMVPL-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@@H](c1ccco1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255049519 1120315397 /nfs/dbraw/zinc/31/53/97/1120315397.db2.gz WTQFZRGHUAGMGT-UJZCVKTISA-N 1 0 286.331 3.894 20 5 CHBDRO C[N@H+](CCCc1ccsc1)Cc1ccccc1[N+](=O)[O-] ZINC000543020094 1120371075 /nfs/dbraw/zinc/37/10/75/1120371075.db2.gz HQVSPZPFKSODSR-UHFFFAOYSA-N 1 0 290.388 3.721 20 5 CHBDRO CSC[C@@H](C)[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417307191 1120424953 /nfs/dbraw/zinc/42/49/53/1120424953.db2.gz GTPPRIRFMNHMNC-IAQYHMDHSA-N 1 0 294.420 3.703 20 5 CHBDRO C[C@H]1CCC[N@H+](CCCCNc2sccc2[N+](=O)[O-])C1 ZINC000301984654 1120512166 /nfs/dbraw/zinc/51/21/66/1120512166.db2.gz IZHSLCCVUDMPLD-LBPRGKRZSA-N 1 0 297.424 3.580 20 5 CHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000123115772 1120515832 /nfs/dbraw/zinc/51/58/32/1120515832.db2.gz OYFDXFKDOPVVRH-INWMFGNUSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCCS2)cc1[N+](=O)[O-] ZINC000156356348 1120623447 /nfs/dbraw/zinc/62/34/47/1120623447.db2.gz VFXGPUTXBYHDBR-GXTWGEPZSA-N 1 0 294.420 3.840 20 5 CHBDRO CC[C@H]([NH2+]CC1(C2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000181654734 1120635947 /nfs/dbraw/zinc/63/59/47/1120635947.db2.gz KZSNPCBRKYMTOH-HNNXBMFYSA-N 1 0 274.364 3.826 20 5 CHBDRO Cc1cc(N(C)Cc2ccco2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302205596 1120650262 /nfs/dbraw/zinc/65/02/62/1120650262.db2.gz WVNIXIRJWORBQI-UHFFFAOYSA-N 1 0 297.314 3.681 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000511855395 1120665853 /nfs/dbraw/zinc/66/58/53/1120665853.db2.gz OAPZQBQDEIWROY-SJIIUEBRSA-N 1 0 286.375 3.873 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000085040744 1120716185 /nfs/dbraw/zinc/71/61/85/1120716185.db2.gz UUDWMZUXOOZARJ-UXIGCNINSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000313457388 1120730572 /nfs/dbraw/zinc/73/05/72/1120730572.db2.gz CNYTULXQNDTNGV-ZYHUDNBSSA-N 1 0 284.306 3.742 20 5 CHBDRO Cc1c(C[N@@H+]([C@H](C)C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000047909009 1120797434 /nfs/dbraw/zinc/79/74/34/1120797434.db2.gz NIYMGDHRNYNZNF-GFCCVEGCSA-N 1 0 274.364 3.666 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000049556688 1120860212 /nfs/dbraw/zinc/86/02/12/1120860212.db2.gz YAASWBZGDUXOOB-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CCSCC[C@H](C)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000072900557 1120949901 /nfs/dbraw/zinc/94/99/01/1120949901.db2.gz GFTBKYSVRLRXCX-LBPRGKRZSA-N 1 0 282.409 3.558 20 5 CHBDRO CC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000051627134 1120963059 /nfs/dbraw/zinc/96/30/59/1120963059.db2.gz GYHDDZSZRQMCBK-ZDUSSCGKSA-N 1 0 276.361 3.897 20 5 CHBDRO C[NH+](C)[C@@H](CNc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000058913204 1121044255 /nfs/dbraw/zinc/04/42/55/1121044255.db2.gz BTEGGCJUMRLRPO-INIZCTEOSA-N 1 0 291.395 3.517 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]C(C1CCC1)C1CCC1 ZINC000325079480 1121105996 /nfs/dbraw/zinc/10/59/96/1121105996.db2.gz FQTDGGIWABVYSC-UHFFFAOYSA-N 1 0 288.391 3.696 20 5 CHBDRO Cc1ccccc1CC[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000107842324 1121222189 /nfs/dbraw/zinc/22/21/89/1121222189.db2.gz NHEYOYMAACTACT-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000042859091 1121319050 /nfs/dbraw/zinc/31/90/50/1121319050.db2.gz QUGUZSQRSDJNOX-SWLSCSKDSA-N 1 0 276.380 3.819 20 5 CHBDRO CCCC[N@H+](CC)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000216453206 1121334992 /nfs/dbraw/zinc/33/49/92/1121334992.db2.gz RQGVYZABRMWNIC-LBPRGKRZSA-N 1 0 250.342 3.778 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[NH+]1CCCCCCC1 ZINC000728913056 1121345555 /nfs/dbraw/zinc/34/55/55/1121345555.db2.gz XXDYFKPCWIVGJW-UHFFFAOYSA-N 1 0 266.316 3.500 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000706956657 1121446146 /nfs/dbraw/zinc/44/61/46/1121446146.db2.gz MIMCLHNNHGXGKK-NEPJUHHUSA-N 1 0 262.353 3.742 20 5 CHBDRO O=[N+]([O-])/C=C/c1ccc(Nc2cc[nH+]c(C3CC3)c2)cc1 ZINC001175902659 1121494830 /nfs/dbraw/zinc/49/48/30/1121494830.db2.gz PYXHZKMESYMIMU-CSKARUKUSA-N 1 0 281.315 3.950 20 5 CHBDRO C[C@H]1CC2(CCC2)C[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000433020748 1121519973 /nfs/dbraw/zinc/51/99/73/1121519973.db2.gz DIVYSIPSQKBRST-GBXSZLQWSA-N 1 0 286.375 3.873 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1CCCCC1 ZINC000543628255 1121533695 /nfs/dbraw/zinc/53/36/95/1121533695.db2.gz NTFZDCUQVMGWNH-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO CC(C)C[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000466719580 1121565499 /nfs/dbraw/zinc/56/54/99/1121565499.db2.gz XHKVXIYDKZTZGI-OAHLLOKOSA-N 1 0 276.380 3.505 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC12CCCC2 ZINC000429434238 1121579473 /nfs/dbraw/zinc/57/94/73/1121579473.db2.gz HHKSZFVDRIMRIB-XJKSGUPXSA-N 1 0 288.391 3.838 20 5 CHBDRO CC1(C)C[C@H]([NH2+]C2CCCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433134899 1121588736 /nfs/dbraw/zinc/58/87/36/1121588736.db2.gz HNBOOZBWJYHNSJ-HNNXBMFYSA-N 1 0 274.364 3.849 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC2(CC2)CC1 ZINC000611177673 1121629400 /nfs/dbraw/zinc/62/94/00/1121629400.db2.gz TXYGYTDLWDAGTK-LBPRGKRZSA-N 1 0 260.337 3.532 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CC=CC1 ZINC000611248536 1121632020 /nfs/dbraw/zinc/63/20/20/1121632020.db2.gz JCDBYOJWOSHKTC-GFCCVEGCSA-N 1 0 292.404 3.774 20 5 CHBDRO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000611299769 1121636522 /nfs/dbraw/zinc/63/65/22/1121636522.db2.gz FUVYCUBLECBRRC-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCOC(C)(C)C)cc1[N+](=O)[O-] ZINC000611404305 1121644658 /nfs/dbraw/zinc/64/46/58/1121644658.db2.gz AGONRFBMJTXVLL-CYBMUJFWSA-N 1 0 294.395 3.759 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC(F)(F)C1 ZINC000611475832 1121650938 /nfs/dbraw/zinc/65/09/38/1121650938.db2.gz JLRNTNAIJUZBJV-QWRGUYRKSA-N 1 0 284.306 3.742 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC2(CC2)CC1 ZINC000611516845 1121654299 /nfs/dbraw/zinc/65/42/99/1121654299.db2.gz SRNXLLSZKIPXPR-ZDUSSCGKSA-N 1 0 274.364 3.840 20 5 CHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000542628570 1121716205 /nfs/dbraw/zinc/71/62/05/1121716205.db2.gz WARORVPTYKGRQI-CQSZACIVSA-N 1 0 292.379 3.758 20 5 CHBDRO C[C@@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC001177712082 1121746974 /nfs/dbraw/zinc/74/69/74/1121746974.db2.gz DYKOYRNAPHKUBD-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCC12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000619723844 1129008467 /nfs/dbraw/zinc/00/84/67/1129008467.db2.gz OWYCLERAEYBJIA-CABCVRRESA-N 1 0 274.364 3.968 20 5 CHBDRO CC/C=C/C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001178801261 1121817336 /nfs/dbraw/zinc/81/73/36/1121817336.db2.gz ZLTDZUMBWPFLJV-ZZXKWVIFSA-N 1 0 286.331 3.911 20 5 CHBDRO CCC(CC)C[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001179686566 1121898318 /nfs/dbraw/zinc/89/83/18/1121898318.db2.gz ZYTWWKQYVWSBMH-GFCCVEGCSA-N 1 0 264.369 3.724 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C(C)(C)C ZINC001182042577 1122106167 /nfs/dbraw/zinc/10/61/67/1122106167.db2.gz ADRFMDJAPQNQFU-UHFFFAOYSA-N 1 0 270.760 3.869 20 5 CHBDRO CC[C@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000503032137 1122163521 /nfs/dbraw/zinc/16/35/21/1122163521.db2.gz FOFCUACIWVRPHE-MRXNPFEDSA-N 1 0 298.386 3.921 20 5 CHBDRO C[C@@H]([NH2+]C1CCC2(CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000434633598 1122385735 /nfs/dbraw/zinc/38/57/35/1122385735.db2.gz JOHUSDQFBIWJNT-GFCCVEGCSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000716534510 1122423205 /nfs/dbraw/zinc/42/32/05/1122423205.db2.gz WYWCWBHIRDWRIK-DGFQIJBJSA-N 1 0 294.782 3.630 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505629599 1122442701 /nfs/dbraw/zinc/44/27/01/1122442701.db2.gz BGZQURSKWCLZKL-BXUZGUMPSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1C[C@H](c2ccccc2)C1 ZINC000435780807 1122489245 /nfs/dbraw/zinc/48/92/45/1122489245.db2.gz GIFDHBYSVJBNAP-QAQDUYKDSA-N 1 0 296.370 3.939 20 5 CHBDRO CC[C@@H]1C[C@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001190529224 1122541953 /nfs/dbraw/zinc/54/19/53/1122541953.db2.gz PLVXNNDXRFYIHI-CABCVRRESA-N 1 0 276.380 3.851 20 5 CHBDRO C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001190660483 1122549199 /nfs/dbraw/zinc/54/91/99/1122549199.db2.gz KEHREJCNUDZGOP-NSHDSACASA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000437041315 1122606870 /nfs/dbraw/zinc/60/68/70/1122606870.db2.gz AGONLUBLMUHACH-KCXAZCMYSA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1ccoc1C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000426354121 1122772685 /nfs/dbraw/zinc/77/26/85/1122772685.db2.gz YGHYEACOXSLIOF-ZDUSSCGKSA-N 1 0 288.347 3.607 20 5 CHBDRO Cc1ccc(C[N@@H+](C)C2(C)CCCC2)cc1[N+](=O)[O-] ZINC000426500636 1122806766 /nfs/dbraw/zinc/80/67/66/1122806766.db2.gz VIPRSKZDBXMBPN-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000775617592 1122817378 /nfs/dbraw/zinc/81/73/78/1122817378.db2.gz ISBWJOBKQUIEBA-QWRGUYRKSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](C3CCC3)C2)c(F)c1 ZINC001196253845 1122913204 /nfs/dbraw/zinc/91/32/04/1122913204.db2.gz HZFSBRDHRLEYQD-CYBMUJFWSA-N 1 0 292.354 3.746 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000507026620 1122920311 /nfs/dbraw/zinc/92/03/11/1122920311.db2.gz PFRAGUODDUWZHW-GFCCVEGCSA-N 1 0 250.342 3.524 20 5 CHBDRO Cc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1C ZINC000507169614 1122934826 /nfs/dbraw/zinc/93/48/26/1122934826.db2.gz JPORSFGJFRGCEL-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO CCc1cccnc1[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000507462271 1122956952 /nfs/dbraw/zinc/95/69/52/1122956952.db2.gz OOTVSPFBEFMCQT-OLZOCXBDSA-N 1 0 299.374 3.964 20 5 CHBDRO CC(C)[C@@H](Cc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC001197770424 1122968829 /nfs/dbraw/zinc/96/88/29/1122968829.db2.gz SNPOQOGJNBUNHA-GOSISDBHSA-N 1 0 298.386 3.952 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)C(C)C ZINC000520564848 1123175828 /nfs/dbraw/zinc/17/58/28/1123175828.db2.gz YLFGGMNFNQKQTE-ZDUSSCGKSA-N 1 0 294.395 3.858 20 5 CHBDRO COc1ccc(C[NH2+][C@H](C)CCC(C)(C)C)cc1[N+](=O)[O-] ZINC000237246444 1123393968 /nfs/dbraw/zinc/39/39/68/1123393968.db2.gz SYBVQVRABGONQH-GFCCVEGCSA-N 1 0 294.395 3.908 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000474071598 1123410614 /nfs/dbraw/zinc/41/06/14/1123410614.db2.gz GISLJRFGSIDNMX-LLVKDONJSA-N 1 0 298.333 3.898 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)C1CCC(F)CC1 ZINC000852651446 1123411816 /nfs/dbraw/zinc/41/18/16/1123411816.db2.gz NIDMHKKDEPXTHZ-QFWMXSHPSA-N 1 0 298.333 3.740 20 5 CHBDRO CC[C@@H](C)C[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000088293456 1124006446 /nfs/dbraw/zinc/00/64/46/1124006446.db2.gz YUGZQIMWVZNZEB-YPMHNXCESA-N 1 0 264.369 3.818 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000034995606 1124021071 /nfs/dbraw/zinc/02/10/71/1124021071.db2.gz NMCPDXOSADIIQD-FZMZJTMJSA-N 1 0 262.353 3.572 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000444747533 1124058391 /nfs/dbraw/zinc/05/83/91/1124058391.db2.gz AIBXRNUGZAZSFJ-HNNXBMFYSA-N 1 0 276.380 3.505 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000444764890 1124060975 /nfs/dbraw/zinc/06/09/75/1124060975.db2.gz COOGOZBUJZLIPE-LBPRGKRZSA-N 1 0 280.343 3.602 20 5 CHBDRO C[C@H]1CCCCC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000088508028 1124061461 /nfs/dbraw/zinc/06/14/61/1124061461.db2.gz RMDGVAWKMVALRE-JSGCOSHPSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCCC12CC2 ZINC000866411402 1124064872 /nfs/dbraw/zinc/06/48/72/1124064872.db2.gz LCTPGOSJNGGUJH-ABAIWWIYSA-N 1 0 292.354 3.587 20 5 CHBDRO CCC(C)(CC)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000086247123 1129164712 /nfs/dbraw/zinc/16/47/12/1129164712.db2.gz RQSLSQQMEZBUMT-UHFFFAOYSA-N 1 0 250.342 3.572 20 5 CHBDRO Cc1cc(C)c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC000037668425 1129165462 /nfs/dbraw/zinc/16/54/62/1129165462.db2.gz ZUGYJQUEUPKRAK-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000088747816 1124096405 /nfs/dbraw/zinc/09/64/05/1124096405.db2.gz BMRXYPVWDAORTB-OCCSQVGLSA-N 1 0 260.337 3.663 20 5 CHBDRO Cc1ccc(CC[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])o1 ZINC000872022878 1124659158 /nfs/dbraw/zinc/65/91/58/1124659158.db2.gz MOEJZIJMQQCTGS-NSHDSACASA-N 1 0 292.310 3.529 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(C2CC2)CCC1 ZINC000449185673 1124666600 /nfs/dbraw/zinc/66/66/00/1124666600.db2.gz ICUONZBXJGXNAC-ZDUSSCGKSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@H]([NH2+]CC1(C2CC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872053935 1124667473 /nfs/dbraw/zinc/66/74/73/1124667473.db2.gz YPDKZHUHPCATRW-JTQLQIEISA-N 1 0 278.327 3.575 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCCCS1)c1c(F)cccc1[N+](=O)[O-] ZINC000872060266 1124669867 /nfs/dbraw/zinc/66/98/67/1124669867.db2.gz OLJZAYBIJBKOHI-MNOVXSKESA-N 1 0 298.383 3.670 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC12CC2 ZINC000872081704 1124677208 /nfs/dbraw/zinc/67/72/08/1124677208.db2.gz JIYDBNHYMWJAKW-TVQRCGJNSA-N 1 0 278.377 3.520 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1C=CCC1 ZINC000872086159 1124679781 /nfs/dbraw/zinc/67/97/81/1124679781.db2.gz UKDBUQLPUJNJOJ-WDEREUQCSA-N 1 0 278.377 3.686 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC2(CC2)CC1 ZINC000449283896 1124683183 /nfs/dbraw/zinc/68/31/83/1124683183.db2.gz NFNWVGIWCGZULV-ZDUSSCGKSA-N 1 0 288.391 3.838 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]3C3CC3)o2)cc1 ZINC000449425034 1124734192 /nfs/dbraw/zinc/73/41/92/1124734192.db2.gz MAZCNTRRUWOAHP-INIZCTEOSA-N 1 0 298.342 3.839 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000449445718 1124740189 /nfs/dbraw/zinc/74/01/89/1124740189.db2.gz LLSXTNBKCLJKGO-BJJXKVORSA-N 1 0 288.391 3.694 20 5 CHBDRO CSCC1(CC[NH2+]Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000873135983 1124741448 /nfs/dbraw/zinc/74/14/48/1124741448.db2.gz RMHYIHZDRTVPPJ-UHFFFAOYSA-N 1 0 294.420 3.526 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])ccc1F ZINC000873184087 1124748246 /nfs/dbraw/zinc/74/82/46/1124748246.db2.gz BJQQQMKWCGQOGY-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(CF)CC1 ZINC000449459624 1124748309 /nfs/dbraw/zinc/74/83/09/1124748309.db2.gz QQNOVYNUCWFUKF-UKTHLTGXSA-N 1 0 292.354 3.680 20 5 CHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ccco3)C2)cc1 ZINC000449498384 1124773352 /nfs/dbraw/zinc/77/33/52/1124773352.db2.gz KJOYGSVTQJJDDX-CQSZACIVSA-N 1 0 286.331 3.567 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000124847440 1124822403 /nfs/dbraw/zinc/82/24/03/1124822403.db2.gz BNWFIJBECUQGOX-CYBMUJFWSA-N 1 0 280.343 3.889 20 5 CHBDRO CCOC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000530491328 1125158662 /nfs/dbraw/zinc/15/86/62/1125158662.db2.gz WWSSQOMRUJNYOV-CZUORRHYSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000531378683 1125212981 /nfs/dbraw/zinc/21/29/81/1125212981.db2.gz JNOMWEJNEZFAPO-SUMWQHHRSA-N 1 0 282.343 3.788 20 5 CHBDRO Cc1cncc([C@@H]2CCCN2Cc2ccccc2[N+](=O)[O-])c1 ZINC000879748373 1125230571 /nfs/dbraw/zinc/23/05/71/1125230571.db2.gz ICWLMFRAYJEEBT-INIZCTEOSA-N 1 0 297.358 3.635 20 5 CHBDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000532195800 1125239878 /nfs/dbraw/zinc/23/98/78/1125239878.db2.gz HNDVDQFBYMJXAU-CYBMUJFWSA-N 1 0 288.347 3.698 20 5 CHBDRO Cc1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000296037929 1125268863 /nfs/dbraw/zinc/26/88/63/1125268863.db2.gz NTADEBITRZAHEM-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO CN(CC[NH3+])Cc1ccc2ccc3cccc4ccc1c2c34 ZINC001204699211 1125304206 /nfs/dbraw/zinc/30/42/06/1125304206.db2.gz IHJLLYWVZATRCB-UHFFFAOYSA-N 1 0 288.394 3.975 20 5 CHBDRO C[C@@H]([NH2+][C@H](C1CC1)C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000324713839 1125335348 /nfs/dbraw/zinc/33/53/48/1125335348.db2.gz XCYJCHRCKVQAET-BZNIZROVSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1cccc(C)c1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000130400020 1125360630 /nfs/dbraw/zinc/36/06/30/1125360630.db2.gz OIRXXBUTELFWTN-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO CC1(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC(F)(F)C1 ZINC000883257055 1125386702 /nfs/dbraw/zinc/38/67/02/1125386702.db2.gz PSOREEQAFJPBCL-GFCCVEGCSA-N 1 0 296.317 3.607 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCCC(C)C)cccc1[N+](=O)[O-] ZINC000532453339 1125389391 /nfs/dbraw/zinc/38/93/91/1125389391.db2.gz MESVKGHETONXQZ-CYBMUJFWSA-N 1 0 264.369 3.990 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CC[C@@H]1CCCC1(F)F ZINC000883266905 1125389539 /nfs/dbraw/zinc/38/95/39/1125389539.db2.gz NPZPYFODEKILCV-LBPRGKRZSA-N 1 0 284.306 3.510 20 5 CHBDRO CSCC[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000131623453 1125402644 /nfs/dbraw/zinc/40/26/44/1125402644.db2.gz RAWJQJSYCBMRJD-NWDGAFQWSA-N 1 0 282.409 3.695 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2csc([C@@H]3CCCC[NH2+]3)n2)c1 ZINC000053251877 1125424123 /nfs/dbraw/zinc/42/41/23/1125424123.db2.gz IACIEHMJPULGAF-LBPRGKRZSA-N 1 0 289.360 3.533 20 5 CHBDRO C[C@H](C[NH2+][C@@H]1CCC12CCC2)c1ccccc1[N+](=O)[O-] ZINC000897465032 1125424942 /nfs/dbraw/zinc/42/49/42/1125424942.db2.gz QZOMXYSXDSUYFJ-IUODEOHRSA-N 1 0 274.364 3.621 20 5 CHBDRO CC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000090909796 1129335905 /nfs/dbraw/zinc/33/59/05/1129335905.db2.gz RDGSFWFIMVPWHX-AWEZNQCLSA-N 1 0 290.388 3.940 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094773487 1129452092 /nfs/dbraw/zinc/45/20/92/1129452092.db2.gz LGWZARFXRGKZAC-JSGCOSHPSA-N 1 0 280.343 3.792 20 5 CHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000743272049 1129518827 /nfs/dbraw/zinc/51/88/27/1129518827.db2.gz LZWGSLXSQSFTPX-NSHDSACASA-N 1 0 268.332 3.600 20 5 CHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CC12CC2 ZINC000822497934 1131384817 /nfs/dbraw/zinc/38/48/17/1131384817.db2.gz OQUCBYQQHQRCQB-JTQLQIEISA-N 1 0 287.146 3.544 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCNc1ccccc1 ZINC000766514049 1129676591 /nfs/dbraw/zinc/67/65/91/1129676591.db2.gz DKLOFHFNFZVIOS-CQSZACIVSA-N 1 0 299.374 3.666 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(Cl)c1 ZINC001168986105 1129687644 /nfs/dbraw/zinc/68/76/44/1129687644.db2.gz VWHAZHXHGDTPCC-TUKIKUTGSA-N 1 0 296.798 3.826 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC001168965643 1129687803 /nfs/dbraw/zinc/68/78/03/1129687803.db2.gz BODDXPOGGWBKOQ-GLQYFDAESA-N 1 0 296.798 3.826 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccs1 ZINC001168968187 1129687984 /nfs/dbraw/zinc/68/79/84/1129687984.db2.gz XHCZKHUQSFWXLX-UPJWGTAASA-N 1 0 282.409 3.624 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](CC2CC2)c2ccccc2)C1 ZINC001169000941 1129688542 /nfs/dbraw/zinc/68/85/42/1129688542.db2.gz ZSCRJIXFAGWCFW-OIISXLGYSA-N 1 0 288.391 3.563 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C)cc1 ZINC001169006297 1129689094 /nfs/dbraw/zinc/68/90/94/1129689094.db2.gz XEHWNLJIZFVRSL-USXIJHARSA-N 1 0 290.407 3.871 20 5 CHBDRO Cc1cccc([C@H]([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C(C)C)c1 ZINC001169004119 1129689413 /nfs/dbraw/zinc/68/94/13/1129689413.db2.gz PZHXUIMFJWEOSV-DJIMGWMZSA-N 1 0 290.407 3.727 20 5 CHBDRO CC[C@H](C)C1CCC([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168988875 1129690060 /nfs/dbraw/zinc/69/00/60/1129690060.db2.gz ULVMCDWQWICQCX-RKVQBDSKSA-N 1 0 282.428 3.626 20 5 CHBDRO C[C@H](c1ccccc1Cl)[N@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169049593 1129691910 /nfs/dbraw/zinc/69/19/10/1129691910.db2.gz WQKLLLDQLUOGOR-UPJWGTAASA-N 1 0 296.798 3.778 20 5 CHBDRO OCC[N@H+](Cc1c2ccccc2cc2ccccc21)C1CC1 ZINC000768330160 1129851609 /nfs/dbraw/zinc/85/16/09/1129851609.db2.gz NZTYPSUWMUXBLL-UHFFFAOYSA-N 1 0 291.394 3.950 20 5 CHBDRO CNc1ccc(C)cc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000902078276 1129977391 /nfs/dbraw/zinc/97/73/91/1129977391.db2.gz LZQZSTGOYXZILP-ZDUSSCGKSA-N 1 0 299.374 3.796 20 5 CHBDRO CNc1ccccc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000902302519 1129998589 /nfs/dbraw/zinc/99/85/89/1129998589.db2.gz VAOJKWVWCWRNQQ-ZDUSSCGKSA-N 1 0 299.374 3.796 20 5 CHBDRO CC(C)[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000746656456 1130135337 /nfs/dbraw/zinc/13/53/37/1130135337.db2.gz YYDQANDFFICQEA-UHFFFAOYSA-N 1 0 268.744 3.621 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1ccco1)c1ccccc1[N+](=O)[O-] ZINC000903245727 1130135864 /nfs/dbraw/zinc/13/58/64/1130135864.db2.gz OOEVCBVRLPTCCB-NWDGAFQWSA-N 1 0 274.320 3.642 20 5 CHBDRO Cc1cncc([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000903287855 1130146583 /nfs/dbraw/zinc/14/65/83/1130146583.db2.gz RHGMTFDYKGCOHI-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000903338539 1130161671 /nfs/dbraw/zinc/16/16/71/1130161671.db2.gz IQXNDGQYVOCLBT-PXAZEXFGSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000903428002 1130175650 /nfs/dbraw/zinc/17/56/50/1130175650.db2.gz LOQJJMUHNQNJDW-SJCJKPOMSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000788740269 1130208092 /nfs/dbraw/zinc/20/80/92/1130208092.db2.gz QIHYXZOXGVNQTC-STQMWFEESA-N 1 0 299.374 3.631 20 5 CHBDRO CCC[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC001170365161 1130485823 /nfs/dbraw/zinc/48/58/23/1130485823.db2.gz LRRGQLPSKIOWHZ-OAHLLOKOSA-N 1 0 294.395 3.778 20 5 CHBDRO Cc1cc(O[C@H](C)C[N+](C)(C)C)c(Cl)cc1Cl ZINC001234059098 1130604600 /nfs/dbraw/zinc/60/46/00/1130604600.db2.gz RJQHMVKBVOTQSH-SNVBAGLBSA-N 1 0 277.215 3.775 20 5 CHBDRO CC1CC([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811483258 1130612105 /nfs/dbraw/zinc/61/21/05/1130612105.db2.gz FRIPPIGRFLAEEA-UHFFFAOYSA-N 1 0 289.162 3.790 20 5 CHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000217229249 1130920397 /nfs/dbraw/zinc/92/03/97/1130920397.db2.gz DEVLHQRZMIDTFA-CQSZACIVSA-N 1 0 280.343 3.744 20 5 CHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815579458 1131002496 /nfs/dbraw/zinc/00/24/96/1131002496.db2.gz NHMVGTKILXGILC-LJLILKBBSA-N 1 0 297.358 3.541 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799193238 1131075374 /nfs/dbraw/zinc/07/53/74/1131075374.db2.gz MFESSYTUKCUMPJ-UONOGXRCSA-N 1 0 297.358 3.540 20 5 CHBDRO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1C ZINC000816648932 1131120984 /nfs/dbraw/zinc/12/09/84/1131120984.db2.gz QWSOHKLWVIDRFC-RYUDHWBXSA-N 1 0 286.331 3.695 20 5 CHBDRO Cc1ccc(Nc2ccc3[nH]cnc3c2)cc1[N+](=O)[O-] ZINC001160224173 1131423011 /nfs/dbraw/zinc/42/30/11/1131423011.db2.gz PQDGFFKEVOAVQL-UHFFFAOYSA-N 1 0 268.276 3.523 20 5 CHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ccoc3)C2)cc1 ZINC000824820797 1131485873 /nfs/dbraw/zinc/48/58/73/1131485873.db2.gz NEWWPBYDFNEAEA-OAHLLOKOSA-N 1 0 286.331 3.567 20 5 CHBDRO C[C@@H](C[NH+](C)C)Oc1cccc2ccc3cccnc3c21 ZINC001227764159 1131740118 /nfs/dbraw/zinc/74/01/18/1131740118.db2.gz LPSLAWPFBSLUHL-ZDUSSCGKSA-N 1 0 280.371 3.717 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(Cl)cc1C(F)(F)F ZINC001228936697 1131980611 /nfs/dbraw/zinc/98/06/11/1131980611.db2.gz XSHKMILZFJMYFQ-SECBINFHSA-N 1 0 296.740 3.832 20 5 CHBDRO CCC[NH+](CCC)CCCNc1ccc(C)cc1[N+](=O)[O-] ZINC001649160091 1132007099 /nfs/dbraw/zinc/00/70/99/1132007099.db2.gz SSFMGPBLVFEFAW-UHFFFAOYSA-N 1 0 293.411 3.827 20 5 CHBDRO C[N@@H+]1CCC[C@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001230203230 1132159507 /nfs/dbraw/zinc/15/95/07/1132159507.db2.gz KBDRXYHHPJARIQ-HNNXBMFYSA-N 1 0 292.382 3.861 20 5 CHBDRO Cc1c(Cl)ccc2ccc(O[C@H](C)C[N+](C)(C)C)nc21 ZINC001231392429 1132289003 /nfs/dbraw/zinc/28/90/03/1132289003.db2.gz UVYUOYXNULSWMH-LLVKDONJSA-N 1 0 293.818 3.670 20 5 CHBDRO CC(C)([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C1CC1 ZINC001172895226 1132359589 /nfs/dbraw/zinc/35/95/89/1132359589.db2.gz BCAWAUPCAZMKHM-HNNXBMFYSA-N 1 0 288.391 3.620 20 5 CHBDRO CCCC[N@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909397 1132371304 /nfs/dbraw/zinc/37/13/04/1132371304.db2.gz RNCKRZSHACGUKS-HNNXBMFYSA-N 1 0 276.380 3.574 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1CCCCCC1)CC2 ZINC001172910393 1132372606 /nfs/dbraw/zinc/37/26/06/1132372606.db2.gz YTMKTKIWXBQBLJ-MRXNPFEDSA-N 1 0 288.391 3.718 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCC1(C)C ZINC001173217754 1132411323 /nfs/dbraw/zinc/41/13/23/1132411323.db2.gz FQWMREAUXIWYOR-DOMZBBRYSA-N 1 0 276.380 3.694 20 5 CHBDRO CC(C)CC[C@@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173217747 1132411362 /nfs/dbraw/zinc/41/13/62/1132411362.db2.gz LSRDZYIMXHQPQV-ZIAGYGMSSA-N 1 0 278.396 3.940 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173227272 1132412313 /nfs/dbraw/zinc/41/23/13/1132412313.db2.gz PCMQEMFNLUJDPH-OAHLLOKOSA-N 1 0 298.386 3.966 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)C[C@H]1C ZINC001173227601 1132412512 /nfs/dbraw/zinc/41/25/12/1132412512.db2.gz RFTMWBBNKNTULO-MCIONIFRSA-N 1 0 276.380 3.646 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(CC2CC2)CC1 ZINC001173225045 1132412987 /nfs/dbraw/zinc/41/29/87/1132412987.db2.gz QPWARUIJNUQDFE-ZDUSSCGKSA-N 1 0 288.391 3.696 20 5 CHBDRO CCCC[C@@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230844 1132413992 /nfs/dbraw/zinc/41/39/92/1132413992.db2.gz VDYVQCRXPHDNFI-OLZOCXBDSA-N 1 0 264.369 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCc1ccccc1 ZINC001173229888 1132414273 /nfs/dbraw/zinc/41/42/73/1132414273.db2.gz WBCABZYIBKESJG-HNNXBMFYSA-N 1 0 298.386 3.700 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCc2ccccc21 ZINC001173214219 1132416367 /nfs/dbraw/zinc/41/63/67/1132416367.db2.gz NLCGIDNWYIXJHU-UGSOOPFHSA-N 1 0 296.370 3.803 20 5 CHBDRO CC(C)C[N@H+](C)Cc1ccc2ccc3cccnc3c2n1 ZINC001232219037 1132439084 /nfs/dbraw/zinc/43/90/84/1132439084.db2.gz LXEUJUWUZCFCFG-UHFFFAOYSA-N 1 0 279.387 3.871 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)cc1Cl ZINC000843434688 1132535417 /nfs/dbraw/zinc/53/54/17/1132535417.db2.gz MMNSEFCSRBRVKH-SDDRHHMPSA-N 1 0 280.755 3.526 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2ccc3c(c2)C[NH2+]C3)c(Cl)c1 ZINC001159472644 1132850678 /nfs/dbraw/zinc/85/06/78/1132850678.db2.gz OUOQNVUPNKLIFG-UHFFFAOYSA-N 1 0 289.722 3.595 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2cccc(C3CC[NH2+]CC3)c2)cc1 ZINC001159757295 1132904073 /nfs/dbraw/zinc/90/40/73/1132904073.db2.gz MHYQIIFZKNCMHJ-UHFFFAOYSA-N 1 0 297.358 3.805 20 5 CHBDRO Cc1c(C[N@@H+]2CC(C)(C)[C@@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001206117075 1133660402 /nfs/dbraw/zinc/66/04/02/1133660402.db2.gz XSFWAGLTDDSJQH-HNNXBMFYSA-N 1 0 274.364 3.524 20 5 CHBDRO O=[N+]([O-])c1ccccc1Nc1cc[nH+]c(C2CC2)c1 ZINC001206157864 1133665071 /nfs/dbraw/zinc/66/50/71/1133665071.db2.gz HELMWIPTCONQRS-UHFFFAOYSA-N 1 0 255.277 3.611 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1ccc(C[NH+](C)C)cc1 ZINC001211289092 1134403732 /nfs/dbraw/zinc/40/37/32/1134403732.db2.gz INAZMSBOJHMAPE-UHFFFAOYSA-N 1 0 285.347 3.708 20 5 CHBDRO C[C@H]1CCCC[C@]1(C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000308696488 1134977817 /nfs/dbraw/zinc/97/78/17/1134977817.db2.gz FNBDKCIQEADODL-WFASDCNBSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H](Oc1c2ccccc2cc2ccccc21)C1C[NH2+]C1 ZINC001218198604 1135068035 /nfs/dbraw/zinc/06/80/35/1135068035.db2.gz NVIWNHBUOAFCHA-CYBMUJFWSA-N 1 0 277.367 3.980 20 5 CHBDRO Cc1cc(C)c2ccc3cccc(O[C@H]4C[NH2+][C@@H]4C)c3c2n1 ZINC001218388158 1135097275 /nfs/dbraw/zinc/09/72/75/1135097275.db2.gz RQZBPUIRBJXLDR-DYVFJYSZSA-N 1 0 292.382 3.744 20 5 CHBDRO C[C@H]1CC[C@H](Oc2cccc3ccc4cccnc4c32)C[NH2+]1 ZINC001218399376 1135099593 /nfs/dbraw/zinc/09/95/93/1135099593.db2.gz PQYCIXSSVHKXIV-BBRMVZONSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000316526958 1135167039 /nfs/dbraw/zinc/16/70/39/1135167039.db2.gz ZGEZSPWKQSPIRO-DIFFPNOSSA-N 1 0 297.358 3.515 20 5 CHBDRO C[C@H](OCC[N+](C)(C)C)c1cc2ccccc2s1 ZINC001224771584 1135480479 /nfs/dbraw/zinc/48/04/79/1135480479.db2.gz OTJWUZQENNDDDE-LBPRGKRZSA-N 1 0 264.414 3.685 20 5 CHBDRO C[C@@H](OCCC[NH+]1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC001224861435 1135489867 /nfs/dbraw/zinc/48/98/67/1135489867.db2.gz WYVRSVOURVIMOX-CQSZACIVSA-N 1 0 292.379 3.548 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000322342676 1135674637 /nfs/dbraw/zinc/67/46/37/1135674637.db2.gz COHSFUNJTRVHJZ-OAHLLOKOSA-N 1 0 276.380 3.962 20 5 CHBDRO C[C@H]1CCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000071206253 176079927 /nfs/dbraw/zinc/07/99/27/176079927.db2.gz CWMUWGJMBNBQNS-TVQRCGJNSA-N 1 0 268.744 3.526 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000071205889 176080040 /nfs/dbraw/zinc/08/00/40/176080040.db2.gz YCDYNJQNFDWGBI-JKOKRWQUSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000037177082 260072862 /nfs/dbraw/zinc/07/28/62/260072862.db2.gz XILDLRVBJSVJET-SJKOYZFVSA-N 1 0 282.343 3.933 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)CC2CC2)cc1[N+](=O)[O-] ZINC000070101183 260152148 /nfs/dbraw/zinc/15/21/48/260152148.db2.gz UKNMPRLXFFRCMP-NEPJUHHUSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]1CCC[C@H](C[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000089609120 260190075 /nfs/dbraw/zinc/19/00/75/260190075.db2.gz LNLBKOAWOWCMEC-HIFRSBDPSA-N 1 0 276.380 3.553 20 5 CHBDRO CCC[C@@H]([NH2+]CC(O)(CC)CC)c1cccc([N+](=O)[O-])c1 ZINC000087014748 260211169 /nfs/dbraw/zinc/21/11/69/260211169.db2.gz GRTTUFRCMPRIJI-OAHLLOKOSA-N 1 0 294.395 3.577 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC000090217582 260239938 /nfs/dbraw/zinc/23/99/38/260239938.db2.gz HYWNFSHSRLNHTQ-NWDGAFQWSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000090918639 260264167 /nfs/dbraw/zinc/26/41/67/260264167.db2.gz OFDPOFTXEVKADN-NHYWBVRUSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC000015301425 260362566 /nfs/dbraw/zinc/36/25/66/260362566.db2.gz WMUBNOHUPRYFKD-AWEZNQCLSA-N 1 0 288.372 3.993 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000132692425 260505345 /nfs/dbraw/zinc/50/53/45/260505345.db2.gz HPFOQMXHAGQRLD-ZOWXZIJZSA-N 1 0 262.353 3.824 20 5 CHBDRO CCC[C@H]([NH2+]CC1(OC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000180201381 261421571 /nfs/dbraw/zinc/42/15/71/261421571.db2.gz UAXPSPCNNVQBOA-HNNXBMFYSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@@H]([NH2+]CCCCOC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000180465407 261424153 /nfs/dbraw/zinc/42/41/53/261424153.db2.gz PXTXMMAARKGBIE-MRXNPFEDSA-N 1 0 294.395 3.841 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000318867631 262088268 /nfs/dbraw/zinc/08/82/68/262088268.db2.gz DCFFIHOFBMXKGN-GOSISDBHSA-N 1 0 296.370 3.723 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccnc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000391159862 262384362 /nfs/dbraw/zinc/38/43/62/262384362.db2.gz BDSDMBPZOVAJBK-INIZCTEOSA-N 1 0 285.347 3.539 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2C[C@@H]2C)cc1[N+](=O)[O-] ZINC000414105070 262805144 /nfs/dbraw/zinc/80/51/44/262805144.db2.gz ZRMRXOSITKXOLH-FMSGJZPZSA-N 1 0 262.353 3.598 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1cccc([N+](=O)[O-])c1 ZINC000187848238 263271569 /nfs/dbraw/zinc/27/15/69/263271569.db2.gz AYOBKFLYDBEJBR-CABCVRRESA-N 1 0 292.379 3.593 20 5 CHBDRO CCOC[C@H]([NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000189357829 264293677 /nfs/dbraw/zinc/29/36/77/264293677.db2.gz MHEAANUMRMUEAL-HOTGVXAUSA-N 1 0 294.395 3.697 20 5 CHBDRO CC[C@H](C)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000054467635 264338820 /nfs/dbraw/zinc/33/88/20/264338820.db2.gz CRSRAHNNLCUZPG-CMPLNLGQSA-N 1 0 250.342 3.600 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000094307443 265234776 /nfs/dbraw/zinc/23/47/76/265234776.db2.gz KYYWSCBIUZGXBQ-SMDDNHRTSA-N 1 0 262.353 3.824 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000094323298 265236717 /nfs/dbraw/zinc/23/67/17/265236717.db2.gz KHVYQKQEOOHRLR-LLVKDONJSA-N 1 0 268.382 3.715 20 5 CHBDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000483720191 267299545 /nfs/dbraw/zinc/29/95/45/267299545.db2.gz FMTDOJASACFNIR-DAXOMENPSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H]1CCC[C@](CNc2ccccc2[N+](=O)[O-])([NH+](C)C)C1 ZINC000040669971 328015236 /nfs/dbraw/zinc/01/52/36/328015236.db2.gz YYMITHVCKPSMSE-BBRMVZONSA-N 1 0 291.395 3.517 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccsc1 ZINC000531681895 328020740 /nfs/dbraw/zinc/02/07/40/328020740.db2.gz AUWSQPSGSSMAAO-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO CC(C)=CCC[C@@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000531704579 328026753 /nfs/dbraw/zinc/02/67/53/328026753.db2.gz KOBHNLVUPXNTBJ-CQSZACIVSA-N 1 0 276.380 3.862 20 5 CHBDRO CCCC[C@H](COC)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000531714530 328028022 /nfs/dbraw/zinc/02/80/22/328028022.db2.gz BAZKTQRUAARKFU-ZIAGYGMSSA-N 1 0 294.395 3.759 20 5 CHBDRO CC[C@H](C)C[N@H+](CC)Cc1csc([N+](=O)[O-])c1 ZINC000177858155 329192959 /nfs/dbraw/zinc/19/29/59/329192959.db2.gz PGLNEPSJQFKWAE-JTQLQIEISA-N 1 0 256.371 3.524 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000048557155 328314660 /nfs/dbraw/zinc/31/46/60/328314660.db2.gz LVHVYUFTNIPTGX-GFCCVEGCSA-N 1 0 290.388 3.686 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000049120315 328340210 /nfs/dbraw/zinc/34/02/10/328340210.db2.gz ZWSDZZJUMCKDOO-KGLIPLIRSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1ccccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963455 328379953 /nfs/dbraw/zinc/37/99/53/328379953.db2.gz PDZRKWPFGYHMNZ-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2C3CCC2CC3)o1 ZINC000535066416 328383005 /nfs/dbraw/zinc/38/30/05/328383005.db2.gz OOLSWUNMQIAVFZ-UHFFFAOYSA-N 1 0 298.342 3.982 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)CCC(C)C ZINC000070185942 328449388 /nfs/dbraw/zinc/44/93/88/328449388.db2.gz LWAONRNWOCCARN-LBPRGKRZSA-N 1 0 280.368 3.518 20 5 CHBDRO C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000071207132 328480207 /nfs/dbraw/zinc/48/02/07/328480207.db2.gz NBTBIACFHXXETD-RNCFNFMXSA-N 1 0 268.744 3.526 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H]1CC[C@@H](C)O1)c1cccc([N+](=O)[O-])c1 ZINC000398103842 326871460 /nfs/dbraw/zinc/87/14/60/326871460.db2.gz YMTGNGUBTZSOTD-KCXAZCMYSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H](C1CC1)[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000255713868 327006958 /nfs/dbraw/zinc/00/69/58/327006958.db2.gz PCIALLMDNUDLTL-RYWCDNDXSA-N 1 0 286.375 3.871 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000558222022 327079427 /nfs/dbraw/zinc/07/94/27/327079427.db2.gz KRNDPUXAIMKAOV-UONOGXRCSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCC1(C)C ZINC000558256933 327083488 /nfs/dbraw/zinc/08/34/88/327083488.db2.gz LFGULXCJMCNPIN-BXUZGUMPSA-N 1 0 262.353 3.742 20 5 CHBDRO CC(C)SCC[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000558260373 327083985 /nfs/dbraw/zinc/08/39/85/327083985.db2.gz YGRWWNVVGNJUBD-CYBMUJFWSA-N 1 0 296.436 3.647 20 5 CHBDRO Cc1ccc(C[N@H+](C)CCc2cccs2)cc1[N+](=O)[O-] ZINC000093685405 327199207 /nfs/dbraw/zinc/19/92/07/327199207.db2.gz URMIYCPCAZYJSP-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO CC(C)CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000151765077 327502762 /nfs/dbraw/zinc/50/27/62/327502762.db2.gz YKPICAFTDLLZJM-HNNXBMFYSA-N 1 0 276.380 3.552 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCCC[C@@H]2C2CC2)cc1 ZINC000507463137 332807174 /nfs/dbraw/zinc/80/71/74/332807174.db2.gz RDFSBPABNJYCBM-SJORKVTESA-N 1 0 288.391 3.696 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3(C4CC4)CC3)o2)cc1 ZINC000532119659 328699770 /nfs/dbraw/zinc/69/97/70/328699770.db2.gz KFTTXWDBCMLDAH-UHFFFAOYSA-N 1 0 298.342 3.887 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC12CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000395646366 328751869 /nfs/dbraw/zinc/75/18/69/328751869.db2.gz NQPIPAOAVGXKIU-FZMZJTMJSA-N 1 0 260.337 3.578 20 5 CHBDRO COc1ccc(C[NH2+]C[C@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000042863329 328771719 /nfs/dbraw/zinc/77/17/19/328771719.db2.gz RPTFZNKNXYZFAG-TZMCWYRMSA-N 1 0 292.379 3.519 20 5 CHBDRO C[C@@H]1CCC[C@@H](C[NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000507939342 332829977 /nfs/dbraw/zinc/82/99/77/332829977.db2.gz PRYKLNQYTQDWBX-UKRRQHHQSA-N 1 0 276.380 3.553 20 5 CHBDRO CC[C@@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000402495209 332834033 /nfs/dbraw/zinc/83/40/33/332834033.db2.gz RESKZXFHPNQPOD-SNVBAGLBSA-N 1 0 290.285 3.663 20 5 CHBDRO CC[C@H]([NH2+]CC1(SC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000193816095 329063287 /nfs/dbraw/zinc/06/32/87/329063287.db2.gz JNKHTFHPJYIZCS-ZDUSSCGKSA-N 1 0 280.393 3.531 20 5 CHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000174352884 329157541 /nfs/dbraw/zinc/15/75/41/329157541.db2.gz KSQKMLOTRUSIDM-KGLIPLIRSA-N 1 0 294.420 3.701 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](CC)[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000181743237 329236309 /nfs/dbraw/zinc/23/63/09/329236309.db2.gz JSHPTOIXFZQDJX-PMPSAXMXSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]C3CC4(CCC4)C3)c2c1 ZINC000583010309 329302186 /nfs/dbraw/zinc/30/21/86/329302186.db2.gz OCWCIBSGLKOJEK-UHFFFAOYSA-N 1 0 299.374 3.541 20 5 CHBDRO CC(F)(F)CCC[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000583092901 329314897 /nfs/dbraw/zinc/31/48/97/329314897.db2.gz BEUFYKFRSHCJBR-GFCCVEGCSA-N 1 0 284.306 3.607 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1C[C@@H]1C ZINC000321714465 329393276 /nfs/dbraw/zinc/39/32/76/329393276.db2.gz VQQIVOGQCCWIIR-JLUCKKNBSA-N 1 0 262.353 3.680 20 5 CHBDRO CC[C@@H]([NH2+]CC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000040492782 329556201 /nfs/dbraw/zinc/55/62/01/329556201.db2.gz IZMYDVQMSMQYAH-CYBMUJFWSA-N 1 0 250.342 3.682 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509358512 332866408 /nfs/dbraw/zinc/86/64/08/332866408.db2.gz PLMQTCASOAPPCP-UHFFFAOYSA-N 1 0 286.322 3.931 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCC[C@H]3C[C@H]32)c(Cl)c1 ZINC000571703380 329911430 /nfs/dbraw/zinc/91/14/30/329911430.db2.gz IUHSJERABASPOV-BHYNMZESSA-N 1 0 280.755 3.526 20 5 CHBDRO CC[C@H]([NH2+]Cc1cc(C)nc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000421867057 330099359 /nfs/dbraw/zinc/09/93/59/330099359.db2.gz BRERILLCNQOVKX-KRWDZBQOSA-N 1 0 299.374 3.848 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000080347157 330124177 /nfs/dbraw/zinc/12/41/77/330124177.db2.gz KFBJNZPLLZBQBR-UHFFFAOYSA-N 1 0 274.320 3.521 20 5 CHBDRO CC(C)([NH2+]CC1(C)CCC1)c1ccccc1[N+](=O)[O-] ZINC000433199279 330208889 /nfs/dbraw/zinc/20/88/89/330208889.db2.gz KSCAMGSOBGCGAB-UHFFFAOYSA-N 1 0 262.353 3.610 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000396960215 330232100 /nfs/dbraw/zinc/23/21/00/330232100.db2.gz ZBFRCUJBSYEVJV-NXEZZACHSA-N 1 0 290.285 3.834 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000035648750 330248342 /nfs/dbraw/zinc/24/83/42/330248342.db2.gz NRFPQAOGBAHQBP-BXUZGUMPSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000035648902 330248467 /nfs/dbraw/zinc/24/84/67/330248467.db2.gz RVMFIRVDLFDEDV-BXUZGUMPSA-N 1 0 262.353 3.572 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000036854546 330304754 /nfs/dbraw/zinc/30/47/54/330304754.db2.gz AWJMTCQNOKHAIF-YRGRVCCFSA-N 1 0 292.379 3.518 20 5 CHBDRO CC(C)[N@H+](Cc1csc([N+](=O)[O-])c1)C1CCCC1 ZINC000108364201 330353658 /nfs/dbraw/zinc/35/36/58/330353658.db2.gz IFKQTFXWDGOAMQ-UHFFFAOYSA-N 1 0 268.382 3.809 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C[C@@H]1C ZINC000085042374 330364218 /nfs/dbraw/zinc/36/42/18/330364218.db2.gz XYATZFKNFFDMML-JFGNBEQYSA-N 1 0 268.382 3.571 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(Cl)s2)c1 ZINC000055483281 330365902 /nfs/dbraw/zinc/36/59/02/330365902.db2.gz IBNBDPAXUOVYLU-UHFFFAOYSA-N 1 0 282.752 3.600 20 5 CHBDRO CC[C@H](C)C[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000088293579 330375650 /nfs/dbraw/zinc/37/56/50/330375650.db2.gz OBYYGJNDDQYANA-VHSXEESVSA-N 1 0 256.371 3.571 20 5 CHBDRO C[C@H]1CC([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)C1 ZINC000084461663 330485906 /nfs/dbraw/zinc/48/59/06/330485906.db2.gz AILBVVIWPIADDP-VXGBXAGGSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000084988318 330488962 /nfs/dbraw/zinc/48/89/62/330488962.db2.gz YOEAELYWXYIKPF-MBNYWOFBSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC(C)(C)C ZINC000449075845 330897375 /nfs/dbraw/zinc/89/73/75/330897375.db2.gz SENQXIHVBMSJHN-GFCCVEGCSA-N 1 0 264.369 3.552 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCO[C@H](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000449177121 330903764 /nfs/dbraw/zinc/90/37/64/330903764.db2.gz UUVNEPUDMXHTOA-NUEKZKHPSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC[C@@H]1C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449350464 330917423 /nfs/dbraw/zinc/91/74/23/330917423.db2.gz WFKNBVWBLCCYAT-XZJROXQQSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000449755297 330948041 /nfs/dbraw/zinc/94/80/41/330948041.db2.gz NXZXZQLBHLLVSW-PPOCWRSBSA-N 1 0 274.364 3.776 20 5 CHBDRO C[C@@H](F)CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553152 331033925 /nfs/dbraw/zinc/03/39/25/331033925.db2.gz XPYAJBMUILJVJM-OCCSQVGLSA-N 1 0 280.343 3.522 20 5 CHBDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000163413304 331036934 /nfs/dbraw/zinc/03/69/34/331036934.db2.gz UAHWSILCRIAMCM-SNVBAGLBSA-N 1 0 290.285 3.806 20 5 CHBDRO CC[C@@H]1C[C@H]1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453305088 331113797 /nfs/dbraw/zinc/11/37/97/331113797.db2.gz GXAMNCTULZBVQN-XQQFMLRXSA-N 1 0 262.353 3.600 20 5 CHBDRO C[C@@H]([NH2+]CCC1CC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000453417365 331130392 /nfs/dbraw/zinc/13/03/92/331130392.db2.gz KHBIZJLSAPOJCW-SNVBAGLBSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC1CC(F)(F)C1 ZINC000453438984 331131831 /nfs/dbraw/zinc/13/18/31/331131831.db2.gz VPDKAOHQQKSQDB-LLVKDONJSA-N 1 0 298.333 3.551 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CC3(CCC3)C2)c(Cl)c1 ZINC000459484574 331284309 /nfs/dbraw/zinc/28/43/09/331284309.db2.gz TULHVLPTMFHTPB-UHFFFAOYSA-N 1 0 280.755 3.671 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1(C2CCC2)CCC1 ZINC000459750574 331298268 /nfs/dbraw/zinc/29/82/68/331298268.db2.gz PZXVTRNKKSWGDG-DAXSKMNVSA-N 1 0 286.375 3.920 20 5 CHBDRO CC1(C)C[C@H]([NH2+]CCCCF)c2cc([N+](=O)[O-])ccc21 ZINC000462818563 331330909 /nfs/dbraw/zinc/33/09/09/331330909.db2.gz JCHCBINADHVWAJ-AWEZNQCLSA-N 1 0 280.343 3.657 20 5 CHBDRO Cc1ccccc1[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000466385198 331394301 /nfs/dbraw/zinc/39/43/01/331394301.db2.gz BDMBYNPCHTYNQN-WKILWMFISA-N 1 0 296.370 3.939 20 5 CHBDRO Cc1ccccc1[C@H]1C[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000466402549 331395246 /nfs/dbraw/zinc/39/52/46/331395246.db2.gz XWDRQDMQENWFIZ-WKILWMFISA-N 1 0 296.370 3.939 20 5 CHBDRO CCc1ccc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])o1 ZINC000467982638 331426221 /nfs/dbraw/zinc/42/62/21/331426221.db2.gz KEVPTXUKCVUDKF-LBPRGKRZSA-N 1 0 288.347 3.644 20 5 CHBDRO C[C@@H]1CC[C@H](C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000475547652 331636295 /nfs/dbraw/zinc/63/62/95/331636295.db2.gz KODDWAYZJRHWRC-HXINVUTJSA-N 1 0 274.364 3.634 20 5 CHBDRO CC[C@@H](C)C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000487198280 331959153 /nfs/dbraw/zinc/95/91/53/331959153.db2.gz VRPOCVYWHPGWKG-SECBINFHSA-N 1 0 290.285 3.749 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCc1ccccc1 ZINC000489122271 332041918 /nfs/dbraw/zinc/04/19/18/332041918.db2.gz JOXOSAVULMCUPV-AWEZNQCLSA-N 1 0 284.359 3.830 20 5 CHBDRO COc1cc(C[N@@H+]2C[C@H](C)CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000490029442 332077212 /nfs/dbraw/zinc/07/72/12/332077212.db2.gz KIMCXNCUPXRCHA-CHWSQXEVSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCCOC(C)C ZINC000490091341 332081065 /nfs/dbraw/zinc/08/10/65/332081065.db2.gz XDKYAWFIZSKYFD-CQSZACIVSA-N 1 0 294.395 3.711 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](C2CC2)[C@@H]2C=CCCC2)cc1 ZINC000490838908 332118985 /nfs/dbraw/zinc/11/89/85/332118985.db2.gz BITDPEGDICMFHI-CQSZACIVSA-N 1 0 272.348 3.668 20 5 CHBDRO CC(C)[C@H](C)[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000491092442 332147916 /nfs/dbraw/zinc/14/79/16/332147916.db2.gz SODCCINZBSUBBV-NSHDSACASA-N 1 0 280.343 3.743 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1occc1C ZINC000491432159 332210773 /nfs/dbraw/zinc/21/07/73/332210773.db2.gz MWLHMCWNMRJLFE-XYOKQWHBSA-N 1 0 286.331 3.689 20 5 CHBDRO CC(C)[NH+](Cc1c(Cl)cccc1[N+](=O)[O-])C(C)C ZINC000492192894 332386483 /nfs/dbraw/zinc/38/64/83/332386483.db2.gz KRLQMWMZLLITGI-UHFFFAOYSA-N 1 0 270.760 3.867 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCCC[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492374238 332394645 /nfs/dbraw/zinc/39/46/45/332394645.db2.gz HFMPRIHVKSIHSY-AWEZNQCLSA-N 1 0 292.379 3.758 20 5 CHBDRO CCCC[N@H+](CC)Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492415825 332396412 /nfs/dbraw/zinc/39/64/12/332396412.db2.gz HRXJCIKMXWYCQM-UHFFFAOYSA-N 1 0 280.368 3.616 20 5 CHBDRO CCOc1cc(C[NH2+][C@@H](CC)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000492610938 332405631 /nfs/dbraw/zinc/40/56/31/332405631.db2.gz YGSXYLLCWVQCTB-HNNXBMFYSA-N 1 0 294.395 3.908 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000502056165 332646904 /nfs/dbraw/zinc/64/69/04/332646904.db2.gz HNADYMCMUAZMOH-GOEBONIOSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)oc1C ZINC000502453242 332660788 /nfs/dbraw/zinc/66/07/88/332660788.db2.gz OIBBCEVDNIZYTO-GFCCVEGCSA-N 1 0 288.347 3.964 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@@H]1C ZINC000504899490 332723910 /nfs/dbraw/zinc/72/39/10/332723910.db2.gz HRPICUJFLLPNNO-RWMBFGLXSA-N 1 0 294.420 3.711 20 5 CHBDRO CCCC(O)(CCC)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173431405 332971376 /nfs/dbraw/zinc/97/13/76/332971376.db2.gz YFFVVHIHKBVDIV-CYBMUJFWSA-N 1 0 294.395 3.577 20 5 CHBDRO C[C@H]1CC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000513070003 333002734 /nfs/dbraw/zinc/00/27/34/333002734.db2.gz QMIVFCBBIFDHAH-XHDPSFHLSA-N 1 0 286.331 3.743 20 5 CHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCCC(F)(F)C1 ZINC000513897387 333048176 /nfs/dbraw/zinc/04/81/76/333048176.db2.gz PWXSWGYKKRMVCO-LBPRGKRZSA-N 1 0 298.333 3.852 20 5 CHBDRO CC(C)C[C@@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000311287874 333066740 /nfs/dbraw/zinc/06/67/40/333066740.db2.gz NMDNVDRZUOAKHO-OLZOCXBDSA-N 1 0 264.369 3.928 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000311920646 333074554 /nfs/dbraw/zinc/07/45/54/333074554.db2.gz DQOGJFXGJMOFNX-FZMZJTMJSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1cc(NCC[N@H+]2[C@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000517393909 333098791 /nfs/dbraw/zinc/09/87/91/333098791.db2.gz WBYBMXPXSZGCLR-OKILXGFUSA-N 1 0 291.395 3.578 20 5 CHBDRO CC(C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000517720444 333106578 /nfs/dbraw/zinc/10/65/78/333106578.db2.gz CVWOOUCZAHMHCB-UHFFFAOYSA-N 1 0 299.374 3.861 20 5 CHBDRO Cc1ccc(C[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000520972370 333109063 /nfs/dbraw/zinc/10/90/63/333109063.db2.gz PHENCYMORKZICA-HNNXBMFYSA-N 1 0 298.386 3.932 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1CCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000187070388 333167810 /nfs/dbraw/zinc/16/78/10/333167810.db2.gz BQRFGIASJGQRNJ-NWDGAFQWSA-N 1 0 294.420 3.777 20 5 CHBDRO CC(C)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000521821770 333190295 /nfs/dbraw/zinc/19/02/95/333190295.db2.gz VFCFCXRFSXOMDZ-UHFFFAOYSA-N 1 0 276.380 3.995 20 5 CHBDRO CCCC[C@@H](CC)C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000223448132 333208004 /nfs/dbraw/zinc/20/80/04/333208004.db2.gz GRACSNWCZKBDNZ-CYBMUJFWSA-N 1 0 294.395 3.909 20 5 CHBDRO CS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000223722569 333211403 /nfs/dbraw/zinc/21/14/03/333211403.db2.gz RAVNQYCWZBZNPY-NJZAAPMLSA-N 1 0 294.420 3.920 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2C2CCCC2)cc1 ZINC000522269175 333277311 /nfs/dbraw/zinc/27/73/11/333277311.db2.gz YXLYLBLZJUYCMH-KRWDZBQOSA-N 1 0 288.391 3.792 20 5 CHBDRO COc1ccc(C[NH2+][C@H]2CCC[C@@H](C)CC2)cc1[N+](=O)[O-] ZINC000227310173 333280100 /nfs/dbraw/zinc/28/01/00/333280100.db2.gz SMADDBHZJMNDSW-OCCSQVGLSA-N 1 0 292.379 3.662 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2(C3CC3)CC2)c(Cl)c1 ZINC000230146239 333314952 /nfs/dbraw/zinc/31/49/52/333314952.db2.gz QSONFLIJOVINKL-UHFFFAOYSA-N 1 0 280.755 3.528 20 5 CHBDRO Cc1ccccc1C[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000037777322 333539554 /nfs/dbraw/zinc/53/95/54/333539554.db2.gz QMZLJCLAOIUUDW-AWEZNQCLSA-N 1 0 284.359 3.624 20 5 CHBDRO CC(C)(C[NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000037934827 333543140 /nfs/dbraw/zinc/54/31/40/333543140.db2.gz KHAILENDCZCDFG-UHFFFAOYSA-N 1 0 284.359 3.662 20 5 CHBDRO CC[C@H](C)C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000538967119 333647084 /nfs/dbraw/zinc/64/70/84/333647084.db2.gz XVGVAFQYEWOEOJ-ZDUSSCGKSA-N 1 0 264.369 3.553 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000540152677 333713830 /nfs/dbraw/zinc/71/38/30/333713830.db2.gz KZDBLQZUEIVKGC-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000540153216 333714228 /nfs/dbraw/zinc/71/42/28/333714228.db2.gz AUAQDBAPUJPEBU-CYBMUJFWSA-N 1 0 276.380 3.990 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2CC2(C)C)cccc1[N+](=O)[O-] ZINC000540174590 333717632 /nfs/dbraw/zinc/71/76/32/333717632.db2.gz GARJQGHLKBKQML-NWDGAFQWSA-N 1 0 262.353 3.600 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000129669883 333786314 /nfs/dbraw/zinc/78/63/14/333786314.db2.gz WYLOAOIMPLLMTD-WHOFXGATSA-N 1 0 262.353 3.682 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCc2ccccc2CC1 ZINC000542701751 333837441 /nfs/dbraw/zinc/83/74/41/333837441.db2.gz JXZIHMFFCQIEQV-UHFFFAOYSA-N 1 0 296.370 3.504 20 5 CHBDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000071117719 333844052 /nfs/dbraw/zinc/84/40/52/333844052.db2.gz ACUCVNYASBUGFW-GXTWGEPZSA-N 1 0 262.353 3.653 20 5 CHBDRO CC(C)([NH2+]C[C@@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000545872344 334003451 /nfs/dbraw/zinc/00/34/51/334003451.db2.gz AMXJHEWDVOEKOE-CYBMUJFWSA-N 1 0 274.364 3.776 20 5 CHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000546888688 334054209 /nfs/dbraw/zinc/05/42/09/334054209.db2.gz UJOCRWVYJNKHKX-VHSXEESVSA-N 1 0 290.285 3.976 20 5 CHBDRO CCCC[C@H](COC)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000134055432 334078992 /nfs/dbraw/zinc/07/89/92/334078992.db2.gz SXVLACKOOMIONY-UONOGXRCSA-N 1 0 294.395 3.759 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)cc1 ZINC000081635456 334201227 /nfs/dbraw/zinc/20/12/27/334201227.db2.gz MINATVPSTSFKKV-CABCVRRESA-N 1 0 274.364 3.653 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000550032835 334211647 /nfs/dbraw/zinc/21/16/47/334211647.db2.gz ZBERDLNXWTWHGK-LBPRGKRZSA-N 1 0 294.782 3.870 20 5 CHBDRO CC(C)(C)C1CC([NH2+]Cc2csc([N+](=O)[O-])c2)C1 ZINC000550255896 334217836 /nfs/dbraw/zinc/21/78/36/334217836.db2.gz YCTOMKACNFVVSG-UHFFFAOYSA-N 1 0 268.382 3.571 20 5 CHBDRO C[C@@H](C[N@H+](C)CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000551012151 334236305 /nfs/dbraw/zinc/23/63/05/334236305.db2.gz LZURDPIZHNJOLG-HNNXBMFYSA-N 1 0 298.386 3.873 20 5 CHBDRO CS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000248153268 334296216 /nfs/dbraw/zinc/29/62/16/334296216.db2.gz RAVNQYCWZBZNPY-UXIGCNINSA-N 1 0 294.420 3.920 20 5 CHBDRO C[C@H]([NH2+]CC(C1CC1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000088455499 334338799 /nfs/dbraw/zinc/33/87/99/334338799.db2.gz UIEWQFPSZHYAPQ-NSHDSACASA-N 1 0 274.364 3.682 20 5 CHBDRO CCC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000090219491 334358808 /nfs/dbraw/zinc/35/88/08/334358808.db2.gz ISBIXSNKJYADKB-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)[C@H]1C ZINC000252434518 334379741 /nfs/dbraw/zinc/37/97/41/334379741.db2.gz YZDZCUFAZBCMCC-JFGNBEQYSA-N 1 0 268.382 3.571 20 5 CHBDRO CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000554363864 334424713 /nfs/dbraw/zinc/42/47/13/334424713.db2.gz OFLSFNTXIDQSJS-KGLIPLIRSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2(C(C)C)CC2)cc1[N+](=O)[O-] ZINC000566669138 334659490 /nfs/dbraw/zinc/65/94/90/334659490.db2.gz RQYPGLKCTNKDTM-LBPRGKRZSA-N 1 0 262.353 3.742 20 5 CHBDRO CCC[C@H]([NH2+]CCc1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000269012206 334719479 /nfs/dbraw/zinc/71/94/79/334719479.db2.gz NJQHRZYTLSUUSW-KRWDZBQOSA-N 1 0 299.374 3.663 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc(C)n1 ZINC000577855763 335412150 /nfs/dbraw/zinc/41/21/50/335412150.db2.gz UYIVFTPEUAJVHI-CQSZACIVSA-N 1 0 299.374 3.766 20 5 CHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000381386867 336060945 /nfs/dbraw/zinc/06/09/45/336060945.db2.gz LVAUVDLMQIQQPN-XHDPSFHLSA-N 1 0 280.343 3.744 20 5 CHBDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000581767989 336144546 /nfs/dbraw/zinc/14/45/46/336144546.db2.gz FFVFJNDQILIAFR-LLVKDONJSA-N 1 0 250.342 3.509 20 5 CHBDRO Cc1ccccc1C[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000386399273 336172488 /nfs/dbraw/zinc/17/24/88/336172488.db2.gz VLYRKAXVUDKJAG-OAHLLOKOSA-N 1 0 298.386 3.932 20 5 CHBDRO COc1ccc(C[NH2+]CC(C)(C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000386424441 336173028 /nfs/dbraw/zinc/17/30/28/336173028.db2.gz BPRQWOWZASYJDV-UHFFFAOYSA-N 1 0 294.395 3.765 20 5 CHBDRO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355078910 533817407 /nfs/dbraw/zinc/81/74/07/533817407.db2.gz BVVKVBWRXAHYFW-OUAUKWLOSA-N 1 0 268.382 3.523 20 5 CHBDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)o1 ZINC000344594383 533828891 /nfs/dbraw/zinc/82/88/91/533828891.db2.gz BLJACOZSGWVRER-LBPRGKRZSA-N 1 0 288.347 3.607 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@@H](C)CC2)cc1[N+](=O)[O-] ZINC000352801685 533924097 /nfs/dbraw/zinc/92/40/97/533924097.db2.gz TZCAQTLXUJBASE-GFCCVEGCSA-N 1 0 262.353 3.525 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000507114825 533928409 /nfs/dbraw/zinc/92/84/09/533928409.db2.gz CGRLDUJVDKGXBG-CQSZACIVSA-N 1 0 262.353 3.524 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000340418833 519836250 /nfs/dbraw/zinc/83/62/50/519836250.db2.gz IPHZODHRVNZAEC-CQSZACIVSA-N 1 0 262.353 3.606 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1CCCCS1)c1cccc([N+](=O)[O-])c1 ZINC000156334587 522617025 /nfs/dbraw/zinc/61/70/25/522617025.db2.gz AKEPTQJTEBWTCR-GJZGRUSLSA-N 1 0 294.420 3.921 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000050015536 522657065 /nfs/dbraw/zinc/65/70/65/522657065.db2.gz IUJUWQUYCLHYFT-HNNXBMFYSA-N 1 0 270.332 3.836 20 5 CHBDRO CC[C@@H]([NH2+]CCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000063099173 522823359 /nfs/dbraw/zinc/82/33/59/522823359.db2.gz MTTKWURRTBPBCJ-LLVKDONJSA-N 1 0 276.258 3.588 20 5 CHBDRO CC[C@@H]([NH2+]CCCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000126801941 522824613 /nfs/dbraw/zinc/82/46/13/522824613.db2.gz JOZPJBGTBBTBAQ-GFCCVEGCSA-N 1 0 290.285 3.978 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000337303984 522911746 /nfs/dbraw/zinc/91/17/46/522911746.db2.gz RBUXHTYKFMRYNF-SUMWQHHRSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000040675917 524737531 /nfs/dbraw/zinc/73/75/31/524737531.db2.gz IXBDHUPSVACWAH-AWEZNQCLSA-N 1 0 284.359 3.531 20 5 CHBDRO Cc1cccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000050015602 524873909 /nfs/dbraw/zinc/87/39/09/524873909.db2.gz QKLFJZOWPNYOBI-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO CSC[C@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000292453508 525706570 /nfs/dbraw/zinc/70/65/70/525706570.db2.gz PQTBXNRCVVKRHP-STQMWFEESA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C2CCCCC2)cccc1[N+](=O)[O-] ZINC000152982960 525915890 /nfs/dbraw/zinc/91/58/90/525915890.db2.gz LJSSAWCUZUVNGH-LBPRGKRZSA-N 1 0 262.353 3.887 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000156754523 525925421 /nfs/dbraw/zinc/92/54/21/525925421.db2.gz LCHOYVUTLIICGA-XBFCOCLRSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)s1 ZINC000049161771 525931064 /nfs/dbraw/zinc/93/10/64/525931064.db2.gz LLQMXDDYLFIPBN-VIFPVBQESA-N 1 0 282.390 3.877 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)cs1 ZINC000111397929 527331421 /nfs/dbraw/zinc/33/14/21/527331421.db2.gz CNLPYIXZEVMALS-ZIAGYGMSSA-N 1 0 288.372 3.550 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccncc1 ZINC000347372596 529185928 /nfs/dbraw/zinc/18/59/28/529185928.db2.gz XLENBVNDLNUDBO-OAHLLOKOSA-N 1 0 285.347 3.539 20 5 CHBDRO CC[C@H]([NH2+]CCCCCF)c1cccc([N+](=O)[O-])c1 ZINC000341917098 535900705 /nfs/dbraw/zinc/90/07/05/535900705.db2.gz WPUYHQWSGJWIRE-AWEZNQCLSA-N 1 0 268.332 3.775 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000348325402 1125560948 /nfs/dbraw/zinc/56/09/48/1125560948.db2.gz LJIQMYJQJGLFOH-GUTXKFCHSA-N 1 0 280.343 3.916 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000300305553 1125576155 /nfs/dbraw/zinc/57/61/55/1125576155.db2.gz DPRWHOJWFAZFDI-DYEKYZERSA-N 1 0 262.353 3.682 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ncccc1C)c1cccc([N+](=O)[O-])c1 ZINC000296415601 1125586154 /nfs/dbraw/zinc/58/61/54/1125586154.db2.gz LCSGCMMRWJGXKC-MRXNPFEDSA-N 1 0 299.374 3.582 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[NH2+][C@@H](CC1CC1)c1ccccc1 ZINC000886112405 1125651144 /nfs/dbraw/zinc/65/11/44/1125651144.db2.gz XKLMWFPCCFETHY-INIZCTEOSA-N 1 0 297.358 3.621 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000886212652 1125661612 /nfs/dbraw/zinc/66/16/12/1125661612.db2.gz BVUWGKNGVZSWLG-CQSZACIVSA-N 1 0 289.379 3.582 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3cccnc32)cc1[N+](=O)[O-] ZINC000886550119 1125690749 /nfs/dbraw/zinc/69/07/49/1125690749.db2.gz SLUYATTVMKDVFR-IUODEOHRSA-N 1 0 297.358 3.636 20 5 CHBDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000483750004 1126800180 /nfs/dbraw/zinc/80/01/80/1126800180.db2.gz VLVAQAJOBINXLN-IVMMDQJWSA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@H](C[C@@](C)(O)CC)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000924798373 1126852541 /nfs/dbraw/zinc/85/25/41/1126852541.db2.gz NIGKRIXGJQJSPH-XPKDYRNWSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1cc(Cl)ccc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000128994569 1126908559 /nfs/dbraw/zinc/90/85/59/1126908559.db2.gz RUVFMGUMKHREJR-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000037177195 1126923703 /nfs/dbraw/zinc/92/37/03/1126923703.db2.gz AYIQGBCPOPVUEC-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO COc1cc(C[N@@H+]2CCCC[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000485554230 1126925290 /nfs/dbraw/zinc/92/52/90/1126925290.db2.gz UTYFCJBSMGSSDD-CQSZACIVSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccsc1)CCC2 ZINC000192669418 1126963497 /nfs/dbraw/zinc/96/34/97/1126963497.db2.gz ZDJUKDJJODYXJP-OAHLLOKOSA-N 1 0 288.372 3.824 20 5 CHBDRO C[C@H](OCC[N+](C)(C)C)c1ccc2ccccc2c1 ZINC001224772191 1126986188 /nfs/dbraw/zinc/98/61/88/1126986188.db2.gz WQUOPAONWRFVRX-AWEZNQCLSA-N 1 0 258.385 3.624 20 5 CHBDRO Cc1cncc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000274360538 1127114054 /nfs/dbraw/zinc/11/40/54/1127114054.db2.gz IFPPIXHECATJFA-QWHCGFSZSA-N 1 0 285.347 3.710 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1ccc([N+](=O)[O-])cc1F ZINC000588978447 1127209332 /nfs/dbraw/zinc/20/93/32/1127209332.db2.gz NVPPRNIWRMWREM-UHFFFAOYSA-N 1 0 268.332 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](C3CC3)C2)c(Cl)c1 ZINC000588977723 1127209032 /nfs/dbraw/zinc/20/90/32/1127209032.db2.gz GPAIBIWJGFTOHU-GFCCVEGCSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000589209280 1127216028 /nfs/dbraw/zinc/21/60/28/1127216028.db2.gz BQERHARHQDWWIM-OAHLLOKOSA-N 1 0 274.364 3.525 20 5 CHBDRO CC1(C2CC2)CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000589286237 1127216821 /nfs/dbraw/zinc/21/68/21/1127216821.db2.gz LVKRGVHJWACTNI-UHFFFAOYSA-N 1 0 292.354 3.746 20 5 CHBDRO CC(C)[C@H]1N(Cc2ccc([N+](=O)[O-])cc2F)CC1(C)C ZINC000590372246 1127256852 /nfs/dbraw/zinc/25/68/52/1127256852.db2.gz ZITFLEWEROGMNI-CQSZACIVSA-N 1 0 280.343 3.600 20 5 CHBDRO CC(C)CC[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000057627040 1127269238 /nfs/dbraw/zinc/26/92/38/1127269238.db2.gz GLSCTKVJUHOGIV-GFCCVEGCSA-N 1 0 250.342 3.634 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2CCCSC2)cccc1[N+](=O)[O-] ZINC000287124128 1127290640 /nfs/dbraw/zinc/29/06/40/1127290640.db2.gz RIJUVAOAYZAPCZ-OLZOCXBDSA-N 1 0 294.420 3.697 20 5 CHBDRO Cc1ccc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC001168400616 1127298636 /nfs/dbraw/zinc/29/86/36/1127298636.db2.gz BZSOBHUPGSWDDL-IMJJTQAJSA-N 1 0 288.391 3.914 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2c3ccccc3O[C@@H]2C)cc1[N+](=O)[O-] ZINC000288574737 1127347668 /nfs/dbraw/zinc/34/76/68/1127347668.db2.gz NIIPCCVUXFFHEH-PXAZEXFGSA-N 1 0 298.342 3.515 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)CC(F)F ZINC000592373099 1127343731 /nfs/dbraw/zinc/34/37/31/1127343731.db2.gz UBWAUBABKISEDW-BCMYLCSRSA-N 1 0 298.333 3.879 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)F ZINC000592392352 1127344426 /nfs/dbraw/zinc/34/44/26/1127344426.db2.gz MQDJFYDQYSLIGL-UWVGGRQHSA-N 1 0 272.295 3.537 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)CC(F)F ZINC000592392402 1127344483 /nfs/dbraw/zinc/34/44/83/1127344483.db2.gz QWHREDLBXSYXDY-GXSJLCMTSA-N 1 0 286.322 3.845 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@@H](F)C2)cccc1[N+](=O)[O-] ZINC000592390729 1127346850 /nfs/dbraw/zinc/34/68/50/1127346850.db2.gz PERSCYBKBXCBTL-XQQFMLRXSA-N 1 0 280.343 3.835 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000593082311 1127372803 /nfs/dbraw/zinc/37/28/03/1127372803.db2.gz VAAHSQVQSPYOHK-LLVKDONJSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000593082884 1127372877 /nfs/dbraw/zinc/37/28/77/1127372877.db2.gz YJFPWOQJNKUZCR-LLVKDONJSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000358195182 1127407841 /nfs/dbraw/zinc/40/78/41/1127407841.db2.gz CIIMSMGKBAKUKR-AWEZNQCLSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761053980 1127413544 /nfs/dbraw/zinc/41/35/44/1127413544.db2.gz IFKIOJYXSLACPQ-ONGXEEELSA-N 1 0 288.269 3.540 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594503246 1127419116 /nfs/dbraw/zinc/41/91/16/1127419116.db2.gz SVDNQKJPLHIBON-LRDDRELGSA-N 1 0 297.358 3.636 20 5 CHBDRO Cc1cc2c(c(C)c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC000594502520 1127419190 /nfs/dbraw/zinc/41/91/90/1127419190.db2.gz JUOJDPQHIGIIDK-QGZVFWFLSA-N 1 0 296.370 3.989 20 5 CHBDRO CCc1cccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594509623 1127420576 /nfs/dbraw/zinc/42/05/76/1127420576.db2.gz XMQOOHMYMCWVEK-QGZVFWFLSA-N 1 0 296.370 3.934 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCCO1 ZINC000594518681 1127421306 /nfs/dbraw/zinc/42/13/06/1127421306.db2.gz IXHNHLRPVLAYJV-VBNZEHGJSA-N 1 0 292.379 3.593 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC(C)(C)F ZINC000594973171 1127438004 /nfs/dbraw/zinc/43/80/04/1127438004.db2.gz OUCNLJZLVRMJPG-XFXZXTDPSA-N 1 0 280.343 3.726 20 5 CHBDRO CC[C@@](C)([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000594979314 1127438033 /nfs/dbraw/zinc/43/80/33/1127438033.db2.gz JDEGPIBMTOHDQX-IQIBNGDESA-N 1 0 274.364 3.776 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@]34C[C@@H]3CCC4)o2)cc1 ZINC000594949509 1127439219 /nfs/dbraw/zinc/43/92/19/1127439219.db2.gz DGACFLHLAJYYHH-GUYCJALGSA-N 1 0 298.342 3.887 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@]34C[C@H]3CCC4)o2)c1 ZINC000594949588 1127439391 /nfs/dbraw/zinc/43/93/91/1127439391.db2.gz FCNIHTFIKQXTGB-CXAGYDPISA-N 1 0 298.342 3.887 20 5 CHBDRO CC(C)[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000594994979 1127444633 /nfs/dbraw/zinc/44/46/33/1127444633.db2.gz YLYXBMPMQCZTEJ-YERXGYGTSA-N 1 0 274.364 3.632 20 5 CHBDRO CSCC1(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595071753 1127448672 /nfs/dbraw/zinc/44/86/72/1127448672.db2.gz DKDCBFNPERKZGI-GFCCVEGCSA-N 1 0 294.420 3.779 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000595050183 1127451154 /nfs/dbraw/zinc/45/11/54/1127451154.db2.gz QSDOMJJEYNUKBQ-ZIAGYGMSSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000595079224 1127453432 /nfs/dbraw/zinc/45/34/32/1127453432.db2.gz ISFOJQMTXBDOAW-MFKMUULPSA-N 1 0 284.306 3.599 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000595081162 1127453603 /nfs/dbraw/zinc/45/36/03/1127453603.db2.gz QHKPCSNUKMEWDU-WFASDCNBSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595081266 1127453680 /nfs/dbraw/zinc/45/36/80/1127453680.db2.gz RFOMZYOUEFMZGK-GWCFXTLKSA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)cc1[N+](=O)[O-] ZINC000595095004 1127455281 /nfs/dbraw/zinc/45/52/81/1127455281.db2.gz SNBSGQRRBXBVAH-GXFFZTMASA-N 1 0 298.333 3.845 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CC1=CCSC1 ZINC000595889690 1127479968 /nfs/dbraw/zinc/47/99/68/1127479968.db2.gz VKNHAMRTMAKPEY-LBPRGKRZSA-N 1 0 292.404 3.569 20 5 CHBDRO CCCCC[C@@H]1CCCC[N@@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595870734 1127480032 /nfs/dbraw/zinc/48/00/32/1127480032.db2.gz KCZYFOYQZUZDEX-CYBMUJFWSA-N 1 0 295.383 3.826 20 5 CHBDRO Cc1c(C[NH2+]C2(CC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000595830557 1127479025 /nfs/dbraw/zinc/47/90/25/1127479025.db2.gz HTPOIGVERHZUPV-UHFFFAOYSA-N 1 0 262.353 3.572 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H]4C[C@H]4C3)o2)c1 ZINC000597222050 1127536731 /nfs/dbraw/zinc/53/67/31/1127536731.db2.gz BNHPTGMBXKVFAP-JSGCOSHPSA-N 1 0 298.342 3.697 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCCCF)o2)c1 ZINC000361067611 1127535332 /nfs/dbraw/zinc/53/53/32/1127535332.db2.gz SJSFOIVAXUDVRM-UHFFFAOYSA-N 1 0 292.310 3.694 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@H+]([C@H]1C[C@H]1c1ccccc1)CC2 ZINC000361314805 1127556331 /nfs/dbraw/zinc/55/63/31/1127556331.db2.gz SLCOROYBYXIPIY-ROUUACIJSA-N 1 0 294.354 3.509 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000294363871 1127568013 /nfs/dbraw/zinc/56/80/13/1127568013.db2.gz AVFYTAVXXBXPLK-QVHKTLOISA-N 1 0 292.379 3.510 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000294363889 1127568566 /nfs/dbraw/zinc/56/85/66/1127568566.db2.gz AVFYTAVXXBXPLK-XFMPKHEZSA-N 1 0 292.379 3.510 20 5 CHBDRO CC[C@H](C)C[C@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602559564 1127592803 /nfs/dbraw/zinc/59/28/03/1127592803.db2.gz FIUBBRQNSHKXJP-QWRGUYRKSA-N 1 0 291.351 3.650 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@H]1CC1(F)F ZINC000598680475 1127631694 /nfs/dbraw/zinc/63/16/94/1127631694.db2.gz YFUGBNZHTFQCGQ-MNOVXSKESA-N 1 0 284.306 3.599 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)[C@@H]1C[C@H]1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000598954696 1127647382 /nfs/dbraw/zinc/64/73/82/1127647382.db2.gz FCKFHYGUVLMAAL-XYPYXGAPSA-N 1 0 274.364 3.680 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC12CCCC2 ZINC000593646403 1127647611 /nfs/dbraw/zinc/64/76/11/1127647611.db2.gz WGZRJSAFSJMHFK-FNORWQNLSA-N 1 0 272.348 3.627 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC2CC=CC2)cccc1[N+](=O)[O-] ZINC000599065820 1127654352 /nfs/dbraw/zinc/65/43/52/1127654352.db2.gz RIAKRSIEFWRRLU-GFCCVEGCSA-N 1 0 260.337 3.520 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCCC12CC2)c1ccc([N+](=O)[O-])cc1 ZINC000599089805 1127656878 /nfs/dbraw/zinc/65/68/78/1127656878.db2.gz ASZRUPLAYPYRRH-OCCSQVGLSA-N 1 0 274.364 3.826 20 5 CHBDRO CCc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000593688276 1127659352 /nfs/dbraw/zinc/65/93/52/1127659352.db2.gz OHMSHJJTORLPTQ-UHFFFAOYSA-N 1 0 288.322 3.586 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCCC(C)(F)F)cccc1[N+](=O)[O-] ZINC000297224882 1127691908 /nfs/dbraw/zinc/69/19/08/1127691908.db2.gz HLIFLPIAFDPNNB-LLVKDONJSA-N 1 0 286.322 3.989 20 5 CHBDRO CC(F)(F)CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000297346185 1127693722 /nfs/dbraw/zinc/69/37/22/1127693722.db2.gz OVEBXRQYSGVNPX-CYBMUJFWSA-N 1 0 298.333 3.952 20 5 CHBDRO Cc1ccsc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000061798799 1127718444 /nfs/dbraw/zinc/71/84/44/1127718444.db2.gz STVCORAOSDZTDF-UHFFFAOYSA-N 1 0 276.361 3.597 20 5 CHBDRO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1CCC1 ZINC000230313508 1127750655 /nfs/dbraw/zinc/75/06/55/1127750655.db2.gz XIKAOOKDOUBWNA-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000076067355 1127931791 /nfs/dbraw/zinc/93/17/91/1127931791.db2.gz BUOSZHWXDDITOR-CABCVRRESA-N 1 0 294.420 3.701 20 5 CHBDRO C[C@@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2)CCCc2ccccc21 ZINC000539798213 1127940235 /nfs/dbraw/zinc/94/02/35/1127940235.db2.gz CAMWHXHLAPQXPX-GOSISDBHSA-N 1 0 296.370 3.936 20 5 CHBDRO Cc1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000539827068 1127945250 /nfs/dbraw/zinc/94/52/50/1127945250.db2.gz WDLUVIJUQPEHSO-GASCZTMLSA-N 1 0 274.364 3.525 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000462733805 1127952741 /nfs/dbraw/zinc/95/27/41/1127952741.db2.gz KNHQZUXBHDVKDC-HRCADAONSA-N 1 0 288.391 3.962 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000540162608 1127966883 /nfs/dbraw/zinc/96/68/83/1127966883.db2.gz LFDPBBHKLBANKW-PWSUYJOCSA-N 1 0 284.306 3.823 20 5 CHBDRO CC(C)(C)[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000544188333 1127962977 /nfs/dbraw/zinc/96/29/77/1127962977.db2.gz YEIGUEFPFNLQAO-CQSZACIVSA-N 1 0 276.380 3.505 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)CC(C)C ZINC000540151624 1127964265 /nfs/dbraw/zinc/96/42/65/1127964265.db2.gz SPASVZFZKOFIMD-STQMWFEESA-N 1 0 264.369 3.988 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2(Cc3ccccc3)CCC2)c1 ZINC000540612489 1127986930 /nfs/dbraw/zinc/98/69/30/1127986930.db2.gz YMKVUXJJVHYXDR-UHFFFAOYSA-N 1 0 296.370 3.850 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468001649 1127987135 /nfs/dbraw/zinc/98/71/35/1127987135.db2.gz CWIVTSXOCGYFET-OCCSQVGLSA-N 1 0 276.380 3.552 20 5 CHBDRO CCCC[C@@H](CC)C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000545517333 1128018899 /nfs/dbraw/zinc/01/88/99/1128018899.db2.gz LFGBOJYMVIYUCD-CYBMUJFWSA-N 1 0 291.395 3.564 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCCCS1 ZINC000541568351 1128028468 /nfs/dbraw/zinc/02/84/68/1128028468.db2.gz NDMGTCGTOASTIL-JSGCOSHPSA-N 1 0 294.420 3.840 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470173822 1128064931 /nfs/dbraw/zinc/06/49/31/1128064931.db2.gz GCONPAXSKGHBMN-NRMKIYEFSA-N 1 0 274.364 3.873 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000470184730 1128065426 /nfs/dbraw/zinc/06/54/26/1128065426.db2.gz WNZDCHDDSDZOLQ-WOVASVFFSA-N 1 0 286.375 3.586 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000470179226 1128065513 /nfs/dbraw/zinc/06/55/13/1128065513.db2.gz URHSLBGGJUBKFZ-RCBBPTIPSA-N 1 0 286.375 3.730 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCCC2(CC2)C1 ZINC000470214494 1128065927 /nfs/dbraw/zinc/06/59/27/1128065927.db2.gz PKBCBNKGJYSXND-UVTDQMKNSA-N 1 0 286.375 3.874 20 5 CHBDRO Cc1cccc2c1[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CC2 ZINC000925310528 1128127889 /nfs/dbraw/zinc/12/78/89/1128127889.db2.gz MXPZZOCJGVILAX-HNNXBMFYSA-N 1 0 282.343 3.680 20 5 CHBDRO CC(C)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761514358 1128132813 /nfs/dbraw/zinc/13/28/13/1128132813.db2.gz IACHBXXQHMSMDC-GFCCVEGCSA-N 1 0 282.771 3.726 20 5 CHBDRO CCCCCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761514400 1128132846 /nfs/dbraw/zinc/13/28/46/1128132846.db2.gz BILSMOCVNPIHSY-UHFFFAOYSA-N 1 0 270.760 3.918 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761521064 1128133148 /nfs/dbraw/zinc/13/31/48/1128133148.db2.gz IUEUJEYMVVOZEM-GWCFXTLKSA-N 1 0 282.771 3.917 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2(C3CC3)CCC2)cc1Cl ZINC000761526389 1128133186 /nfs/dbraw/zinc/13/31/86/1128133186.db2.gz AVNUTJWCDCRSJC-UHFFFAOYSA-N 1 0 294.782 3.918 20 5 CHBDRO CC[C@@H](C[C@@](C)(O)CC)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000926834575 1128196834 /nfs/dbraw/zinc/19/68/34/1128196834.db2.gz HBPLJNYLLCKQLZ-WWGRRREGSA-N 1 0 294.395 3.575 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609195428 1128170774 /nfs/dbraw/zinc/17/07/74/1128170774.db2.gz ORDLVCDIBNYRGF-CQSZACIVSA-N 1 0 280.343 3.744 20 5 CHBDRO CC[C@H](C)[C@H](C)[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000609204312 1128173671 /nfs/dbraw/zinc/17/36/71/1128173671.db2.gz FTASCVBBXDRLPF-STQMWFEESA-N 1 0 276.380 3.994 20 5 CHBDRO C[C@H]([NH2+]C[C@]12C[C@H]1CCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000927122164 1128219781 /nfs/dbraw/zinc/21/97/81/1128219781.db2.gz ODXUAKKROZCTNH-RWSFTLGLSA-N 1 0 278.327 3.575 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000495425362 1128282244 /nfs/dbraw/zinc/28/22/44/1128282244.db2.gz AFIPJQWJFVEKNS-LLVKDONJSA-N 1 0 296.798 3.959 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000495434747 1128282579 /nfs/dbraw/zinc/28/25/79/1128282579.db2.gz TWIDVHSEBXMMIN-CYBMUJFWSA-N 1 0 282.771 3.569 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)nc1 ZINC000930208263 1128307388 /nfs/dbraw/zinc/30/73/88/1128307388.db2.gz LJLNXYHFSLZNSD-QWRGUYRKSA-N 1 0 289.310 3.541 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000037253727 1128427689 /nfs/dbraw/zinc/42/76/89/1128427689.db2.gz VWWSOQQKFIMKBV-DYEKYZERSA-N 1 0 262.353 3.824 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]C2(C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000565399562 1128525502 /nfs/dbraw/zinc/52/55/02/1128525502.db2.gz CZWZOONEMYIDIR-OAHLLOKOSA-N 1 0 286.375 3.849 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC(C)(C)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000568810341 1128592294 /nfs/dbraw/zinc/59/22/94/1128592294.db2.gz NNIVYCHDZDTKFN-OAHLLOKOSA-N 1 0 274.364 3.524 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H](F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000569724138 1128608416 /nfs/dbraw/zinc/60/84/16/1128608416.db2.gz UMLXXXCMMLTEQA-WCFLWFBJSA-N 1 0 266.316 3.526 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)nc1C ZINC000556888223 1128636425 /nfs/dbraw/zinc/63/64/25/1128636425.db2.gz GMUXNWGOIRRWGN-AWEZNQCLSA-N 1 0 299.374 3.766 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000556958668 1128651784 /nfs/dbraw/zinc/65/17/84/1128651784.db2.gz JZJFWKVQMFEKTO-UYWPIULCSA-N 1 0 286.375 3.730 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000601101817 1128698172 /nfs/dbraw/zinc/69/81/72/1128698172.db2.gz YHHQELDLGLZJEK-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2ncccc21)c1ccccc1[N+](=O)[O-] ZINC000601272259 1128707046 /nfs/dbraw/zinc/70/70/46/1128707046.db2.gz AEVAKIOBBSLJOO-WBMJQRKESA-N 1 0 297.358 3.718 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC23CCCC3)cc1Cl ZINC000763456819 1128720520 /nfs/dbraw/zinc/72/05/20/1128720520.db2.gz HKUHXQNJGOQNBY-CYBMUJFWSA-N 1 0 280.755 3.671 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000072555221 1117762147 /nfs/dbraw/zinc/76/21/47/1117762147.db2.gz RVBHUEBHNYAHFJ-ZDUSSCGKSA-N 1 0 270.332 3.788 20 5 CHBDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610001967 1128734110 /nfs/dbraw/zinc/73/41/10/1128734110.db2.gz PVAFRERVEVUQMX-CJNGLKHVSA-N 1 0 276.380 3.995 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000072630849 1117781834 /nfs/dbraw/zinc/78/18/34/1117781834.db2.gz ABDXCMVHHVKULL-NEPJUHHUSA-N 1 0 250.342 3.634 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000072727645 1117811918 /nfs/dbraw/zinc/81/19/18/1117811918.db2.gz BIRVHIKKYKSFAK-CYBMUJFWSA-N 1 0 299.374 3.964 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215375 1117882958 /nfs/dbraw/zinc/88/29/58/1117882958.db2.gz JIPDYLPUUDZLAQ-OLZOCXBDSA-N 1 0 262.353 3.605 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCCC[C@@H]1C ZINC000430240068 1117908656 /nfs/dbraw/zinc/90/86/56/1117908656.db2.gz CBMBWCJDINZAEM-WFASDCNBSA-N 1 0 292.379 3.614 20 5 CHBDRO CCCCC[C@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000049097974 1128743354 /nfs/dbraw/zinc/74/33/54/1128743354.db2.gz PKIVOVCFFFPKBS-LBPRGKRZSA-N 1 0 280.368 3.662 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCc2ccsc2)c1 ZINC000049153333 1128745840 /nfs/dbraw/zinc/74/58/40/1128745840.db2.gz HNRUWTKFLUZHOW-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)C(C)C ZINC000083173906 1117961593 /nfs/dbraw/zinc/96/15/93/1117961593.db2.gz UMRCRKVLMHLUGL-NSHDSACASA-N 1 0 291.351 3.602 20 5 CHBDRO CCC(CC)C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000134913431 1118019276 /nfs/dbraw/zinc/01/92/76/1118019276.db2.gz VXLVJEAWXCQSKJ-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)Cc2ccco2)cccc1[N+](=O)[O-] ZINC000764773448 1118112334 /nfs/dbraw/zinc/11/23/34/1118112334.db2.gz IRGBOCFARJPDAQ-DGCLKSJQSA-N 1 0 288.347 3.778 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000253180418 1118317547 /nfs/dbraw/zinc/31/75/47/1118317547.db2.gz DOWCHGPDRXQZFI-OBJOEFQTSA-N 1 0 262.353 3.824 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2coc3ccccc23)c1 ZINC000083601913 1118456400 /nfs/dbraw/zinc/45/64/00/1118456400.db2.gz RHMVISWWOBJHLJ-UHFFFAOYSA-N 1 0 282.299 3.631 20 5 CHBDRO CCC(C)(C)[C@@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000579676157 1118467128 /nfs/dbraw/zinc/46/71/28/1118467128.db2.gz MZLOZHGALMBTCA-GFCCVEGCSA-N 1 0 264.369 3.552 20 5 CHBDRO C[C@H]1CC([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@H](C)C1 ZINC000084975955 1118502086 /nfs/dbraw/zinc/50/20/86/1118502086.db2.gz KZPULQGOPXQIOO-CHWSQXEVSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCc1ccccc1 ZINC000050508411 1118505033 /nfs/dbraw/zinc/50/50/33/1118505033.db2.gz UFZOVAVFXUTPDZ-AWEZNQCLSA-N 1 0 284.359 3.830 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001167457717 1118574521 /nfs/dbraw/zinc/57/45/21/1118574521.db2.gz JFHGEJBNFGSBLF-CQSZACIVSA-N 1 0 280.343 3.889 20 5 CHBDRO Cc1c(C[N@@H+](C)C(C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000050988757 1118595740 /nfs/dbraw/zinc/59/57/40/1118595740.db2.gz DDJMMVLAUCLFKO-UHFFFAOYSA-N 1 0 274.364 3.524 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC000090856347 1118645859 /nfs/dbraw/zinc/64/58/59/1118645859.db2.gz FVGLRIRSFYSJSF-NEPJUHHUSA-N 1 0 292.379 3.833 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000286950735 1118678886 /nfs/dbraw/zinc/67/88/86/1118678886.db2.gz HJOMUKOSYOLTTE-SWLSCSKDSA-N 1 0 294.420 3.779 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCSC2)cc1[N+](=O)[O-] ZINC000287138565 1118703485 /nfs/dbraw/zinc/70/34/85/1118703485.db2.gz SAMOIUMQRFPOCL-STQMWFEESA-N 1 0 294.420 3.697 20 5 CHBDRO CCC1CC[NH+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000510666310 1118784939 /nfs/dbraw/zinc/78/49/39/1118784939.db2.gz MPEKGIWGOFACIW-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCC[C@@H]2CCCF)cc1 ZINC000510696560 1118788113 /nfs/dbraw/zinc/78/81/13/1118788113.db2.gz RESFNKGNUXZNKJ-HIFRSBDPSA-N 1 0 280.343 3.603 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)C1CC1 ZINC000610805130 1118894374 /nfs/dbraw/zinc/89/43/74/1118894374.db2.gz AORNDYQWXYASFV-RYUDHWBXSA-N 1 0 262.353 3.600 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000610831186 1118897722 /nfs/dbraw/zinc/89/77/22/1118897722.db2.gz JLBPUGGAOWQIGW-CXAGYDPISA-N 1 0 299.374 3.834 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H]2CC=CCC2)C2CC2)cc1 ZINC000215663774 1118915775 /nfs/dbraw/zinc/91/57/75/1118915775.db2.gz DPMUOXYVSSEMEK-CQSZACIVSA-N 1 0 286.375 3.916 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](C[C@H]2CC=CCC2)C2CC2)c1 ZINC000215663579 1118916025 /nfs/dbraw/zinc/91/60/25/1118916025.db2.gz ZLHKXOMTLAVLDI-AWEZNQCLSA-N 1 0 286.375 3.916 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000342330151 1118979173 /nfs/dbraw/zinc/97/91/73/1118979173.db2.gz KRELLXSWAWGSML-UHFFFAOYSA-N 1 0 295.342 3.674 20 5 CHBDRO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000539214286 1118983446 /nfs/dbraw/zinc/98/34/46/1118983446.db2.gz GVETVSRWTAAWNS-OLZOCXBDSA-N 1 0 299.374 3.964 20 5 CHBDRO Cc1ccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511059948 1118995444 /nfs/dbraw/zinc/99/54/44/1118995444.db2.gz PXYWKEUYOHHWOP-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1(c2ccccc2)CC1 ZINC000068979821 1128815116 /nfs/dbraw/zinc/81/51/16/1128815116.db2.gz DIQOWCUIZSOWJF-SOFGYWHQSA-N 1 0 294.354 3.887 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000051686148 1119084633 /nfs/dbraw/zinc/08/46/33/1119084633.db2.gz LXZRLEBZHDDOHK-LLVKDONJSA-N 1 0 250.342 3.524 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC(C)(C)C)cccc1[N+](=O)[O-] ZINC000178677905 1119225546 /nfs/dbraw/zinc/22/55/46/1119225546.db2.gz UPFKLMZHUHOIMP-NSHDSACASA-N 1 0 250.342 3.600 20 5 CHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000219701654 1119511310 /nfs/dbraw/zinc/51/13/10/1119511310.db2.gz GCPYBZDXSAHDSB-TZMCWYRMSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000340525993 1119514897 /nfs/dbraw/zinc/51/48/97/1119514897.db2.gz XTXYKZYFLFXBQM-RDBSUJKOSA-N 1 0 266.316 3.526 20 5 CHBDRO CC1([NH2+]Cc2cccc([N+](=O)[O-])c2)CCC(F)(F)CC1 ZINC000612192044 1119747926 /nfs/dbraw/zinc/74/79/26/1119747926.db2.gz NVLWNCMVAUPDEI-UHFFFAOYSA-N 1 0 284.306 3.652 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1F ZINC000066562650 1119913201 /nfs/dbraw/zinc/91/32/01/1119913201.db2.gz UTHFEJHAPZKIMO-LBPRGKRZSA-N 1 0 288.322 3.927 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H]1C ZINC000414150598 1119918983 /nfs/dbraw/zinc/91/89/83/1119918983.db2.gz VTHRRZFPZWPYIX-BVIHXZOGSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H]([NH2+]CC(C)(C)c1cccnc1)c1ccc([N+](=O)[O-])cc1 ZINC000414320902 1119983047 /nfs/dbraw/zinc/98/30/47/1119983047.db2.gz BPMQIRMCJVWUAX-CYBMUJFWSA-N 1 0 299.374 3.618 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCCC[C@H]2C)c1 ZINC000094659346 1120053589 /nfs/dbraw/zinc/05/35/89/1120053589.db2.gz JOBBTRYWDNDKMB-CQSZACIVSA-N 1 0 291.395 3.580 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)CC1CCCC1 ZINC000542698761 1120122195 /nfs/dbraw/zinc/12/21/95/1120122195.db2.gz AHKLHQBHNAFKML-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)c(F)c1 ZINC000313853440 1120153987 /nfs/dbraw/zinc/15/39/87/1120153987.db2.gz SXSKYOGUPODDLC-LRDDRELGSA-N 1 0 292.354 3.889 20 5 CHBDRO CC[C@H](C[C@](C)(O)CC)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000926893195 1120203626 /nfs/dbraw/zinc/20/36/26/1120203626.db2.gz QTZPEUOMVSHDPM-XNRPHZJLSA-N 1 0 294.395 3.575 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCC(F)(F)C1 ZINC000312058094 1120280269 /nfs/dbraw/zinc/28/02/69/1120280269.db2.gz BEZCPTBDFVKPRY-SNVBAGLBSA-N 1 0 290.697 3.526 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC2CCC1CC2)c1cccc([N+](=O)[O-])c1 ZINC000312781655 1120375452 /nfs/dbraw/zinc/37/54/52/1120375452.db2.gz HTGWHZFUCRAMKF-OCLKLICZSA-N 1 0 274.364 3.824 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c(F)c1 ZINC000313853443 1120413520 /nfs/dbraw/zinc/41/35/20/1120413520.db2.gz SXSKYOGUPODDLC-MLGOLLRUSA-N 1 0 292.354 3.889 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000131006317 1120438536 /nfs/dbraw/zinc/43/85/36/1120438536.db2.gz SMMWAXWGGSPCKM-GHMZBOCLSA-N 1 0 250.342 3.680 20 5 CHBDRO CCCC[C@@H](CC)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000069378304 1120501920 /nfs/dbraw/zinc/50/19/20/1120501920.db2.gz SUKDJEGLQQPNOZ-CQSZACIVSA-N 1 0 264.369 3.696 20 5 CHBDRO Cc1csc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000379275663 1120534455 /nfs/dbraw/zinc/53/44/55/1120534455.db2.gz OJOTWFFANVOVDY-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO Cc1csc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000379277553 1120535161 /nfs/dbraw/zinc/53/51/61/1120535161.db2.gz PHDBXLBTVYVDGI-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@@H]1C[C@@H](C)C[NH+](CCSc2cccc([N+](=O)[O-])c2)C1 ZINC001307342109 1120541721 /nfs/dbraw/zinc/54/17/21/1120541721.db2.gz RRIMPGWSFHUFGF-CHWSQXEVSA-N 1 0 294.420 3.665 20 5 CHBDRO Cc1ccc(C[N@@H+](C)C(C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000092704011 1120546062 /nfs/dbraw/zinc/54/60/62/1120546062.db2.gz SLWMPLARNLYMDM-UHFFFAOYSA-N 1 0 274.364 3.524 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCCC(F)(F)F ZINC001161824734 1120548042 /nfs/dbraw/zinc/54/80/42/1120548042.db2.gz XAOGUUGKPQSJNI-UHFFFAOYSA-N 1 0 275.338 3.647 20 5 CHBDRO Cc1ccc(F)cc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000922538874 1120549155 /nfs/dbraw/zinc/54/91/55/1120549155.db2.gz YJSNDHLCKFLIKU-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@@H]1C ZINC000020055201 1120580857 /nfs/dbraw/zinc/58/08/57/1120580857.db2.gz SFRMHZKYFACQCC-JMSVASOKSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1cscc1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000566747781 1120600008 /nfs/dbraw/zinc/60/00/08/1120600008.db2.gz KKDMHPQHEQPXOC-AWEZNQCLSA-N 1 0 288.372 3.742 20 5 CHBDRO Cc1c(C[NH2+]C[C@@H](C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000125441352 1120614220 /nfs/dbraw/zinc/61/42/20/1120614220.db2.gz JSQVCEVKAZMLPK-LLVKDONJSA-N 1 0 264.369 3.675 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000282179904 1120629520 /nfs/dbraw/zinc/62/95/20/1120629520.db2.gz ZILITEHFZCJWHJ-NSHDSACASA-N 1 0 284.306 3.510 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000302754090 1120657035 /nfs/dbraw/zinc/65/70/35/1120657035.db2.gz ZNOODGQOSSLVAM-XQQFMLRXSA-N 1 0 262.353 3.634 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000132469274 1120691184 /nfs/dbraw/zinc/69/11/84/1120691184.db2.gz HNCBMWXYZWEPOZ-GXTWGEPZSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000313457384 1120730408 /nfs/dbraw/zinc/73/04/08/1120730408.db2.gz CNYTULXQNDTNGV-CMPLNLGQSA-N 1 0 284.306 3.742 20 5 CHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000511954967 1120864974 /nfs/dbraw/zinc/86/49/74/1120864974.db2.gz DBDKHASBCWYXGF-GFCCVEGCSA-N 1 0 262.353 3.560 20 5 CHBDRO C[NH+](C)[C@@H]1CCC[C@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432309545 1120945939 /nfs/dbraw/zinc/94/59/39/1120945939.db2.gz AVIKHZSSTKWEBS-WDEREUQCSA-N 1 0 297.786 3.533 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CSC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000354019481 1121017718 /nfs/dbraw/zinc/01/77/18/1121017718.db2.gz YVWJWEDDEIXNOT-BYCMXARLSA-N 1 0 294.420 3.777 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCC2CCC2)cc1[N+](=O)[O-] ZINC000163498138 1121025027 /nfs/dbraw/zinc/02/50/27/1121025027.db2.gz RHIHTDKPXSOOMA-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO Cc1c(C)c(C)c(CO[C@@H](C)C[N+](C)(C)C)c(C)c1C ZINC001223322365 1121030406 /nfs/dbraw/zinc/03/04/06/1121030406.db2.gz PVJWEGHXVKYIRM-LBPRGKRZSA-N 1 0 278.460 3.840 20 5 CHBDRO CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000509155324 1121069366 /nfs/dbraw/zinc/06/93/66/1121069366.db2.gz RYWJLQUAEWSSHM-NSHDSACASA-N 1 0 268.332 3.600 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC3(CC3)CC2)cc1F ZINC000702594002 1121206024 /nfs/dbraw/zinc/20/60/24/1121206024.db2.gz GZUKNBHUWCGRJB-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@@]12C[C@@H]1CCCC2 ZINC001175292584 1121258877 /nfs/dbraw/zinc/25/88/77/1121258877.db2.gz LAJYFTFRHLHPPC-DETPVDSQSA-N 1 0 292.354 3.792 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1CC(C)C ZINC000500483497 1121285288 /nfs/dbraw/zinc/28/52/88/1121285288.db2.gz YIZWCPRBOGZSCU-CQSZACIVSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000174995512 1121313101 /nfs/dbraw/zinc/31/31/01/1121313101.db2.gz AZDLWDYEDBLVAH-OAHLLOKOSA-N 1 0 286.306 3.511 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000042859096 1121318036 /nfs/dbraw/zinc/31/80/36/1121318036.db2.gz QUGUZSQRSDJNOX-IUODEOHRSA-N 1 0 276.380 3.819 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000512653193 1121509628 /nfs/dbraw/zinc/50/96/28/1121509628.db2.gz VGMYTIWHJKWOGZ-DGCLKSJQSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000433035689 1121532812 /nfs/dbraw/zinc/53/28/12/1121532812.db2.gz NRGAOLBONJSEKA-BXUZGUMPSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CC12CCCC2 ZINC000429434237 1121580335 /nfs/dbraw/zinc/58/03/35/1121580335.db2.gz HHKSZFVDRIMRIB-CZUORRHYSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@@H]1C[C@H]1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433161403 1121599465 /nfs/dbraw/zinc/59/94/65/1121599465.db2.gz RGMOXPFYIXQSRN-JRPNMDOOSA-N 1 0 274.364 3.563 20 5 CHBDRO CN(Cc1csc([N+](=O)[O-])c1)Cc1cccc(Cl)c1 ZINC000047264911 1121617844 /nfs/dbraw/zinc/61/78/44/1121617844.db2.gz YTKGMXFKYQDLTC-UHFFFAOYSA-N 1 0 296.779 3.942 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000611271343 1121633327 /nfs/dbraw/zinc/63/33/27/1121633327.db2.gz SNRPIEXWYVGVTP-OMVNSRBRSA-N 1 0 298.342 3.691 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)C1CCC1 ZINC000611337295 1121637782 /nfs/dbraw/zinc/63/77/82/1121637782.db2.gz YDDPRWNAVNLRMN-RYUDHWBXSA-N 1 0 262.353 3.742 20 5 CHBDRO CC(C)C([NH2+]Cc1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000611434221 1121647417 /nfs/dbraw/zinc/64/74/17/1121647417.db2.gz XUOAGOOQKLCROT-UHFFFAOYSA-N 1 0 268.332 3.504 20 5 CHBDRO CC1=CCC[C@H](C)[C@@H]1C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC001178393739 1121781836 /nfs/dbraw/zinc/78/18/36/1121781836.db2.gz WFKKXZZELJNDSF-WMLDXEAASA-N 1 0 288.391 3.719 20 5 CHBDRO Cc1cccnc1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000130983311 1129009946 /nfs/dbraw/zinc/00/99/46/1129009946.db2.gz PBQJNPOWWSEFLT-UHFFFAOYSA-N 1 0 277.711 3.564 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C1CC1 ZINC001179173013 1121858393 /nfs/dbraw/zinc/85/83/93/1121858393.db2.gz FTBKAHMNGANUMF-OAHLLOKOSA-N 1 0 276.380 3.996 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2sccc2Cl)cc1[N+](=O)[O-] ZINC001179387294 1121875617 /nfs/dbraw/zinc/87/56/17/1121875617.db2.gz ZGTXJFHIBOFBTE-UHFFFAOYSA-N 1 0 296.779 3.908 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC001179768171 1121906412 /nfs/dbraw/zinc/90/64/12/1121906412.db2.gz LPIZNFUFHRIFBC-LXZTZZPZSA-N 1 0 286.375 3.776 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1cccn1C ZINC000183238358 1129035325 /nfs/dbraw/zinc/03/53/25/1129035325.db2.gz LTOZBYPRNYSQMG-KRWDZBQOSA-N 1 0 299.374 3.579 20 5 CHBDRO CC(C)[C@H]1CC[C@H]1[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC001183652526 1122232853 /nfs/dbraw/zinc/23/28/53/1122232853.db2.gz RTDHVHWBAIQMOM-YRGRVCCFSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001183822804 1122241987 /nfs/dbraw/zinc/24/19/87/1122241987.db2.gz MYSRQTWSADBTNZ-XEZLXBQYSA-N 1 0 294.782 3.630 20 5 CHBDRO C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001183822803 1122242335 /nfs/dbraw/zinc/24/23/35/1122242335.db2.gz MYSRQTWSADBTNZ-LPTSXCQYSA-N 1 0 294.782 3.630 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C2CCCCC2)cc1[N+](=O)[O-] ZINC000504886801 1122308800 /nfs/dbraw/zinc/30/88/00/1122308800.db2.gz DJLIQANKSHLNOG-LBPRGKRZSA-N 1 0 292.379 3.977 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)C ZINC000504911191 1122310241 /nfs/dbraw/zinc/31/02/41/1122310241.db2.gz BVPFOPWWOXRIQT-GFCCVEGCSA-N 1 0 282.409 3.711 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1CCC1 ZINC000504911982 1122310888 /nfs/dbraw/zinc/31/08/88/1122310888.db2.gz ONFMCDHSXDUNSV-CYBMUJFWSA-N 1 0 294.420 3.855 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)C1CCCCC1 ZINC000505309219 1122356145 /nfs/dbraw/zinc/35/61/45/1122356145.db2.gz ZOMGIFQBNSLEPC-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000514086982 1122375220 /nfs/dbraw/zinc/37/52/20/1122375220.db2.gz DYERJIIXNFGNRQ-AWEZNQCLSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000183521998 1129059718 /nfs/dbraw/zinc/05/97/18/1129059718.db2.gz WGQVQVWXVMBZSU-VXGBXAGGSA-N 1 0 282.409 3.695 20 5 CHBDRO CCCC[N@H+](CC)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505842323 1122556301 /nfs/dbraw/zinc/55/63/01/1122556301.db2.gz HSFZWHBJCAWOAR-UHFFFAOYSA-N 1 0 250.342 3.525 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000601289569 1122616730 /nfs/dbraw/zinc/61/67/30/1122616730.db2.gz PBIVQAXKBWZEGM-SMDDNHRTSA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1ccc(C[N@H+]2C[C@H](C)CC(C)(C)C2)cc1[N+](=O)[O-] ZINC001192502685 1122648929 /nfs/dbraw/zinc/64/89/29/1122648929.db2.gz XWTYIRFFQMSOHH-GFCCVEGCSA-N 1 0 276.380 3.771 20 5 CHBDRO Cc1c(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC001192481526 1122649626 /nfs/dbraw/zinc/64/96/26/1122649626.db2.gz NCVPHPDEZOWGAS-XGWLTEMNSA-N 1 0 288.391 3.914 20 5 CHBDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000438481887 1122702605 /nfs/dbraw/zinc/70/26/05/1122702605.db2.gz WSBHCMMQHKVYRM-LBPRGKRZSA-N 1 0 290.285 3.661 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000086642574 1122783776 /nfs/dbraw/zinc/78/37/76/1122783776.db2.gz XJEBUAKQOSIBRA-UHFFFAOYSA-N 1 0 280.368 3.662 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000518774337 1122788968 /nfs/dbraw/zinc/78/89/68/1122788968.db2.gz AMNGHMMOLBTDMI-DOMZBBRYSA-N 1 0 276.380 3.996 20 5 CHBDRO CC(C)CC[N@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000054174220 1122792488 /nfs/dbraw/zinc/79/24/88/1122792488.db2.gz SXZQGNWIZSBVFM-UHFFFAOYSA-N 1 0 268.382 3.667 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426524699 1122813133 /nfs/dbraw/zinc/81/31/33/1122813133.db2.gz PNQPWWYAGKGMAB-GXFFZTMASA-N 1 0 280.755 3.623 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-] ZINC000775617591 1122817431 /nfs/dbraw/zinc/81/74/31/1122817431.db2.gz ISBWJOBKQUIEBA-HBYGRHMLSA-N 1 0 280.343 3.648 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H]1CC=CCC1 ZINC000506741885 1122819010 /nfs/dbraw/zinc/81/90/10/1122819010.db2.gz CARHOOMEKFPMDU-KBPBESRZSA-N 1 0 274.364 3.944 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@H]1CC=CCC1 ZINC000506741887 1122819630 /nfs/dbraw/zinc/81/96/30/1122819630.db2.gz CARHOOMEKFPMDU-UONOGXRCSA-N 1 0 274.364 3.944 20 5 CHBDRO CC(C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000102419369 1122919058 /nfs/dbraw/zinc/91/90/58/1122919058.db2.gz ATJZLAULHUKPHO-UHFFFAOYSA-N 1 0 276.361 3.821 20 5 CHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000507109789 1122925856 /nfs/dbraw/zinc/92/58/56/1122925856.db2.gz GURGTNNDMSJPBF-UHFFFAOYSA-N 1 0 288.372 3.918 20 5 CHBDRO Cc1cc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)ccc1F ZINC000507146470 1122929291 /nfs/dbraw/zinc/92/92/91/1122929291.db2.gz WYVDNOLYELIXHD-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO C[C@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000086887713 1122945428 /nfs/dbraw/zinc/94/54/28/1122945428.db2.gz KNAFOQAXNSFZEI-GXTWGEPZSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000086889895 1122947020 /nfs/dbraw/zinc/94/70/20/1122947020.db2.gz OXPCZAOMMBMHBU-TZMCWYRMSA-N 1 0 262.353 3.653 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH+]2CCCCCC2)ccc1Cl ZINC000037403724 1122959160 /nfs/dbraw/zinc/95/91/60/1122959160.db2.gz VISNSFVDOWLVDD-UHFFFAOYSA-N 1 0 268.744 3.624 20 5 CHBDRO C[C@H](c1cccnc1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183730498 1129090560 /nfs/dbraw/zinc/09/05/60/1129090560.db2.gz KZWLLEZXCVFUJX-VIIAAUOXSA-N 1 0 297.358 3.696 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c1 ZINC000507665544 1122984142 /nfs/dbraw/zinc/98/41/42/1122984142.db2.gz KVDFQOFNDHNEAZ-MRXNPFEDSA-N 1 0 282.343 3.584 20 5 CHBDRO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000081599883 1122986174 /nfs/dbraw/zinc/98/61/74/1122986174.db2.gz WVXPZIXCAHCBGT-LBPRGKRZSA-N 1 0 290.388 3.719 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1cccc(C)c1[N+](=O)[O-] ZINC000218824535 1123139683 /nfs/dbraw/zinc/13/96/83/1123139683.db2.gz JUNFIGUNXWKHDI-AWEZNQCLSA-N 1 0 293.411 3.826 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000294396797 1123151704 /nfs/dbraw/zinc/15/17/04/1123151704.db2.gz KUMQFQPRRKYKGN-CYBMUJFWSA-N 1 0 276.361 3.897 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000294498042 1123202524 /nfs/dbraw/zinc/20/25/24/1123202524.db2.gz ZESDKSDBAJXTBC-CQSZACIVSA-N 1 0 276.361 3.897 20 5 CHBDRO Cc1ccc(C[N@@H+]([C@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000508010813 1123255022 /nfs/dbraw/zinc/25/50/22/1123255022.db2.gz ZOSMCHYKQXBWMS-GFCCVEGCSA-N 1 0 274.364 3.666 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1C=CCC1 ZINC000850509694 1123278242 /nfs/dbraw/zinc/27/82/42/1123278242.db2.gz PYVFRBBUMNXBOR-CWRNSKLLSA-N 1 0 286.375 3.614 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2CCC(C(F)F)CC2)c1 ZINC000442767707 1123337915 /nfs/dbraw/zinc/33/79/15/1123337915.db2.gz NFPNIRGLGSGAKR-UHFFFAOYSA-N 1 0 284.306 3.508 20 5 CHBDRO C[C@@H](O)C[N@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000776520797 1123345812 /nfs/dbraw/zinc/34/58/12/1123345812.db2.gz GQTAPFYPLPOXTR-CQSZACIVSA-N 1 0 279.383 3.806 20 5 CHBDRO C[C@@H](Nc1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)[NH+](C)C ZINC000439132101 1123362798 /nfs/dbraw/zinc/36/27/98/1123362798.db2.gz WSOXQTWQKPEWDB-DYVFJYSZSA-N 1 0 299.374 3.698 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C2(Cl)CC2)cc1[N+](=O)[O-] ZINC000925490877 1123572954 /nfs/dbraw/zinc/57/29/54/1123572954.db2.gz CVDRFDXLZCNDDA-MNOVXSKESA-N 1 0 282.771 3.714 20 5 CHBDRO C[C@H]([NH2+]CCCOC1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000173365524 1123598905 /nfs/dbraw/zinc/59/89/05/1123598905.db2.gz PEGYRSIKZZSRBW-ZDUSSCGKSA-N 1 0 292.379 3.595 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783547703 1123749218 /nfs/dbraw/zinc/74/92/18/1123749218.db2.gz UOSQNPZARNKDER-LLVKDONJSA-N 1 0 268.744 3.623 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(C(F)F)CC1 ZINC000475214071 1123825948 /nfs/dbraw/zinc/82/59/48/1123825948.db2.gz FHBHLWTUXOPRPJ-YRNVUSSQSA-N 1 0 296.317 3.633 20 5 CHBDRO C[C@@H]1CC[C@@H](C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000475547653 1124008006 /nfs/dbraw/zinc/00/80/06/1124008006.db2.gz KODDWAYZJRHWRC-IOKDEZFASA-N 1 0 274.364 3.634 20 5 CHBDRO CC(C)(C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C(C)(F)F ZINC000865790290 1124015301 /nfs/dbraw/zinc/01/53/01/1124015301.db2.gz OWDLRFLCSBZLPB-VURMDHGXSA-N 1 0 298.333 3.879 20 5 CHBDRO COc1ccc(C[N@H+](CC2CCC2)C(C)C)cc1[N+](=O)[O-] ZINC000444769506 1124061034 /nfs/dbraw/zinc/06/10/34/1124061034.db2.gz ZXAXSCDTYJNXFV-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@H]1CCSC1 ZINC000866403836 1124063880 /nfs/dbraw/zinc/06/38/80/1124063880.db2.gz WTXPEEFXBQKAIK-OLZOCXBDSA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@@H]1CCCCC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000088512764 1124064476 /nfs/dbraw/zinc/06/44/76/1124064476.db2.gz PMPNHTOSGRVKQH-CJNGLKHVSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)C(C)(C)C(F)F)cc1[N+](=O)[O-] ZINC000866540476 1124080508 /nfs/dbraw/zinc/08/05/08/1124080508.db2.gz OWSXDIIWUFUDTM-JTQLQIEISA-N 1 0 286.322 3.673 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCc1cccs1 ZINC000525266916 1124120347 /nfs/dbraw/zinc/12/03/47/1124120347.db2.gz ZTDVSTMVLVSAPO-GFCCVEGCSA-N 1 0 290.388 3.892 20 5 CHBDRO COc1ccc(C[N@@H+]2C[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000525637969 1124451698 /nfs/dbraw/zinc/45/16/98/1124451698.db2.gz MRVFYOWGTOFCKZ-CHWSQXEVSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1C ZINC000525636064 1124452039 /nfs/dbraw/zinc/45/20/39/1124452039.db2.gz DBJLNJRZWIYSKV-QWRGUYRKSA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccc(CC[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])o1 ZINC000872022877 1124659088 /nfs/dbraw/zinc/65/90/88/1124659088.db2.gz MOEJZIJMQQCTGS-LLVKDONJSA-N 1 0 292.310 3.529 20 5 CHBDRO C[C@H]([NH2+]C(C1CC1)C1CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027906 1124660555 /nfs/dbraw/zinc/66/05/55/1124660555.db2.gz MZOVRBVSVUQQDB-VIFPVBQESA-N 1 0 278.327 3.573 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccncc1 ZINC000449165654 1124663062 /nfs/dbraw/zinc/66/30/62/1124663062.db2.gz WVORAADRIUPJCY-CJNGLKHVSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1(C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872055125 1124667514 /nfs/dbraw/zinc/66/75/14/1124667514.db2.gz DZJLGGBZYKLESP-ZJUUUORDSA-N 1 0 266.316 3.573 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCCSC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872071920 1124674611 /nfs/dbraw/zinc/67/46/11/1124674611.db2.gz ZYEPXJPTWPXTIH-GHMZBOCLSA-N 1 0 298.383 3.528 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872081048 1124677315 /nfs/dbraw/zinc/67/73/15/1124677315.db2.gz DYSSNXWZKRDYSZ-FIQHERPVSA-N 1 0 278.327 3.573 20 5 CHBDRO C[C@H]([NH2+]C1CC2(CCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872083143 1124678588 /nfs/dbraw/zinc/67/85/88/1124678588.db2.gz HUMAGNOCCMFBBQ-JTQLQIEISA-N 1 0 278.327 3.717 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCCC(F)(F)C1 ZINC000873079343 1124735675 /nfs/dbraw/zinc/73/56/75/1124735675.db2.gz DRTNPWVQCSTUOB-LBPRGKRZSA-N 1 0 298.333 3.879 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCCOC(C)C ZINC000873104431 1124738235 /nfs/dbraw/zinc/73/82/35/1124738235.db2.gz MRCNOBGTHSFQSM-UHFFFAOYSA-N 1 0 294.395 3.506 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1(C)CC(F)(F)C1 ZINC000877833341 1125089067 /nfs/dbraw/zinc/08/90/67/1125089067.db2.gz GQEBZOXORAYWPB-NSHDSACASA-N 1 0 298.333 3.693 20 5 CHBDRO CCC1([NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])CCCC1 ZINC000451276236 1125147969 /nfs/dbraw/zinc/14/79/69/1125147969.db2.gz OFWXVSQHWYCNIH-UHFFFAOYSA-N 1 0 296.342 3.555 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000531378681 1125212589 /nfs/dbraw/zinc/21/25/89/1125212589.db2.gz JNOMWEJNEZFAPO-DYVFJYSZSA-N 1 0 282.343 3.788 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000520214710 1125226855 /nfs/dbraw/zinc/22/68/55/1125226855.db2.gz VPDUWRKPUXESQA-VIKVFOODSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)C(C)C ZINC000532235485 1125243279 /nfs/dbraw/zinc/24/32/79/1125243279.db2.gz OGHOJATUOQJZNC-STQMWFEESA-N 1 0 264.369 3.846 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)C(C)C ZINC000532235484 1125243377 /nfs/dbraw/zinc/24/33/77/1125243377.db2.gz OGHOJATUOQJZNC-QWHCGFSZSA-N 1 0 264.369 3.846 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(C)CC(F)(F)C1 ZINC000883255322 1125385752 /nfs/dbraw/zinc/38/57/52/1125385752.db2.gz RXRHKZKVOXERAW-LLVKDONJSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc(O[C@H](C)C[N+](C)(C)C)c(C(C)C)c1 ZINC001229126606 1125430509 /nfs/dbraw/zinc/43/05/09/1125430509.db2.gz WELXPCPVLVQXJO-CQSZACIVSA-N 1 0 250.406 3.592 20 5 CHBDRO C[C@H](C[NH2+]Cc1cccs1)c1ccccc1[N+](=O)[O-] ZINC000897469126 1125431943 /nfs/dbraw/zinc/43/19/43/1125431943.db2.gz DOONTCBMLKGNNR-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCC[C@H]1CCCF ZINC000282864676 1125453073 /nfs/dbraw/zinc/45/30/73/1125453073.db2.gz YUQDVCZTDQNTFW-JSGCOSHPSA-N 1 0 280.343 3.603 20 5 CHBDRO CC(C)([NH2+]CCc1cccs1)c1ccccc1[N+](=O)[O-] ZINC000795218713 1129191436 /nfs/dbraw/zinc/19/14/36/1129191436.db2.gz BKEYDVVHZMOHMU-UHFFFAOYSA-N 1 0 290.388 3.724 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[NH+](C1CCC1)C1CCC1 ZINC000795477906 1129327756 /nfs/dbraw/zinc/32/77/56/1129327756.db2.gz YVMIKDYNKSPDIW-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO CCC[C@@H]([NH2+]CC[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000038095973 1129333224 /nfs/dbraw/zinc/33/32/24/1129333224.db2.gz NJYJJEMDEPYCRE-HZPDHXFCSA-N 1 0 292.379 3.595 20 5 CHBDRO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C(C1CC1)C1CC1 ZINC000735490633 1129348800 /nfs/dbraw/zinc/34/88/00/1129348800.db2.gz MDIMUGBDWSZDGE-UHFFFAOYSA-N 1 0 294.782 3.869 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000766227559 1129388085 /nfs/dbraw/zinc/38/80/85/1129388085.db2.gz YHRQGTRJGCHCGJ-YNEHKIRRSA-N 1 0 294.420 3.838 20 5 CHBDRO Cc1cccc(C)c1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000738308991 1129392940 /nfs/dbraw/zinc/39/29/40/1129392940.db2.gz JJPJUQDZFDOCJS-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094774536 1129451703 /nfs/dbraw/zinc/45/17/03/1129451703.db2.gz JTDHEEBWYRQVLH-YPMHNXCESA-N 1 0 280.343 3.744 20 5 CHBDRO CC[C@]1(C)CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743860677 1129541075 /nfs/dbraw/zinc/54/10/75/1129541075.db2.gz POPJFUNYLOFZIV-OAHLLOKOSA-N 1 0 280.343 3.746 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000303529717 1129546754 /nfs/dbraw/zinc/54/67/54/1129546754.db2.gz FORHGTGTOUTXSV-KRWDZBQOSA-N 1 0 286.375 3.917 20 5 CHBDRO CSC1CCC(C[NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000720576253 1129663259 /nfs/dbraw/zinc/66/32/59/1129663259.db2.gz VDAAYZVBKBNNGO-UHFFFAOYSA-N 1 0 294.420 3.606 20 5 CHBDRO CCC(CC)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168965916 1129687875 /nfs/dbraw/zinc/68/78/75/1129687875.db2.gz DJXVBDKSJBDDLZ-ZBFHGGJFSA-N 1 0 290.407 3.737 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(C)c1 ZINC001169000778 1129688181 /nfs/dbraw/zinc/68/81/81/1129688181.db2.gz BTBLPXINCKTMFS-HYVNUMGLSA-N 1 0 290.407 3.871 20 5 CHBDRO C[N@H+](Cc1cccc2ccccc21)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169023260 1129691204 /nfs/dbraw/zinc/69/12/04/1129691204.db2.gz DVLVVPWEWHUEEV-WMLDXEAASA-N 1 0 298.386 3.717 20 5 CHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CCCC[C@H]2c2ccccc2)C1 ZINC001169051997 1129692696 /nfs/dbraw/zinc/69/26/96/1129692696.db2.gz FIPBYULVNOJYAP-UAGQMJEPSA-N 1 0 288.391 3.659 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCc1ccc(-c2ccccc2)cc1 ZINC001206001208 1129700761 /nfs/dbraw/zinc/70/07/61/1129700761.db2.gz WUXBTSVFKBJZDN-MRXNPFEDSA-N 1 0 284.423 3.965 20 5 CHBDRO C[C@H]([NH3+])c1ccn(-c2nc3ccccc3c3ccccc32)n1 ZINC001169236306 1129712565 /nfs/dbraw/zinc/71/25/65/1129712565.db2.gz ASTZEARWOLTNSQ-LBPRGKRZSA-N 1 0 288.354 3.593 20 5 CHBDRO c1ccc2c(c1)nc(NCC[C@H]1CCC[NH2+]1)c1ccccc21 ZINC001169568617 1129737958 /nfs/dbraw/zinc/73/79/58/1129737958.db2.gz DRBHKGDUAIJLOD-CQSZACIVSA-N 1 0 291.398 3.942 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)CC2 ZINC000113310568 1129836767 /nfs/dbraw/zinc/83/67/67/1129836767.db2.gz UJIQSLXFOXOLBE-QGZVFWFLSA-N 1 0 282.343 3.680 20 5 CHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801516031 1129923359 /nfs/dbraw/zinc/92/33/59/1129923359.db2.gz QKMHHPJZLMYILY-CQSZACIVSA-N 1 0 280.343 3.744 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801518479 1129923441 /nfs/dbraw/zinc/92/34/41/1129923441.db2.gz JLATUTWSMUQJOQ-HNNXBMFYSA-N 1 0 280.343 3.746 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801517197 1129923602 /nfs/dbraw/zinc/92/36/02/1129923602.db2.gz BHFVYVKSCQFPDI-NEPJUHHUSA-N 1 0 280.343 3.744 20 5 CHBDRO CC(C)C([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)C(C)C ZINC000801533611 1129925573 /nfs/dbraw/zinc/92/55/73/1129925573.db2.gz OCLZUXLWZRXGIN-UHFFFAOYSA-N 1 0 268.332 3.504 20 5 CHBDRO C[N@H+](CCSC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC000801910988 1129958287 /nfs/dbraw/zinc/95/82/87/1129958287.db2.gz REOQICHHRGQSSB-UHFFFAOYSA-N 1 0 282.409 3.558 20 5 CHBDRO CNc1ccc(C)cc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000902078274 1129977713 /nfs/dbraw/zinc/97/77/13/1129977713.db2.gz LZQZSTGOYXZILP-CYBMUJFWSA-N 1 0 299.374 3.796 20 5 CHBDRO CCO[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000902766422 1130054884 /nfs/dbraw/zinc/05/48/84/1130054884.db2.gz KFRIQZXXPZBBDL-IVMMDQJWSA-N 1 0 292.379 3.593 20 5 CHBDRO CCO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000902893914 1130080678 /nfs/dbraw/zinc/08/06/78/1130080678.db2.gz FRPXFOOLEKAFMI-BFHYXJOUSA-N 1 0 292.379 3.593 20 5 CHBDRO CC(C)C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000746653142 1130133865 /nfs/dbraw/zinc/13/38/65/1130133865.db2.gz CKFKMHPLVZPILY-UHFFFAOYSA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000903245846 1130135982 /nfs/dbraw/zinc/13/59/82/1130135982.db2.gz OWSLSVQNPLNIED-KGLIPLIRSA-N 1 0 299.374 3.753 20 5 CHBDRO CCO[C@H]1CCC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000903286580 1130146862 /nfs/dbraw/zinc/14/68/62/1130146862.db2.gz BLSLTKNGWPRANH-INWMFGNUSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+][C@@H]1C[C@@H]2CCC[C@H]12)c1c(F)cccc1[N+](=O)[O-] ZINC000903318546 1130153470 /nfs/dbraw/zinc/15/34/70/1130153470.db2.gz QGHNSNOIDSAJAL-MRBYEJRBSA-N 1 0 278.327 3.573 20 5 CHBDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903341524 1130163136 /nfs/dbraw/zinc/16/31/36/1130163136.db2.gz ZFFDDZIKSDPZTA-SJKOYZFVSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903427766 1130176136 /nfs/dbraw/zinc/17/61/36/1130176136.db2.gz JUWFZSMXHFILGS-PXAZEXFGSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788480510 1130189929 /nfs/dbraw/zinc/18/99/29/1130189929.db2.gz KXKCNHWOGPDNFW-KYOSRNDESA-N 1 0 292.354 3.887 20 5 CHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1C=CCC1 ZINC000826942655 1130317407 /nfs/dbraw/zinc/31/74/07/1130317407.db2.gz RUOQUZACLARDSI-JTQLQIEISA-N 1 0 287.146 3.710 20 5 CHBDRO [NH3+]Cc1cc(-c2ccc3cc4ccccc4cc3c2)ncn1 ZINC001240679958 1130414993 /nfs/dbraw/zinc/41/49/93/1130414993.db2.gz KWFHGMRUIOCFBY-UHFFFAOYSA-N 1 0 285.350 3.909 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cc(Cl)cc(Cl)c1F ZINC001234930669 1130693301 /nfs/dbraw/zinc/69/33/01/1130693301.db2.gz QFKQOBZRDYKEAY-MRVPVSSYSA-N 1 0 281.178 3.606 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCSCC1)c1ccc([N+](=O)[O-])cc1 ZINC000692465189 1130740405 /nfs/dbraw/zinc/74/04/05/1130740405.db2.gz MPGKOCHHJWVRHF-DGCLKSJQSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000782502359 1130780222 /nfs/dbraw/zinc/78/02/22/1130780222.db2.gz FQYSQQLOPCQYIP-XFJVYGCCSA-N 1 0 292.354 3.744 20 5 CHBDRO C[C@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000783630117 1130843541 /nfs/dbraw/zinc/84/35/41/1130843541.db2.gz TYBMVIMBAOHCPU-UMSPYCQHSA-N 1 0 282.771 3.917 20 5 CHBDRO C[C@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815620829 1131009460 /nfs/dbraw/zinc/00/94/60/1131009460.db2.gz CJFKZQOZSZZGKC-NSHDSACASA-N 1 0 289.379 3.550 20 5 CHBDRO C[C@H]([NH2+]C1CC(C(C)(C)C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815643318 1131014962 /nfs/dbraw/zinc/01/49/62/1131014962.db2.gz ZJXJVBOXURFNEF-PKSQDBQZSA-N 1 0 291.395 3.652 20 5 CHBDRO CC1=CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000816556485 1131110037 /nfs/dbraw/zinc/11/00/37/1131110037.db2.gz KMPLJVOGXAGKLS-GFCCVEGCSA-N 1 0 280.755 3.837 20 5 CHBDRO CC(C)C1([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000816644827 1131118118 /nfs/dbraw/zinc/11/81/18/1131118118.db2.gz XMMAHQNGOVHMBB-UHFFFAOYSA-N 1 0 268.744 3.526 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C/C=C/C2CC2)cc1[N+](=O)[O-] ZINC001117712231 1131193616 /nfs/dbraw/zinc/19/36/16/1131193616.db2.gz CTMSSWUGJDYIFK-ZYOFXKKJSA-N 1 0 290.363 3.610 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CC(C)(C)C1 ZINC001171086746 1131511689 /nfs/dbraw/zinc/51/16/89/1131511689.db2.gz JMBSIQLMWNRHRP-UHFFFAOYSA-N 1 0 280.343 3.744 20 5 CHBDRO CC(C)([NH3+])CNc1nc2ccccc2c2ccccc21 ZINC001171194430 1131647036 /nfs/dbraw/zinc/64/70/36/1131647036.db2.gz NCIFSEDFYZYQKB-UHFFFAOYSA-N 1 0 265.360 3.537 20 5 CHBDRO OC[C@H](CCF)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000846097684 1131689528 /nfs/dbraw/zinc/68/95/28/1131689528.db2.gz UFUNFBRYLSHRAQ-INIZCTEOSA-N 1 0 297.373 3.803 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(C3CCC3)CC2)c(F)c1 ZINC001171841143 1132106453 /nfs/dbraw/zinc/10/64/53/1132106453.db2.gz KGSUTERVMXAUSN-UHFFFAOYSA-N 1 0 292.354 3.746 20 5 CHBDRO CC(=O)c1cc2ccccc2cc1O[C@H](C)C[N+](C)(C)C ZINC001230065152 1132152478 /nfs/dbraw/zinc/15/24/78/1132152478.db2.gz BSFKLENRFHNJPU-CYBMUJFWSA-N 1 0 286.395 3.516 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1c(Cl)cccc1C(F)(F)F ZINC001230826539 1132218860 /nfs/dbraw/zinc/21/88/60/1132218860.db2.gz OOZOJUNINNDBCR-SECBINFHSA-N 1 0 296.740 3.832 20 5 CHBDRO COC1C[NH+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001141723290 1132239347 /nfs/dbraw/zinc/23/93/47/1132239347.db2.gz SUSHDYUAEQYWTL-UHFFFAOYSA-N 1 0 277.367 3.824 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[N@@H+]1CCC12COC2 ZINC001141728100 1132242083 /nfs/dbraw/zinc/24/20/83/1132242083.db2.gz LKLSNVHFDMFNDY-UHFFFAOYSA-N 1 0 289.378 3.968 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001141728586 1132242729 /nfs/dbraw/zinc/24/27/29/1132242729.db2.gz YMQNVIVBNJGQIW-CALCHBBNSA-N 1 0 289.378 3.966 20 5 CHBDRO CC1(C)CC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172915900 1132359956 /nfs/dbraw/zinc/35/99/56/1132359956.db2.gz PNQCJTPNDNRQMD-HNNXBMFYSA-N 1 0 288.391 3.574 20 5 CHBDRO CC(C)([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C1CC1 ZINC001172895227 1132360047 /nfs/dbraw/zinc/36/00/47/1132360047.db2.gz BCAWAUPCAZMKHM-OAHLLOKOSA-N 1 0 288.391 3.620 20 5 CHBDRO C[N@H+]([C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)(C)C ZINC001172910333 1132372164 /nfs/dbraw/zinc/37/21/64/1132372164.db2.gz LQEKPLULDHCAKC-CQSZACIVSA-N 1 0 276.380 3.573 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@](C)(F)C1 ZINC001173221382 1132411583 /nfs/dbraw/zinc/41/15/83/1132411583.db2.gz HWZZSYPPQUDEEH-CJNGLKHVSA-N 1 0 294.370 3.740 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC001173226221 1132412472 /nfs/dbraw/zinc/41/24/72/1132412472.db2.gz LJFSCTQPGJUUNC-VXGBXAGGSA-N 1 0 298.333 3.503 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC(C)(C)C ZINC001173227255 1132412543 /nfs/dbraw/zinc/41/25/43/1132412543.db2.gz OYBXFHUPMXBJAG-LBPRGKRZSA-N 1 0 264.369 3.504 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001173223102 1132412807 /nfs/dbraw/zinc/41/28/07/1132412807.db2.gz XRQXYDQSGOXQRC-FVQBIDKESA-N 1 0 288.391 3.648 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001173225688 1132412833 /nfs/dbraw/zinc/41/28/33/1132412833.db2.gz FISJPSFCCSNFIS-YPMHNXCESA-N 1 0 298.333 3.503 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1[C@H](C)CCC[C@H]1C ZINC001173224439 1132413012 /nfs/dbraw/zinc/41/30/12/1132413012.db2.gz FVQKGZHDZZNVPK-MCIONIFRSA-N 1 0 276.380 3.789 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC2(CCC2)C1 ZINC001173230196 1132413732 /nfs/dbraw/zinc/41/37/32/1132413732.db2.gz COQVRXXHZHMBSC-CQSZACIVSA-N 1 0 288.391 3.792 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001173231817 1132414330 /nfs/dbraw/zinc/41/43/30/1132414330.db2.gz NKEMCYFJAOZGFC-HZSPNIEDSA-N 1 0 276.380 3.504 20 5 CHBDRO CC(C)C1CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173233343 1132414346 /nfs/dbraw/zinc/41/43/46/1132414346.db2.gz LECFTKPINMPIKC-CQSZACIVSA-N 1 0 290.407 3.894 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173235814 1132415561 /nfs/dbraw/zinc/41/55/61/1132415561.db2.gz ZNDHNLDBGBKYGL-UONOGXRCSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCc2ccccc21 ZINC001173214218 1132415986 /nfs/dbraw/zinc/41/59/86/1132415986.db2.gz NLCGIDNWYIXJHU-SCLBCKFNSA-N 1 0 296.370 3.803 20 5 CHBDRO Cc1ccnc([C@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173212894 1132416134 /nfs/dbraw/zinc/41/61/34/1132416134.db2.gz CIXKCIOAPSPAHI-KGLIPLIRSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccccc2)CC1 ZINC001173213885 1132416292 /nfs/dbraw/zinc/41/62/92/1132416292.db2.gz LPOPBYBSQZBKDT-AWEZNQCLSA-N 1 0 296.370 3.805 20 5 CHBDRO CCCCCC[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173209619 1132416684 /nfs/dbraw/zinc/41/66/84/1132416684.db2.gz DNBHAQCTZBJAKC-CYBMUJFWSA-N 1 0 264.369 3.696 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCc2ccccc21 ZINC001173214216 1132416738 /nfs/dbraw/zinc/41/67/38/1132416738.db2.gz NLCGIDNWYIXJHU-ACJLOTCBSA-N 1 0 296.370 3.803 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC(F)(F)CC1 ZINC001173209277 1132416857 /nfs/dbraw/zinc/41/68/57/1132416857.db2.gz AYIBXTUKESQNMQ-NSHDSACASA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@@H]1F ZINC001232219386 1132439166 /nfs/dbraw/zinc/43/91/66/1132439166.db2.gz TUBMEUCLTBJUDO-WBMJQRKESA-N 1 0 295.361 3.573 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2ccc(C3CC[NH2+]CC3)cc2)cc1 ZINC001159596892 1132871750 /nfs/dbraw/zinc/87/17/50/1132871750.db2.gz LNWIYMAJSBQELO-UHFFFAOYSA-N 1 0 297.358 3.805 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC001174478479 1132882147 /nfs/dbraw/zinc/88/21/47/1132882147.db2.gz YIYJHGNHWOXLRK-UHFFFAOYSA-N 1 0 297.358 3.934 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC[C@H]2C(C)C)cccc1[N+](=O)[O-] ZINC001205403254 1133574658 /nfs/dbraw/zinc/57/46/58/1133574658.db2.gz WKCVLGMQFAELGS-GJZGRUSLSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC(C2CC2)CC1 ZINC001206141574 1133662597 /nfs/dbraw/zinc/66/25/97/1133662597.db2.gz FDVBNKTZEOLBBV-UHFFFAOYSA-N 1 0 288.391 3.834 20 5 CHBDRO O=[N+]([O-])c1ccccc1Nc1cccc(C[NH+]2CCCC2)c1 ZINC001206164827 1133666218 /nfs/dbraw/zinc/66/62/18/1133666218.db2.gz SACKKMWHOOSYQT-UHFFFAOYSA-N 1 0 297.358 3.934 20 5 CHBDRO Cc1cc(Nc2ccc(F)c([N+](=O)[O-])c2)c2ccccc2[nH+]1 ZINC001211188253 1134387443 /nfs/dbraw/zinc/38/74/43/1134387443.db2.gz GSQGYNLVFKSCNK-UHFFFAOYSA-N 1 0 297.289 3.756 20 5 CHBDRO C[NH+](C)Cc1ccc(Nc2ccc(F)c([N+](=O)[O-])c2)cc1 ZINC001211192711 1134388602 /nfs/dbraw/zinc/38/86/02/1134388602.db2.gz JKPGBDBDBMAOBP-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO O=[N+]([O-])c1ccc(F)c(Nc2cc[nH+]c(C3CC3)c2)c1F ZINC001215292299 1134615003 /nfs/dbraw/zinc/61/50/03/1134615003.db2.gz RIFIXYGFLVXLDB-UHFFFAOYSA-N 1 0 291.257 3.889 20 5 CHBDRO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccccc1[N+](=O)[O-] ZINC000403659968 1134828699 /nfs/dbraw/zinc/82/86/99/1134828699.db2.gz XUCWOWAYKPRLJL-WODVXLOZSA-N 1 0 292.404 3.672 20 5 CHBDRO C[NH+](C)Cc1cccc(Nc2cc(F)cc([N+](=O)[O-])c2)c1 ZINC001216481798 1134903974 /nfs/dbraw/zinc/90/39/74/1134903974.db2.gz DPWSFFUQGDXKCY-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO c1ccc2c(c1)nc(O[C@@H]1CCC[NH2+]C1)c1ccccc21 ZINC001217961748 1135031430 /nfs/dbraw/zinc/03/14/30/1135031430.db2.gz JXLDTZJBMYVGIX-CYBMUJFWSA-N 1 0 278.355 3.519 20 5 CHBDRO C[NH2+][C@H]1C[C@@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001217955865 1135032070 /nfs/dbraw/zinc/03/20/70/1135032070.db2.gz KRWMBQAAYBVXRU-BETUJISGSA-N 1 0 278.355 3.517 20 5 CHBDRO C[C@@H]1C[C@@H](Oc2nccc3c4ccccc4ccc32)C[NH2+]1 ZINC001218039737 1135047514 /nfs/dbraw/zinc/04/75/14/1135047514.db2.gz UKVAKJCHLGUYDQ-TZMCWYRMSA-N 1 0 278.355 3.517 20 5 CHBDRO C[C@@H]1C[C@H](Oc2nc3ccccc3c3ccccc32)C[NH2+]1 ZINC001218046345 1135048828 /nfs/dbraw/zinc/04/88/28/1135048828.db2.gz VRCAYOFPDRWGFQ-OLZOCXBDSA-N 1 0 278.355 3.517 20 5 CHBDRO C[C@@H]1CC[C@@H](Oc2cccc3cc4ccccc4nc32)C[NH2+]1 ZINC001218401078 1135099659 /nfs/dbraw/zinc/09/96/59/1135099659.db2.gz XZFPCBYTZPAQJQ-CZUORRHYSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@@H]1CC[NH2+]C[C@@H]1Oc1nc2ccccc2c2ccccc21 ZINC001218481600 1135112671 /nfs/dbraw/zinc/11/26/71/1135112671.db2.gz RJSGCYACKUOACX-ACJLOTCBSA-N 1 0 292.382 3.765 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@@H]3C[C@@H]4CC[C@H]3[NH2+]4)c12 ZINC001218479975 1135113021 /nfs/dbraw/zinc/11/30/21/1135113021.db2.gz VASCAAZQFSUUMH-ZMSDIMECSA-N 1 0 290.366 3.660 20 5 CHBDRO CC(C)[N@@H+]1CCC[C@H](O[C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001224024710 1135411947 /nfs/dbraw/zinc/41/19/47/1135411947.db2.gz KTKVZOWWGQXVPR-CJNGLKHVSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@@H](OCCC[N+](C)(C)C)c1cc(-c2ccccc2)no1 ZINC001224620742 1135462300 /nfs/dbraw/zinc/46/23/00/1135462300.db2.gz CMYPDBHEQXOSMS-CQSZACIVSA-N 1 0 289.399 3.516 20 5 CHBDRO Cc1ccc(Cl)cc1[C@@H](C)OCCC[N+](C)(C)C ZINC001224622557 1135462609 /nfs/dbraw/zinc/46/26/09/1135462609.db2.gz IEFRXXYKVFNRRX-CYBMUJFWSA-N 1 0 270.824 3.822 20 5 CHBDRO C[C@H](OCCC[NH+]1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC001224861434 1135489819 /nfs/dbraw/zinc/48/98/19/1135489819.db2.gz WYVRSVOURVIMOX-AWEZNQCLSA-N 1 0 292.379 3.548 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc(Oc2ccccc2)cc1 ZINC001225251403 1135526804 /nfs/dbraw/zinc/52/68/04/1135526804.db2.gz TYTPNYFTQIABKT-OAHLLOKOSA-N 1 0 286.395 3.952 20 5 CHBDRO CC[C@@H](C)c1ccc(O[C@@H](C)C[N+](C)(C)C)cc1 ZINC001227329893 1135822787 /nfs/dbraw/zinc/82/27/87/1135822787.db2.gz MZWYJDUXKPPALQ-KGLIPLIRSA-N 1 0 250.406 3.674 20 5 CHBDRO C[C@@H]([NH2+]CC1(C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000104447442 186006389 /nfs/dbraw/zinc/00/63/89/186006389.db2.gz LBGIGNZFXDUYMN-GFCCVEGCSA-N 1 0 262.353 3.826 20 5 CHBDRO CC[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)C ZINC000574788784 335047422 /nfs/dbraw/zinc/04/74/22/335047422.db2.gz KDYFXZFSVMYNTG-HNNXBMFYSA-N 1 0 289.379 3.643 20 5 CHBDRO CCC[C@H]([NH2+]CCc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000035661470 260033647 /nfs/dbraw/zinc/03/36/47/260033647.db2.gz AUSWVDCIYMKRPB-INIZCTEOSA-N 1 0 288.347 3.861 20 5 CHBDRO CCC[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000020087098 170988221 /nfs/dbraw/zinc/98/82/21/170988221.db2.gz CRSCAGLHLRPKGG-RYUDHWBXSA-N 1 0 250.342 3.742 20 5 CHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000037031324 172899515 /nfs/dbraw/zinc/89/95/15/172899515.db2.gz YUMWEYSVLWTPSS-JSGCOSHPSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000037176956 173010948 /nfs/dbraw/zinc/01/09/48/173010948.db2.gz IHKCDQQEGUEWQI-HUBLWGQQSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)CCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000038093535 174107368 /nfs/dbraw/zinc/10/73/68/174107368.db2.gz OZUIVYYRIMTLLI-GFCCVEGCSA-N 1 0 250.342 3.682 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000417945001 227462050 /nfs/dbraw/zinc/46/20/50/227462050.db2.gz CWZLYRYHWOMULK-WMZOPIPTSA-N 1 0 296.370 3.531 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000519968898 260035571 /nfs/dbraw/zinc/03/55/71/260035571.db2.gz UFZFOHOFEHLEQK-WFASDCNBSA-N 1 0 276.380 3.914 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccc([N+](=O)[O-])cc1 ZINC000037177172 260072899 /nfs/dbraw/zinc/07/28/99/260072899.db2.gz KBRQMMBKYFZHAB-IAQYHMDHSA-N 1 0 286.331 3.916 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccsc2Cl)cc1 ZINC000312602229 260175637 /nfs/dbraw/zinc/17/56/37/260175637.db2.gz NKNAXBNEFJUGJW-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C(C1CCC1)C1CCC1 ZINC000313010506 260233148 /nfs/dbraw/zinc/23/31/48/260233148.db2.gz WGCIOPOZWAZZDM-UHFFFAOYSA-N 1 0 274.364 3.653 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000040675880 260349081 /nfs/dbraw/zinc/34/90/81/260349081.db2.gz AIPJCERGBXKRPW-QGZVFWFLSA-N 1 0 284.359 3.878 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000129308626 260385248 /nfs/dbraw/zinc/38/52/48/260385248.db2.gz DMYQVRJVMQQVHP-OAHLLOKOSA-N 1 0 274.320 3.819 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@H](C)SC)c1cccc([N+](=O)[O-])c1 ZINC000090724895 260393152 /nfs/dbraw/zinc/39/31/52/260393152.db2.gz KDRPHJTZWMNUJI-SMDDNHRTSA-N 1 0 282.409 3.777 20 5 CHBDRO CC[C@@H](C)C[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000088293453 260731248 /nfs/dbraw/zinc/73/12/48/260731248.db2.gz YUGZQIMWVZNZEB-DGCLKSJQSA-N 1 0 264.369 3.818 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449061834 261142177 /nfs/dbraw/zinc/14/21/77/261142177.db2.gz HRMRWIBQLSVJEQ-UONOGXRCSA-N 1 0 284.359 3.877 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000518774339 261637363 /nfs/dbraw/zinc/63/73/63/261637363.db2.gz AMNGHMMOLBTDMI-SWLSCSKDSA-N 1 0 276.380 3.996 20 5 CHBDRO CC[N@H+](Cc1ccccn1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182843597 261952593 /nfs/dbraw/zinc/95/25/93/261952593.db2.gz XDMREOYXKSRBPD-CQSZACIVSA-N 1 0 299.374 3.881 20 5 CHBDRO C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000183995658 262004969 /nfs/dbraw/zinc/00/49/69/262004969.db2.gz FVSBMLJBDJYTJA-CJNGLKHVSA-N 1 0 292.379 3.595 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000020544612 262249400 /nfs/dbraw/zinc/24/94/00/262249400.db2.gz AWJMTCQNOKHAIF-MBNYWOFBSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)cccc1[N+](=O)[O-] ZINC000187846413 263270829 /nfs/dbraw/zinc/27/08/29/263270829.db2.gz ZCXXXPPAINWCPN-OLZOCXBDSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1ccc(NCCCCC[NH+]2CCCCC2)cc1 ZINC000518915843 265214884 /nfs/dbraw/zinc/21/48/84/265214884.db2.gz WTYPSECQAXFQHD-UHFFFAOYSA-N 1 0 291.395 3.663 20 5 CHBDRO CC1(C)CCC[C@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000094324585 265237223 /nfs/dbraw/zinc/23/72/23/265237223.db2.gz VNIGUHAJEWLWQE-CYBMUJFWSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000356686569 266159375 /nfs/dbraw/zinc/15/93/75/266159375.db2.gz VHDHLTLWCQTTKJ-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000357034051 266236500 /nfs/dbraw/zinc/23/65/00/266236500.db2.gz GYSJCHNXDJFLRX-ZDUSSCGKSA-N 1 0 274.364 3.607 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1c(C)cccc1[N+](=O)[O-] ZINC000100724882 328028528 /nfs/dbraw/zinc/02/85/28/328028528.db2.gz NLJLYULINOFBLZ-AWEZNQCLSA-N 1 0 293.411 3.826 20 5 CHBDRO CCCC[C@@H](COC)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000531714527 328027989 /nfs/dbraw/zinc/02/79/89/328027989.db2.gz BAZKTQRUAARKFU-KBPBESRZSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@H](Cc1ccsc1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000049155830 328350663 /nfs/dbraw/zinc/35/06/63/328350663.db2.gz GBVWLPGCZCIUCJ-NEPJUHHUSA-N 1 0 290.388 3.938 20 5 CHBDRO CC1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCCC1 ZINC000049963557 328379887 /nfs/dbraw/zinc/37/98/87/328379887.db2.gz PZEJUONTQVPYIN-UHFFFAOYSA-N 1 0 268.744 3.671 20 5 CHBDRO CC[C@@H](C)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963578 328379918 /nfs/dbraw/zinc/37/99/18/328379918.db2.gz ZTSMYMWLRJQCTQ-ZJUUUORDSA-N 1 0 270.760 3.772 20 5 CHBDRO C[C@@H]([NH2+]CC1CC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000525858905 328508891 /nfs/dbraw/zinc/50/88/91/328508891.db2.gz CEKVOWZMQXBGBP-LLVKDONJSA-N 1 0 262.353 3.682 20 5 CHBDRO CC1(C2CC2)CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000563782618 328516786 /nfs/dbraw/zinc/51/67/86/328516786.db2.gz YZWGSBHSKJOQGP-UHFFFAOYSA-N 1 0 274.364 3.607 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCC12CCCC2 ZINC000394213427 326869307 /nfs/dbraw/zinc/86/93/07/326869307.db2.gz HDTAGMNSHGYJQQ-HNNXBMFYSA-N 1 0 274.364 3.797 20 5 CHBDRO CC[C@@H]1CC[C@@H]1[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000558252324 327081651 /nfs/dbraw/zinc/08/16/51/327081651.db2.gz JYGWSZUIPLDABY-BZPMIXESSA-N 1 0 262.353 3.742 20 5 CHBDRO CCC[N@H+](CC)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000559049735 327138914 /nfs/dbraw/zinc/13/89/14/327138914.db2.gz XFGHRKVYJZPKPL-UHFFFAOYSA-N 1 0 290.285 3.846 20 5 CHBDRO CC[C@H]1CC[C@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)CC1 ZINC000560555596 327324314 /nfs/dbraw/zinc/32/43/14/327324314.db2.gz AFOAEVATBTWIPB-MQMHXKEQSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000560882071 327349208 /nfs/dbraw/zinc/34/92/08/327349208.db2.gz AQJWLIFQAOGMCS-NILFDRSVSA-N 1 0 286.331 3.703 20 5 CHBDRO CC(C)CSCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000181757599 327382311 /nfs/dbraw/zinc/38/23/11/327382311.db2.gz SCSPRFKDAUOMRD-GFCCVEGCSA-N 1 0 282.409 3.635 20 5 CHBDRO C[C@@H](CC[NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000043534001 328802262 /nfs/dbraw/zinc/80/22/62/328802262.db2.gz SQMSJAFQNONKOH-AWEZNQCLSA-N 1 0 284.359 3.878 20 5 CHBDRO CC1(C)CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000514100241 328829926 /nfs/dbraw/zinc/82/99/26/328829926.db2.gz UNIJXWYUVACFMZ-FNORWQNLSA-N 1 0 274.364 3.730 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000358391625 328883807 /nfs/dbraw/zinc/88/38/07/328883807.db2.gz FEHVGBPRKHXJJV-KCQAQPDRSA-N 1 0 292.379 3.511 20 5 CHBDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000174352876 329157581 /nfs/dbraw/zinc/15/75/81/329157581.db2.gz KSQKMLOTRUSIDM-ZIAGYGMSSA-N 1 0 294.420 3.701 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC2(CC2)C1 ZINC000187002747 329351272 /nfs/dbraw/zinc/35/12/72/329351272.db2.gz SDUQYYWZTUFMIJ-LBPRGKRZSA-N 1 0 260.337 3.532 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)n1 ZINC000187443773 329357797 /nfs/dbraw/zinc/35/77/97/329357797.db2.gz PCSAPUZACUBYAP-ZDUSSCGKSA-N 1 0 299.374 3.766 20 5 CHBDRO CCC(CC)(CC)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000086642674 332877498 /nfs/dbraw/zinc/87/74/98/332877498.db2.gz TUGPEKIIHDCYJH-UHFFFAOYSA-N 1 0 264.369 3.696 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCC2)C[C@@H]1C ZINC000432814562 330038013 /nfs/dbraw/zinc/03/80/13/330038013.db2.gz AUVUOYHLPDVQGE-ZDUSSCGKSA-N 1 0 274.364 3.668 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)CC(C)C)cccc1[N+](=O)[O-] ZINC000536838626 330231923 /nfs/dbraw/zinc/23/19/23/330231923.db2.gz LYYVCLLLRLJPFC-DGCLKSJQSA-N 1 0 264.369 3.988 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cnc(C)cc1C)c1cccc([N+](=O)[O-])c1 ZINC000397119499 330238745 /nfs/dbraw/zinc/23/87/45/330238745.db2.gz ZMSDQUJADMEKES-QGZVFWFLSA-N 1 0 299.374 3.848 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000035257094 330244883 /nfs/dbraw/zinc/24/48/83/330244883.db2.gz VMHGXDZQCHLLAS-LSDHHAIUSA-N 1 0 276.380 3.962 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000536870724 330263842 /nfs/dbraw/zinc/26/38/42/330263842.db2.gz PLKWMXKLVDJUKJ-CYZMBNFOSA-N 1 0 264.369 3.988 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(C)CC1 ZINC000536875276 330308058 /nfs/dbraw/zinc/30/80/58/330308058.db2.gz ICTBAHOLBJBQGH-LBPRGKRZSA-N 1 0 294.420 3.855 20 5 CHBDRO CC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000120044521 330385285 /nfs/dbraw/zinc/38/52/85/330385285.db2.gz OTHSIDPHJKKUGC-UHFFFAOYSA-N 1 0 290.294 3.636 20 5 CHBDRO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000516301044 330491215 /nfs/dbraw/zinc/49/12/15/330491215.db2.gz ICQPNXHDHZZPOT-DEBLGDTFSA-N 1 0 282.343 3.959 20 5 CHBDRO CCC(C)(C)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000429412903 330545707 /nfs/dbraw/zinc/54/57/07/330545707.db2.gz QQPPPBKMPXMEOH-CYBMUJFWSA-N 1 0 278.396 3.942 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccccc1[N+](=O)[O-] ZINC000429795847 330555068 /nfs/dbraw/zinc/55/50/68/330555068.db2.gz ZTOXBWUCNRWPRL-QWRGUYRKSA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1c(C[NH2+]C2CCC(C(F)F)CC2)cccc1[N+](=O)[O-] ZINC000442858921 330787806 /nfs/dbraw/zinc/78/78/06/330787806.db2.gz UDEAOGPMXAVXFQ-UHFFFAOYSA-N 1 0 298.333 3.817 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC12CCCC2 ZINC000449288189 330912062 /nfs/dbraw/zinc/91/20/62/330912062.db2.gz YBVCCXXWOHHFDV-CZUORRHYSA-N 1 0 288.391 3.838 20 5 CHBDRO CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449351116 330917358 /nfs/dbraw/zinc/91/73/58/330917358.db2.gz YCGKMAPRKOYJQR-TUKIKUTGSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000162483076 330919321 /nfs/dbraw/zinc/91/93/21/330919321.db2.gz YJNBTYQNAZHMIJ-DGCLKSJQSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1cc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)ccn1 ZINC000449404539 330922997 /nfs/dbraw/zinc/92/29/97/330922997.db2.gz UZFMFEKMLVMHPK-UHFFFAOYSA-N 1 0 299.374 3.711 20 5 CHBDRO CCC1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000449412057 330923406 /nfs/dbraw/zinc/92/34/06/330923406.db2.gz DNDJVVSIYBJEAM-UHFFFAOYSA-N 1 0 286.331 3.887 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC(F)(F)C1 ZINC000450941016 331008180 /nfs/dbraw/zinc/00/81/80/331008180.db2.gz PGVBZXYQBIRBKS-CYBMUJFWSA-N 1 0 298.333 3.505 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cs1 ZINC000453118227 331091050 /nfs/dbraw/zinc/09/10/50/331091050.db2.gz KUOHHIXMIROHBU-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000453119834 331091075 /nfs/dbraw/zinc/09/10/75/331091075.db2.gz MUXJIDDPJPAFQK-CQSZACIVSA-N 1 0 290.388 3.940 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1(c2ccccc2)CC1 ZINC000453177926 331097580 /nfs/dbraw/zinc/09/75/80/331097580.db2.gz RQHMNHVLEWOFNE-CQSZACIVSA-N 1 0 296.370 3.805 20 5 CHBDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000453409965 331129790 /nfs/dbraw/zinc/12/97/90/331129790.db2.gz RKRHPHSIVPVYMA-JGGQBBKZSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C2CCC(C(F)F)CC2)cs1 ZINC000459704743 331295179 /nfs/dbraw/zinc/29/51/79/331295179.db2.gz GAZDEOLHRFWCDQ-UHFFFAOYSA-N 1 0 290.335 3.570 20 5 CHBDRO CC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])CC(C)(C)C ZINC000463365338 331346594 /nfs/dbraw/zinc/34/65/94/331346594.db2.gz IXOHPLCQCWQZSL-UHFFFAOYSA-N 1 0 298.358 3.611 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@H]2C2CC2)c(Cl)c1 ZINC000468031400 331427051 /nfs/dbraw/zinc/42/70/51/331427051.db2.gz QAUXQJNIQITSEK-DZGCQCFKSA-N 1 0 294.782 3.917 20 5 CHBDRO CC(C)[C@H]1CCC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000468443895 331435016 /nfs/dbraw/zinc/43/50/16/331435016.db2.gz HIMSLCQQOAVBBW-CVEARBPZSA-N 1 0 276.380 3.552 20 5 CHBDRO CC[C@H]1CCC[C@@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510793869 332917352 /nfs/dbraw/zinc/91/73/52/332917352.db2.gz DPCDAUSSYOJSCI-XPTSAGLGSA-N 1 0 284.306 3.541 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@H]2C2CCC2)c(Cl)c1 ZINC000511044550 332925538 /nfs/dbraw/zinc/92/55/38/332925538.db2.gz BXZTXLYYYCPMKB-DZGCQCFKSA-N 1 0 294.782 3.917 20 5 CHBDRO CCCC[C@H](COC)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000483207312 331863052 /nfs/dbraw/zinc/86/30/52/331863052.db2.gz FCZLUZZVTGVSHD-GDBMZVCRSA-N 1 0 294.395 3.841 20 5 CHBDRO CC[N@H+](CC(C)C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000488539015 332016220 /nfs/dbraw/zinc/01/62/20/332016220.db2.gz IAJZRKIHEIZRIJ-GFCCVEGCSA-N 1 0 250.342 3.634 20 5 CHBDRO CC[N@H+](CC(C)C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000488597221 332020013 /nfs/dbraw/zinc/02/00/13/332020013.db2.gz ZONIVHQYAFHQMH-LBPRGKRZSA-N 1 0 250.342 3.634 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3c(c2)CCCC3)cc1 ZINC000490557148 332091741 /nfs/dbraw/zinc/09/17/41/332091741.db2.gz PHRKVONAIHUEFX-UHFFFAOYSA-N 1 0 296.370 3.763 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000491092441 332147961 /nfs/dbraw/zinc/14/79/61/332147961.db2.gz SODCCINZBSUBBV-LLVKDONJSA-N 1 0 280.343 3.743 20 5 CHBDRO CC(C)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491328987 332191584 /nfs/dbraw/zinc/19/15/84/332191584.db2.gz KJFZSJXOLFIOSO-KRWDZBQOSA-N 1 0 284.359 3.930 20 5 CHBDRO CCOc1cc(C[N@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000492419045 332396590 /nfs/dbraw/zinc/39/65/90/332396590.db2.gz TYOYEWONYWVRDU-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000493310853 332434864 /nfs/dbraw/zinc/43/48/64/332434864.db2.gz OPMMVYQCYPDMIJ-VXGBXAGGSA-N 1 0 294.782 3.870 20 5 CHBDRO CC(C)[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494520821 332477008 /nfs/dbraw/zinc/47/70/08/332477008.db2.gz DZQWJQHPGLOZGR-VIFPVBQESA-N 1 0 290.285 3.748 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000247305311 334278779 /nfs/dbraw/zinc/27/87/79/334278779.db2.gz GTJYGIXPFIYVCY-SFHVURJKSA-N 1 0 296.370 3.802 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CSC[C@@H]2C)cc1[N+](=O)[O-] ZINC000512863086 332990280 /nfs/dbraw/zinc/99/02/80/332990280.db2.gz ZIYVCGBLVMDEBI-SMDDNHRTSA-N 1 0 294.420 3.559 20 5 CHBDRO CC(C)C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000307832478 333017676 /nfs/dbraw/zinc/01/76/76/333017676.db2.gz LOIHFRQYOBIGTQ-GFCCVEGCSA-N 1 0 280.343 3.602 20 5 CHBDRO CC[C@@H](C)C[N@H+](CC)Cc1ccc([N+](=O)[O-])cc1F ZINC000311403750 333067911 /nfs/dbraw/zinc/06/79/11/333067911.db2.gz GRHGJDJNJCSOAD-LLVKDONJSA-N 1 0 268.332 3.602 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC[C@H](F)C1 ZINC000517235847 333095456 /nfs/dbraw/zinc/09/54/56/333095456.db2.gz WTWNQEDJFBPMTH-USJBSMOHSA-N 1 0 292.354 3.868 20 5 CHBDRO CCOCC(C)(C)C[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000336847687 335121120 /nfs/dbraw/zinc/12/11/20/335121120.db2.gz FYYOQIWTAXLUAY-OAHLLOKOSA-N 1 0 294.395 3.698 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC[C@H](C)CC1 ZINC000520972419 333109141 /nfs/dbraw/zinc/10/91/41/333109141.db2.gz RIGKNGQHIBYTQW-MQMHXKEQSA-N 1 0 292.379 3.662 20 5 CHBDRO CC[N@H+](CC1CC1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182782672 333117605 /nfs/dbraw/zinc/11/76/05/333117605.db2.gz KJLCBLRIHUMLCY-GFCCVEGCSA-N 1 0 262.353 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC2(CCC2)C1 ZINC000182844564 333117842 /nfs/dbraw/zinc/11/78/42/333117842.db2.gz JEJPFOFTWSCUMT-ZDUSSCGKSA-N 1 0 274.364 3.840 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CCC1CC1 ZINC000182916972 333118210 /nfs/dbraw/zinc/11/82/10/333118210.db2.gz QFSOSGJWDFFODW-LBPRGKRZSA-N 1 0 262.353 3.696 20 5 CHBDRO C[C@H]([NH2+][C@@H]1COCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000336862414 335121809 /nfs/dbraw/zinc/12/18/09/335121809.db2.gz IWZKCLRGTPLMIB-YVEFUNNKSA-N 1 0 298.342 3.517 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](C)c1cn[nH]c1)c1cccc([N+](=O)[O-])c1 ZINC000222451889 333193694 /nfs/dbraw/zinc/19/36/94/333193694.db2.gz GJEACAIXRGJABG-NHYWBVRUSA-N 1 0 288.351 3.510 20 5 CHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522466259 333287393 /nfs/dbraw/zinc/28/73/93/333287393.db2.gz IGCYBEARAOFYAP-PBHICJAKSA-N 1 0 296.370 3.973 20 5 CHBDRO Cc1ccc(C)c(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000231883818 333331095 /nfs/dbraw/zinc/33/10/95/333331095.db2.gz IFUJJUOWVDMBDQ-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCCc3occc32)cccc1[N+](=O)[O-] ZINC000231884079 333331110 /nfs/dbraw/zinc/33/11/10/333331110.db2.gz WHXHKGLULHLJHF-CQSZACIVSA-N 1 0 286.331 3.663 20 5 CHBDRO Cc1ccc(F)cc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000231885949 333331250 /nfs/dbraw/zinc/33/12/50/333331250.db2.gz NLBYWIFPIATOIP-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000235306153 333367410 /nfs/dbraw/zinc/36/74/10/333367410.db2.gz ISNSWPUMMXHSKQ-BXUZGUMPSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000237432489 333379407 /nfs/dbraw/zinc/37/94/07/333379407.db2.gz RISWNPQPODOZIT-LLVKDONJSA-N 1 0 286.331 3.743 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000524766853 333387685 /nfs/dbraw/zinc/38/76/85/333387685.db2.gz XKBWFUUUHKTDBD-HNNXBMFYSA-N 1 0 262.353 3.607 20 5 CHBDRO CC(C)=CCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000397661121 333426988 /nfs/dbraw/zinc/42/69/88/333426988.db2.gz IZNYCYOVJVBWJI-UHFFFAOYSA-N 1 0 268.744 3.694 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000037565768 333534989 /nfs/dbraw/zinc/53/49/89/333534989.db2.gz LIKXQHFDMUCFSC-SWLSCSKDSA-N 1 0 282.343 3.585 20 5 CHBDRO CC(C)(C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000037934967 333543242 /nfs/dbraw/zinc/54/32/42/333543242.db2.gz VCEDPVCVTPOEOD-UHFFFAOYSA-N 1 0 290.388 3.724 20 5 CHBDRO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000539050523 333651794 /nfs/dbraw/zinc/65/17/94/333651794.db2.gz HXNAILAJEZAUGZ-FZKQIMNGSA-N 1 0 296.370 3.660 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)CC2 ZINC000540150390 333713394 /nfs/dbraw/zinc/71/33/94/333713394.db2.gz GOIQIDPWJIHPGG-GOSISDBHSA-N 1 0 296.370 3.723 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCSCC(C)C ZINC000540149027 333713468 /nfs/dbraw/zinc/71/34/68/333713468.db2.gz LDSXTXFNWVQHLW-CYBMUJFWSA-N 1 0 296.436 3.943 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000540156520 333714662 /nfs/dbraw/zinc/71/46/62/333714662.db2.gz RQTUBYYFLSNIFF-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO CCC[NH2+][C@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000541548036 333779188 /nfs/dbraw/zinc/77/91/88/333779188.db2.gz DJESBHUOJXDFPJ-INIZCTEOSA-N 1 0 288.347 3.839 20 5 CHBDRO CS[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1C)C(C)(C)C ZINC000544597559 333939054 /nfs/dbraw/zinc/93/90/54/333939054.db2.gz HJAYEESFAKHALW-CQSZACIVSA-N 1 0 296.436 3.771 20 5 CHBDRO COCCC(C)(C)C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000546227739 334020849 /nfs/dbraw/zinc/02/08/49/334020849.db2.gz NIUFXSBRJNLWTJ-ZDUSSCGKSA-N 1 0 294.395 3.617 20 5 CHBDRO Cc1cc(F)ccc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000548161337 334143983 /nfs/dbraw/zinc/14/39/83/334143983.db2.gz IFAISHWEGGQRQN-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC1(C)CCC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000079978480 334164844 /nfs/dbraw/zinc/16/48/44/334164844.db2.gz QGVRZRXFMIROTI-CQSZACIVSA-N 1 0 276.380 3.696 20 5 CHBDRO CC(C)([NH2+]Cc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000080347047 334170656 /nfs/dbraw/zinc/17/06/56/334170656.db2.gz VIEJRLZVVYBGBS-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO CCSCCC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000548790919 334174194 /nfs/dbraw/zinc/17/41/94/334174194.db2.gz SOYBYNAUZKNVJI-LBPRGKRZSA-N 1 0 282.409 3.697 20 5 CHBDRO CC[C@H]1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000552072610 334285800 /nfs/dbraw/zinc/28/58/00/334285800.db2.gz SLSSDSYZDGFFOZ-MQMHXKEQSA-N 1 0 262.353 3.653 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000249775426 334340499 /nfs/dbraw/zinc/34/04/99/334340499.db2.gz NACPUXICQAZXPI-QJPTWQEYSA-N 1 0 250.342 3.680 20 5 CHBDRO CCC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CC1 ZINC000090219492 334358830 /nfs/dbraw/zinc/35/88/30/334358830.db2.gz ISBIXSNKJYADKB-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000252222179 334377549 /nfs/dbraw/zinc/37/75/49/334377549.db2.gz ZIDJGAPKMGMXCC-JYAVWHMHSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]1C[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000554738877 334450185 /nfs/dbraw/zinc/45/01/85/334450185.db2.gz MUXCOWQTSYXXSY-DYVFJYSZSA-N 1 0 296.370 3.975 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[C@H]1C(C)(C)C ZINC000565060753 334537103 /nfs/dbraw/zinc/53/71/03/334537103.db2.gz MAKADKVYVZSSLO-ZIAGYGMSSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)CC2CC2)cccc1[N+](=O)[O-] ZINC000164305094 334880000 /nfs/dbraw/zinc/88/00/00/334880000.db2.gz YYDAKQGVANBHOD-JQWIXIFHSA-N 1 0 262.353 3.742 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCc2ccsc2)cccc1[N+](=O)[O-] ZINC000177727280 335382354 /nfs/dbraw/zinc/38/23/54/335382354.db2.gz IEHAJXAGSKLDIF-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO CC[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000178345057 335427029 /nfs/dbraw/zinc/42/70/29/335427029.db2.gz JNKZPJQKKMUROW-SNVBAGLBSA-N 1 0 276.361 3.994 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC2CCC1CC2)c1ccc([N+](=O)[O-])cc1 ZINC000380684439 336016842 /nfs/dbraw/zinc/01/68/42/336016842.db2.gz DCXNTDIHJQWUMR-ZSHMMXAPSA-N 1 0 274.364 3.824 20 5 CHBDRO CC(C)([NH2+]Cc1cccs1)c1ccccc1[N+](=O)[O-] ZINC000291653400 519324224 /nfs/dbraw/zinc/32/42/24/519324224.db2.gz CYONBYDXFVESTJ-UHFFFAOYSA-N 1 0 276.361 3.681 20 5 CHBDRO CC[C@H]([NH2+]CCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000063099172 522577729 /nfs/dbraw/zinc/57/77/29/522577729.db2.gz MTTKWURRTBPBCJ-NSHDSACASA-N 1 0 276.258 3.588 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1CCCS1)c1cccc([N+](=O)[O-])c1 ZINC000149558661 522631679 /nfs/dbraw/zinc/63/16/79/522631679.db2.gz HDTSXUWPIVSENS-KGLIPLIRSA-N 1 0 280.393 3.531 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000050015537 522884943 /nfs/dbraw/zinc/88/49/43/522884943.db2.gz IUJUWQUYCLHYFT-OAHLLOKOSA-N 1 0 270.332 3.836 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000037010520 522914403 /nfs/dbraw/zinc/91/44/03/522914403.db2.gz SZQFSBDJBGAIMO-BLLLJJGKSA-N 1 0 285.347 3.792 20 5 CHBDRO CO[C@@]1(C)CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000280495955 523809079 /nfs/dbraw/zinc/80/90/79/523809079.db2.gz MOKFQNORUOMEGB-CJNGLKHVSA-N 1 0 292.379 3.547 20 5 CHBDRO CCc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])s1 ZINC000050015818 523941989 /nfs/dbraw/zinc/94/19/89/523941989.db2.gz MVCYQLGNLOKWOO-UHFFFAOYSA-N 1 0 276.361 3.509 20 5 CHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccsc2)cc1[N+](=O)[O-] ZINC000061363442 524084076 /nfs/dbraw/zinc/08/40/76/524084076.db2.gz YGQGRIGGHCLXGI-JTQLQIEISA-N 1 0 292.360 3.516 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])s1 ZINC000291781073 524570515 /nfs/dbraw/zinc/57/05/15/524570515.db2.gz UWFRAZMPHLKEPA-UHFFFAOYSA-N 1 0 290.388 3.990 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccsc2)cc1[N+](=O)[O-] ZINC000061361471 524593774 /nfs/dbraw/zinc/59/37/74/524593774.db2.gz XNORCMSLDNHDCB-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000280420531 525480429 /nfs/dbraw/zinc/48/04/29/525480429.db2.gz QQVJPFSLVMVRQT-GHMZBOCLSA-N 1 0 284.306 3.681 20 5 CHBDRO CSC[C@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000292353687 525706940 /nfs/dbraw/zinc/70/69/40/525706940.db2.gz HONKQYYCTMDVFB-STQMWFEESA-N 1 0 294.420 3.731 20 5 CHBDRO CSC[C@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000292353679 525708390 /nfs/dbraw/zinc/70/83/90/525708390.db2.gz HONKQYYCTMDVFB-OLZOCXBDSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(F)(F)F)cc1[N+](=O)[O-] ZINC000063099218 525725440 /nfs/dbraw/zinc/72/54/40/525725440.db2.gz LNWYCBQNUAIKKP-SECBINFHSA-N 1 0 276.258 3.506 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289647968 526107649 /nfs/dbraw/zinc/10/76/49/526107649.db2.gz DPNWYLLAMMMXHU-MNOVXSKESA-N 1 0 284.306 3.633 20 5 CHBDRO Cc1sccc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000293397478 526919047 /nfs/dbraw/zinc/91/90/47/526919047.db2.gz XQNXEHKVYQQSEA-SNVBAGLBSA-N 1 0 276.361 3.816 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2cccnc2)C2CCC2)cc1 ZINC000281008423 527350211 /nfs/dbraw/zinc/35/02/11/527350211.db2.gz YGGIIHSUSSEXIX-KRWDZBQOSA-N 1 0 297.358 3.621 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1CC(F)(F)C1)CCC2 ZINC000293665281 527380473 /nfs/dbraw/zinc/38/04/73/527380473.db2.gz MGOZTALCNWAZKW-CQSZACIVSA-N 1 0 296.317 3.607 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CC1CCC(F)(F)CC1 ZINC000337307547 527400687 /nfs/dbraw/zinc/40/06/87/527400687.db2.gz SMORUWYQUREFPR-UHFFFAOYSA-N 1 0 284.306 3.510 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000280979017 527401085 /nfs/dbraw/zinc/40/10/85/527401085.db2.gz WAYCCSRVLIYBST-QGZVFWFLSA-N 1 0 297.358 3.621 20 5 CHBDRO CC[C@H](C)C[C@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000088297610 1124007069 /nfs/dbraw/zinc/00/70/69/1124007069.db2.gz SCBDJBIRBSPMER-RYUDHWBXSA-N 1 0 280.368 3.518 20 5 CHBDRO CCCCc1ccc(O[C@H](C)C[N+](C)(C)C)cc1 ZINC001227621886 1135851792 /nfs/dbraw/zinc/85/17/92/1135851792.db2.gz GOTYJHALTAEQAL-CQSZACIVSA-N 1 0 250.406 3.503 20 5 CHBDRO CC[C@H](C)c1ccc(O[C@H](C)C[N+](C)(C)C)cc1 ZINC001227329894 1135822771 /nfs/dbraw/zinc/82/27/71/1135822771.db2.gz MZWYJDUXKPPALQ-UONOGXRCSA-N 1 0 250.406 3.674 20 5 CHBDRO C[C@H]([NH2+]CCC1(F)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000348315804 1125537428 /nfs/dbraw/zinc/53/74/28/1125537428.db2.gz CUITYDWCILWHAG-NSHDSACASA-N 1 0 266.316 3.528 20 5 CHBDRO CC(C)[C@H]1CC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000135191160 1125581061 /nfs/dbraw/zinc/58/10/61/1125581061.db2.gz RMAFREHOFWTVKO-LBPRGKRZSA-N 1 0 282.771 3.726 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[NH2+][C@H](c1ccccc1)C1CCC1 ZINC000886062432 1125643312 /nfs/dbraw/zinc/64/33/12/1125643312.db2.gz PAXOVUINYZGXGN-MRXNPFEDSA-N 1 0 297.358 3.621 20 5 CHBDRO CCCC[C@@H](CCC)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819133745 1131233227 /nfs/dbraw/zinc/23/32/27/1131233227.db2.gz CDRPJPJFQFOFOP-GDBMZVCRSA-N 1 0 294.395 3.577 20 5 CHBDRO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC000483120508 1126767524 /nfs/dbraw/zinc/76/75/24/1126767524.db2.gz UJOPONADPYSTJY-NSHDSACASA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CC2 ZINC000160819946 1126775916 /nfs/dbraw/zinc/77/59/16/1126775916.db2.gz WPBJLGFQKPQTLJ-MRXNPFEDSA-N 1 0 282.343 3.680 20 5 CHBDRO Cc1c(C[NH2+]C[C@@H](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000483637493 1126796591 /nfs/dbraw/zinc/79/65/91/1126796591.db2.gz LPUBCXFVITVYQO-AWEZNQCLSA-N 1 0 298.386 3.872 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CCCC(F)(F)F ZINC000266529526 1126984186 /nfs/dbraw/zinc/98/41/86/1126984186.db2.gz FMGULEOVNBLINW-ZZXKWVIFSA-N 1 0 288.269 3.540 20 5 CHBDRO C[C@H](OCC[N+](C)(C)C)c1ccc(Cl)c(Cl)c1 ZINC001224775748 1126993730 /nfs/dbraw/zinc/99/37/30/1126993730.db2.gz OFQBBIXFJMZRIX-JTQLQIEISA-N 1 0 277.215 3.777 20 5 CHBDRO CN(Cc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1F ZINC000043626410 1127002086 /nfs/dbraw/zinc/00/20/86/1127002086.db2.gz CHMPNVCGDKMATB-UHFFFAOYSA-N 1 0 292.285 3.505 20 5 CHBDRO CC(C)(C)C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000487217925 1127025475 /nfs/dbraw/zinc/02/54/75/1127025475.db2.gz UETBNKBBUBLKNN-UHFFFAOYSA-N 1 0 290.285 3.749 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2c3ccccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000111410771 1127125844 /nfs/dbraw/zinc/12/58/44/1127125844.db2.gz JQAZSFGBUJZAKC-UGSOOPFHSA-N 1 0 296.370 3.926 20 5 CHBDRO Cc1ccsc1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000589183623 1127215661 /nfs/dbraw/zinc/21/56/61/1127215661.db2.gz AJWAWANAYWNFHX-UHFFFAOYSA-N 1 0 290.388 3.639 20 5 CHBDRO CC1(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000355140788 1127320596 /nfs/dbraw/zinc/32/05/96/1127320596.db2.gz VKZCWUNAJDVLSP-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CC(F)F ZINC000592392134 1127344899 /nfs/dbraw/zinc/34/48/99/1127344899.db2.gz BIOXHUYRPITUJM-ZJUUUORDSA-N 1 0 272.295 3.537 20 5 CHBDRO CC[N@H+](CCSC)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000592204056 1127345141 /nfs/dbraw/zinc/34/51/41/1127345141.db2.gz QZAZEPAENDCWHV-LBPRGKRZSA-N 1 0 282.409 3.649 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1cccnc1 ZINC000358327940 1127415302 /nfs/dbraw/zinc/41/53/02/1127415302.db2.gz VDYFFZQQPWKMPG-MRXNPFEDSA-N 1 0 299.374 3.929 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C1(C2CCC2)CC1 ZINC000594507433 1127419930 /nfs/dbraw/zinc/41/99/30/1127419930.db2.gz NCXQELVAUPGHLG-CQSZACIVSA-N 1 0 272.348 3.504 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000594515398 1127420961 /nfs/dbraw/zinc/42/09/61/1127420961.db2.gz PPHCTDKFIAUEPD-JSGCOSHPSA-N 1 0 299.374 3.580 20 5 CHBDRO CSCC1(CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000594964004 1127441487 /nfs/dbraw/zinc/44/14/87/1127441487.db2.gz TZEUTDOSVIUVHR-UHFFFAOYSA-N 1 0 294.420 3.526 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)[C@H](C)C2 ZINC000594983179 1127443882 /nfs/dbraw/zinc/44/38/82/1127443882.db2.gz MCZDBOGIFHAADC-ACJLOTCBSA-N 1 0 296.370 3.926 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)C1CCC(F)CC1 ZINC000594991064 1127444263 /nfs/dbraw/zinc/44/42/63/1127444263.db2.gz YSWAPMIWTASQTI-LMWSTFAQSA-N 1 0 280.343 3.601 20 5 CHBDRO CC([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])(C1CC1)C1CC1 ZINC000594992096 1127444501 /nfs/dbraw/zinc/44/45/01/1127444501.db2.gz AUZYSPHPQPAVFD-GQCTYLIASA-N 1 0 286.375 3.776 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000595005182 1127444935 /nfs/dbraw/zinc/44/49/35/1127444935.db2.gz DSFGGWPPATXPTO-DGCLKSJQSA-N 1 0 280.393 3.531 20 5 CHBDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000359293440 1127456872 /nfs/dbraw/zinc/45/68/72/1127456872.db2.gz FLEHWNOBCZSDNQ-BBRMVZONSA-N 1 0 274.364 3.607 20 5 CHBDRO Cc1noc(C[NH+](CC(C)(C)C)CC(C)(C)C)c1[N+](=O)[O-] ZINC000595427091 1127462405 /nfs/dbraw/zinc/46/24/05/1127462405.db2.gz XNTVIKVWCMAKKA-UHFFFAOYSA-N 1 0 297.399 3.785 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CCCc2ccncc2)cc1[N+](=O)[O-] ZINC000360491940 1127500440 /nfs/dbraw/zinc/50/04/40/1127500440.db2.gz OOHOGTLQFYHJDO-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO CCC[C@H]([NH2+]Cc1cccc(N)c1)c1cccc([N+](=O)[O-])c1 ZINC000596650988 1127514985 /nfs/dbraw/zinc/51/49/85/1127514985.db2.gz NFHSXYNGDNFKIC-KRWDZBQOSA-N 1 0 299.374 3.808 20 5 CHBDRO CC(C)([NH2+]CC1CCSCC1)c1ccc([N+](=O)[O-])cc1 ZINC000602609323 1127599358 /nfs/dbraw/zinc/59/93/58/1127599358.db2.gz CBUPBJFFNLDVDS-UHFFFAOYSA-N 1 0 294.420 3.563 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(CCF)CC1 ZINC000602948159 1127622524 /nfs/dbraw/zinc/62/25/24/1127622524.db2.gz AUFFGXVPPAICIV-GFCCVEGCSA-N 1 0 280.343 3.727 20 5 CHBDRO COC[C@H](CC(C)(C)C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000593585341 1127629641 /nfs/dbraw/zinc/62/96/41/1127629641.db2.gz GGFHHVCZWFWPLZ-JSGCOSHPSA-N 1 0 294.395 3.697 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@H]1CC1(F)F ZINC000598648752 1127630556 /nfs/dbraw/zinc/63/05/56/1127630556.db2.gz SAWQREYZOLKUGA-SVTZGKHISA-N 1 0 296.317 3.633 20 5 CHBDRO CCC([NH2+]Cc1csc([N+](=O)[O-])c1)(C1CC1)C1CC1 ZINC000598986827 1127647953 /nfs/dbraw/zinc/64/79/53/1127647953.db2.gz FBFNEAWTOOVADO-UHFFFAOYSA-N 1 0 280.393 3.715 20 5 CHBDRO CCC[C@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)OCC ZINC000599061682 1127654324 /nfs/dbraw/zinc/65/43/24/1127654324.db2.gz QZLXHBVTCMYNLG-UKRRQHHQSA-N 1 0 294.395 3.759 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCCC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000599093068 1127657319 /nfs/dbraw/zinc/65/73/19/1127657319.db2.gz USXZJXZPDTWELJ-JSGCOSHPSA-N 1 0 274.364 3.826 20 5 CHBDRO C[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc([N+](=O)[O-])cc1 ZINC000296615780 1127678607 /nfs/dbraw/zinc/67/86/07/1127678607.db2.gz WOBIKVAURYJAGW-CYBMUJFWSA-N 1 0 299.374 3.618 20 5 CHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC2(CC2)CC1 ZINC000599673305 1127685609 /nfs/dbraw/zinc/68/56/09/1127685609.db2.gz OKFYWMPYFUUORR-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000604012898 1127689582 /nfs/dbraw/zinc/68/95/82/1127689582.db2.gz CNZMEIAHLGRYFB-MRXNPFEDSA-N 1 0 274.364 3.749 20 5 CHBDRO CCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000604427986 1127705720 /nfs/dbraw/zinc/70/57/20/1127705720.db2.gz VBQCVDSSRKHUBV-UHFFFAOYSA-N 1 0 250.342 3.605 20 5 CHBDRO CCC(CC)(C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)SC ZINC000230707724 1127772518 /nfs/dbraw/zinc/77/25/18/1127772518.db2.gz PXQBLEXRQQJZCL-UHFFFAOYSA-N 1 0 296.436 3.915 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@@H](C)CC2)cccc1[N+](=O)[O-] ZINC000063302475 1127811142 /nfs/dbraw/zinc/81/11/42/1127811142.db2.gz OSBHDKHXJVQWAD-GFCCVEGCSA-N 1 0 262.353 3.525 20 5 CHBDRO Cc1ccc([C@H](CNc2ccccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000064114251 1127899422 /nfs/dbraw/zinc/89/94/22/1127899422.db2.gz FAMLVSHBDAEIFF-KRWDZBQOSA-N 1 0 299.374 3.618 20 5 CHBDRO C[C@H]1C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000539826810 1127944597 /nfs/dbraw/zinc/94/45/97/1127944597.db2.gz ZBVOIPDTGWRQGG-FWPCIQOSSA-N 1 0 274.364 3.728 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)c1ccccc1[N+](=O)[O-] ZINC000595070437 1127948982 /nfs/dbraw/zinc/94/89/82/1127948982.db2.gz WASYTKGOHSOSGO-OGHNNQOOSA-N 1 0 296.370 3.974 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000543897982 1127952766 /nfs/dbraw/zinc/95/27/66/1127952766.db2.gz GHBHNVSRHPIAHA-KCXAZCMYSA-N 1 0 274.364 3.605 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCSCC(C)C ZINC000540149028 1127963358 /nfs/dbraw/zinc/96/33/58/1127963358.db2.gz LDSXTXFNWVQHLW-ZDUSSCGKSA-N 1 0 296.436 3.943 20 5 CHBDRO C[C@H](C[NH2+]CCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000544404324 1127971911 /nfs/dbraw/zinc/97/19/11/1127971911.db2.gz KXRDKRZSDJUSFX-HNNXBMFYSA-N 1 0 298.386 3.606 20 5 CHBDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000544612064 1127979400 /nfs/dbraw/zinc/97/94/00/1127979400.db2.gz XCLWUGLXMADCNQ-BXUZGUMPSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@@H](C)[N@H+](CC)Cc1cccc([N+](=O)[O-])c1C ZINC000595592000 1128010261 /nfs/dbraw/zinc/01/02/61/1128010261.db2.gz AHVYFIDNUPBAHP-LLVKDONJSA-N 1 0 250.342 3.524 20 5 CHBDRO CC[C@@]1(C)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000541773663 1128039101 /nfs/dbraw/zinc/03/91/01/1128039101.db2.gz HSMJCVFDTBCAFY-HNNXBMFYSA-N 1 0 262.353 3.525 20 5 CHBDRO CC[C@H](C)C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542001322 1128047012 /nfs/dbraw/zinc/04/70/12/1128047012.db2.gz IIRASHYJFVSQOG-JTQLQIEISA-N 1 0 270.760 3.726 20 5 CHBDRO CCC(CC)[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CC1 ZINC000609144376 1128050980 /nfs/dbraw/zinc/05/09/80/1128050980.db2.gz RZIQYGMHSIZFOB-UHFFFAOYSA-N 1 0 280.343 3.887 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccoc1 ZINC000470173515 1128065054 /nfs/dbraw/zinc/06/50/54/1128065054.db2.gz CDKFWHTUPUZHSJ-JYRVWZFOSA-N 1 0 286.331 3.723 20 5 CHBDRO CCOc1cc(C[N@@H+]2[C@H](C)CC[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492603725 1128105556 /nfs/dbraw/zinc/10/55/56/1128105556.db2.gz CGQNTPDDSIPKTK-TZMCWYRMSA-N 1 0 292.379 3.756 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@@H](C)C[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492629927 1128106831 /nfs/dbraw/zinc/10/68/31/1128106831.db2.gz KZSJRYOLCYNSFO-GXTWGEPZSA-N 1 0 292.379 3.614 20 5 CHBDRO CCOc1cc(C[N@H+](C)[C@H](C)C2CCC2)ccc1[N+](=O)[O-] ZINC000492748629 1128111908 /nfs/dbraw/zinc/11/19/08/1128111908.db2.gz NDGMWBJQLKRNHS-GFCCVEGCSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761523760 1128132640 /nfs/dbraw/zinc/13/26/40/1128132640.db2.gz XHQNPDGIKIZIOW-CMPLNLGQSA-N 1 0 282.771 3.917 20 5 CHBDRO CCC[C@H](CC)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519926 1128133239 /nfs/dbraw/zinc/13/32/39/1128133239.db2.gz LPSMDPLHVOYTAP-NSHDSACASA-N 1 0 270.760 3.917 20 5 CHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000493310851 1128138374 /nfs/dbraw/zinc/13/83/74/1128138374.db2.gz OPMMVYQCYPDMIJ-RYUDHWBXSA-N 1 0 294.782 3.870 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000609204310 1128173538 /nfs/dbraw/zinc/17/35/38/1128173538.db2.gz FTASCVBBXDRLPF-CHWSQXEVSA-N 1 0 276.380 3.994 20 5 CHBDRO CC[C@H](C)[C@@H](C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000609204553 1128173718 /nfs/dbraw/zinc/17/37/18/1128173718.db2.gz WAOSZAWMZYFBEC-QWHCGFSZSA-N 1 0 276.380 3.994 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)CCC=C(C)C ZINC000542483816 1128175995 /nfs/dbraw/zinc/17/59/95/1128175995.db2.gz QZFXJLBCQJLCLR-ZDUSSCGKSA-N 1 0 292.379 3.828 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000054467489 1128177259 /nfs/dbraw/zinc/17/72/59/1128177259.db2.gz NOYRQVVVZBPFJK-SMDDNHRTSA-N 1 0 250.342 3.682 20 5 CHBDRO CC[C@@H](C)C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000054467482 1128177667 /nfs/dbraw/zinc/17/76/67/1128177667.db2.gz NOYRQVVVZBPFJK-RISCZKNCSA-N 1 0 250.342 3.682 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCS[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000927029293 1128209747 /nfs/dbraw/zinc/20/97/47/1128209747.db2.gz CKFUOSZLXIVRMS-WCFLWFBJSA-N 1 0 294.420 3.838 20 5 CHBDRO C[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089512607 1128295795 /nfs/dbraw/zinc/29/57/95/1128295795.db2.gz FJLKYTZXILJOJY-KBPBESRZSA-N 1 0 284.359 3.877 20 5 CHBDRO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCCC1 ZINC000174813205 1128361345 /nfs/dbraw/zinc/36/13/45/1128361345.db2.gz ZQAXSFUYJVGTMU-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO CCCC[C@@H](C)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000562057252 1128374925 /nfs/dbraw/zinc/37/49/25/1128374925.db2.gz SEIBDFAPEWIIFV-CYBMUJFWSA-N 1 0 264.369 3.648 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]C1CC=CC1 ZINC000130506326 1128493463 /nfs/dbraw/zinc/49/34/63/1128493463.db2.gz IHXOKNYQBWPKIY-CZUORRHYSA-N 1 0 286.375 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc(OCCC[NH+]2CCCCCCC2)cc1 ZINC000917831080 1128522361 /nfs/dbraw/zinc/52/23/61/1128522361.db2.gz YDZWIFHIDSCDSZ-UHFFFAOYSA-N 1 0 292.379 3.630 20 5 CHBDRO CCC[C@H](C)C[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000565268979 1128523439 /nfs/dbraw/zinc/52/34/39/1128523439.db2.gz RZIPJXZEBYHISV-LBPRGKRZSA-N 1 0 289.379 3.644 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@@H](F)C1 ZINC000570720114 1128630707 /nfs/dbraw/zinc/63/07/07/1128630707.db2.gz ZVLDHTVUGOKUKC-BPLDGKMQSA-N 1 0 294.370 3.786 20 5 CHBDRO Cc1cc([C@@H]2CCC[NH2+]2)ccc1-c1ccc([N+](=O)[O-])cc1 ZINC000600786155 1128681033 /nfs/dbraw/zinc/68/10/33/1128681033.db2.gz NVWWBFCSEOBIOA-KRWDZBQOSA-N 1 0 282.343 3.995 20 5 CHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609672507 1128721316 /nfs/dbraw/zinc/72/13/16/1128721316.db2.gz HLZRRCDVNYGBBU-YOEHRIQHSA-N 1 0 296.370 3.973 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705057 1128722675 /nfs/dbraw/zinc/72/26/75/1128722675.db2.gz LPPYOOYNJYTCGX-SNVBAGLBSA-N 1 0 270.760 3.726 20 5 CHBDRO CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCO1 ZINC000578637208 1128724475 /nfs/dbraw/zinc/72/44/75/1128724475.db2.gz PBCJQGJGSHLOQY-GZBFAFLISA-N 1 0 292.379 3.511 20 5 CHBDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610001920 1128734100 /nfs/dbraw/zinc/73/41/00/1128734100.db2.gz LZHPQYKFSHOUEW-HIFRSBDPSA-N 1 0 276.380 3.995 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCC(C)(C)C1 ZINC000430243852 1117913867 /nfs/dbraw/zinc/91/38/67/1117913867.db2.gz WBIBMYSKKJALLW-CQSZACIVSA-N 1 0 292.379 3.614 20 5 CHBDRO CC1=C[C@@H](C)C[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000430280756 1117989577 /nfs/dbraw/zinc/98/95/77/1117989577.db2.gz YCORPJFFMDXTRF-DGCLKSJQSA-N 1 0 260.337 3.554 20 5 CHBDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000112676026 1118085398 /nfs/dbraw/zinc/08/53/98/1118085398.db2.gz ZRAJQXNVDKEQSQ-JKSUJKDBSA-N 1 0 276.380 3.899 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC(F)(F)C1 ZINC000615721951 1128760618 /nfs/dbraw/zinc/76/06/18/1128760618.db2.gz MNRVKJVMIHEPOD-SVTZGKHISA-N 1 0 296.317 3.776 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000282212289 1118294536 /nfs/dbraw/zinc/29/45/36/1118294536.db2.gz OMBMHJCGDZMTEQ-FZMZJTMJSA-N 1 0 260.337 3.578 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH+]2C3CCCC2CCC3)cs1 ZINC000610370092 1118362540 /nfs/dbraw/zinc/36/25/40/1118362540.db2.gz SWEYRLXQOIRTIR-UHFFFAOYSA-N 1 0 266.366 3.563 20 5 CHBDRO Cc1ccc(C[N@H+]2CCCC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC001167405237 1118460493 /nfs/dbraw/zinc/46/04/93/1118460493.db2.gz BDXRIJHAYXWVFN-OAHLLOKOSA-N 1 0 276.380 3.914 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CC(C1CC1)C1CC1 ZINC000090740029 1118553594 /nfs/dbraw/zinc/55/35/94/1118553594.db2.gz FYORGNJHRIAFOJ-UHFFFAOYSA-N 1 0 294.782 3.774 20 5 CHBDRO CC(C)[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1 ZINC000178004036 1118595449 /nfs/dbraw/zinc/59/54/49/1118595449.db2.gz ZLOMNJODGNRVMF-UHFFFAOYSA-N 1 0 268.744 3.621 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)C2CCC2)cccc1[N+](=O)[O-] ZINC000090856201 1118645777 /nfs/dbraw/zinc/64/57/77/1118645777.db2.gz SZRWMHFOBWTOAN-RYUDHWBXSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000337512848 1118689351 /nfs/dbraw/zinc/68/93/51/1118689351.db2.gz WNWCIGWQRFHWGU-HFBAOOFYSA-N 1 0 274.364 3.750 20 5 CHBDRO CCn1ccc(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000616737729 1128798098 /nfs/dbraw/zinc/79/80/98/1128798098.db2.gz FHAKECOFAHILEP-VURMDHGXSA-N 1 0 299.374 3.561 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H](C)CSC)c1cccc([N+](=O)[O-])c1 ZINC000131566708 1118761972 /nfs/dbraw/zinc/76/19/72/1118761972.db2.gz BGDMMKJTYVYWTJ-SMDDNHRTSA-N 1 0 282.409 3.777 20 5 CHBDRO C[C@H]([NH2+][C@H]1CC[C@@H]1C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000510688135 1118787013 /nfs/dbraw/zinc/78/70/13/1118787013.db2.gz QNLBESCUZXVSKF-XZJROXQQSA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1CCCC1 ZINC000539020242 1118964171 /nfs/dbraw/zinc/96/41/71/1118964171.db2.gz VZGZGXLYRIOGRG-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO C[C@H](c1ccccc1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000071951767 1118978184 /nfs/dbraw/zinc/97/81/84/1118978184.db2.gz JWKHAXNWBUZZEV-CQSZACIVSA-N 1 0 284.359 3.830 20 5 CHBDRO CC(C)(CF)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000472141808 1118994595 /nfs/dbraw/zinc/99/45/95/1118994595.db2.gz HWHFHUOLHMHDHB-UHFFFAOYSA-N 1 0 292.310 3.693 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1C ZINC000479581066 1119124629 /nfs/dbraw/zinc/12/46/29/1119124629.db2.gz SONTVIJUWYQKAS-UHFFFAOYSA-N 1 0 284.359 3.925 20 5 CHBDRO [NH3+]Cc1cccn1-c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1 ZINC001167596037 1119147991 /nfs/dbraw/zinc/14/79/91/1119147991.db2.gz SACMXXAUUXTTHY-UHFFFAOYSA-N 1 0 293.326 3.511 20 5 CHBDRO CC(C)[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccnc1 ZINC000091407472 1119153449 /nfs/dbraw/zinc/15/34/49/1119153449.db2.gz XHPWFKFFSJQCPW-KRWDZBQOSA-N 1 0 299.374 3.519 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000343016862 1119282139 /nfs/dbraw/zinc/28/21/39/1119282139.db2.gz YDZRNMBOTCFVAU-MRXNPFEDSA-N 1 0 274.364 3.668 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001167656135 1119302349 /nfs/dbraw/zinc/30/23/49/1119302349.db2.gz GRTCICMTZRLTIW-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000583254488 1119327518 /nfs/dbraw/zinc/32/75/18/1119327518.db2.gz NJUYSIFMHDRJLT-QWHCGFSZSA-N 1 0 292.379 3.518 20 5 CHBDRO CC(C)CC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000611774600 1119369413 /nfs/dbraw/zinc/36/94/13/1119369413.db2.gz DTZGFKNHULHOQW-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000219697410 1119511291 /nfs/dbraw/zinc/51/12/91/1119511291.db2.gz FINOUWLVCUQVAS-DOMZBBRYSA-N 1 0 262.353 3.605 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCCC12CC2 ZINC000601138113 1119810859 /nfs/dbraw/zinc/81/08/59/1119810859.db2.gz PDEZHYFFCYLZDH-CSPWOOARSA-N 1 0 272.348 3.530 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2C[C@H]2C)cc1[N+](=O)[O-] ZINC000414105072 1119900417 /nfs/dbraw/zinc/90/04/17/1119900417.db2.gz ZRMRXOSITKXOLH-GFQSEFKGSA-N 1 0 262.353 3.598 20 5 CHBDRO CC[C@H]([NH2+][C@H]1C[C@@H](OC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000414138716 1119912951 /nfs/dbraw/zinc/91/29/51/1119912951.db2.gz HPQAXYLJQLKHBE-IMJJTQAJSA-N 1 0 292.379 3.592 20 5 CHBDRO C[C@@H](C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC000472587309 1119986976 /nfs/dbraw/zinc/98/69/76/1119986976.db2.gz WUCGXPWFSYREAT-AWEZNQCLSA-N 1 0 296.370 3.757 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000181261810 1120031909 /nfs/dbraw/zinc/03/19/09/1120031909.db2.gz HFTHKJWRDQXXQV-RISCZKNCSA-N 1 0 292.379 3.592 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCCC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000695068400 1120100443 /nfs/dbraw/zinc/10/04/43/1120100443.db2.gz YWCKTILDHHWMEN-GFCCVEGCSA-N 1 0 284.306 3.571 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CS[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000414508014 1120106047 /nfs/dbraw/zinc/10/60/47/1120106047.db2.gz ZTUGVZJNJFQZAE-AAEUAGOBSA-N 1 0 294.420 3.702 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CCCCC1 ZINC000468634583 1120231915 /nfs/dbraw/zinc/23/19/15/1120231915.db2.gz GCGSGYFZPMRWIZ-RAXLEYEMSA-N 1 0 274.364 3.920 20 5 CHBDRO CC[C@@H](C)C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000481077478 1120264835 /nfs/dbraw/zinc/26/48/35/1120264835.db2.gz QEUZHCNFOMJOTG-GFCCVEGCSA-N 1 0 262.353 3.605 20 5 CHBDRO C[C@H](c1ccco1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255049518 1120315783 /nfs/dbraw/zinc/31/57/83/1120315783.db2.gz WTQFZRGHUAGMGT-DMTLFAOVSA-N 1 0 286.331 3.894 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)o1 ZINC000601304353 1120363658 /nfs/dbraw/zinc/36/36/58/1120363658.db2.gz NSZINHNFPGZXDJ-LBPRGKRZSA-N 1 0 274.320 3.655 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000312630792 1120370431 /nfs/dbraw/zinc/37/04/31/1120370431.db2.gz YFFTYEUFIHQVAS-LLVKDONJSA-N 1 0 280.343 3.792 20 5 CHBDRO CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000068592616 1120478772 /nfs/dbraw/zinc/47/87/72/1120478772.db2.gz VUZCAKODVDYGFT-JSGCOSHPSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@H](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000070112281 1120528106 /nfs/dbraw/zinc/52/81/06/1120528106.db2.gz WSVTZAUYTFNXFE-CORIIIEPSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1F ZINC000922538631 1120549309 /nfs/dbraw/zinc/54/93/09/1120549309.db2.gz UKBMIEFTIGFHGG-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO COCC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000508992801 1120577736 /nfs/dbraw/zinc/57/77/36/1120577736.db2.gz BSKZILMATMIKQE-DOMZBBRYSA-N 1 0 294.395 3.697 20 5 CHBDRO C[C@H](C[N@H+](C)Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000066853534 1120595316 /nfs/dbraw/zinc/59/53/16/1120595316.db2.gz HSAQBXUTDARBIR-GFCCVEGCSA-N 1 0 290.388 3.892 20 5 CHBDRO Cc1cc(N2C[C@@H]3CCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302107826 1120648088 /nfs/dbraw/zinc/64/80/88/1120648088.db2.gz YFIVIYKWPYGDRI-BETUJISGSA-N 1 0 297.358 3.688 20 5 CHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000313155921 1120683237 /nfs/dbraw/zinc/68/32/37/1120683237.db2.gz HCMNCKOGPVGODB-CYBMUJFWSA-N 1 0 276.380 3.901 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C/C=C\C1CC1 ZINC001117745257 1120702147 /nfs/dbraw/zinc/70/21/47/1120702147.db2.gz KAUJQTCLIZKLSG-SJTVSNAISA-N 1 0 272.348 3.554 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC2(C)C)cc1[N+](=O)[O-] ZINC000222029344 1120961530 /nfs/dbraw/zinc/96/15/30/1120961530.db2.gz WBFTXMDZMYINBD-DGCLKSJQSA-N 1 0 262.353 3.600 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CSC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000354019483 1121019087 /nfs/dbraw/zinc/01/90/87/1121019087.db2.gz YVWJWEDDEIXNOT-TUKIKUTGSA-N 1 0 294.420 3.777 20 5 CHBDRO CC(C)([NH2+][C@H]1C=CCCC1)c1ccccc1[N+](=O)[O-] ZINC000429228768 1121133853 /nfs/dbraw/zinc/13/38/53/1121133853.db2.gz FLBNOFMJOWSMQK-LBPRGKRZSA-N 1 0 260.337 3.528 20 5 CHBDRO CC(C)([NH2+][C@@H]1C=CCCC1)c1ccccc1[N+](=O)[O-] ZINC000429228767 1121134277 /nfs/dbraw/zinc/13/42/77/1121134277.db2.gz FLBNOFMJOWSMQK-GFCCVEGCSA-N 1 0 260.337 3.528 20 5 CHBDRO C/C=C/C[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001175043990 1121157523 /nfs/dbraw/zinc/15/75/23/1121157523.db2.gz AYAJJOMMZZCGOK-WOMSROEHSA-N 1 0 288.391 3.816 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1CC[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000512226840 1121210623 /nfs/dbraw/zinc/21/06/23/1121210623.db2.gz PPUZFKZKKWAZLO-UKRRQHHQSA-N 1 0 276.380 3.901 20 5 CHBDRO COc1cc(C[NH+]2CCCCCCC2)c([N+](=O)[O-])cc1F ZINC000766109837 1121264169 /nfs/dbraw/zinc/26/41/69/1121264169.db2.gz YHEWHYLYOIOOCR-UHFFFAOYSA-N 1 0 296.342 3.509 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1CC(C)C ZINC000500483495 1121285569 /nfs/dbraw/zinc/28/55/69/1121285569.db2.gz YIZWCPRBOGZSCU-AWEZNQCLSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000042977624 1121321694 /nfs/dbraw/zinc/32/16/94/1121321694.db2.gz REJQLWNFJZFPQO-UHFFFAOYSA-N 1 0 270.332 3.535 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCSC2)cc1[N+](=O)[O-] ZINC000704771537 1121367325 /nfs/dbraw/zinc/36/73/25/1121367325.db2.gz MTIVPAPWYGPPKW-QWHCGFSZSA-N 1 0 294.420 3.697 20 5 CHBDRO CC[C@H](C)C[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000509377979 1121559712 /nfs/dbraw/zinc/55/97/12/1121559712.db2.gz GZKWOTGRBCCWCN-JWJUJFCLSA-N 1 0 262.353 3.586 20 5 CHBDRO CC[C@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433144263 1121591021 /nfs/dbraw/zinc/59/10/21/1121591021.db2.gz BPPFHBLVBHHZND-IINYFYTJSA-N 1 0 262.353 3.705 20 5 CHBDRO CC1(C)CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000061819900 1121600615 /nfs/dbraw/zinc/60/06/15/1121600615.db2.gz PDJKCMJIBMHRJL-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO CC1(C)C[C@@H]([NH2+]CC2CCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433174293 1121605950 /nfs/dbraw/zinc/60/59/50/1121605950.db2.gz MRUQLBCEANDOMF-OAHLLOKOSA-N 1 0 274.364 3.707 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000611299772 1121636879 /nfs/dbraw/zinc/63/68/79/1121636879.db2.gz FUVYCUBLECBRRC-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@@H](OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000611337071 1121637857 /nfs/dbraw/zinc/63/78/57/1121637857.db2.gz OKQKYYOOJUFPSJ-IMJJTQAJSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1sccc1[N+](=O)[O-] ZINC000611411033 1121644974 /nfs/dbraw/zinc/64/49/74/1121644974.db2.gz MSCDOINTKKJWRX-NSHDSACASA-N 1 0 285.413 3.579 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000611475896 1121651564 /nfs/dbraw/zinc/65/15/64/1121651564.db2.gz OOGYUPNFHQFALH-GHMZBOCLSA-N 1 0 284.306 3.742 20 5 CHBDRO C[C@@H](CC[NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000052329900 1121702075 /nfs/dbraw/zinc/70/20/75/1121702075.db2.gz RQOJPLDCJHTFNV-AWEZNQCLSA-N 1 0 284.359 3.878 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000037775540 1129011743 /nfs/dbraw/zinc/01/17/43/1129011743.db2.gz CGPBFYPFPMDIHA-SNVBAGLBSA-N 1 0 262.334 3.507 20 5 CHBDRO CC(C)[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CCCC1 ZINC000731030221 1121843312 /nfs/dbraw/zinc/84/33/12/1121843312.db2.gz LWRJXBBMQVLZQO-UHFFFAOYSA-N 1 0 280.343 3.887 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000149809668 1121843859 /nfs/dbraw/zinc/84/38/59/1121843859.db2.gz GHOMDPCLYJMDSB-AWEZNQCLSA-N 1 0 276.380 3.962 20 5 CHBDRO Cc1ccc(CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC001179111417 1121852275 /nfs/dbraw/zinc/85/22/75/1121852275.db2.gz ZMCFYZZIPGNFDY-UHFFFAOYSA-N 1 0 298.386 3.852 20 5 CHBDRO C[C@@H](C[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000619843871 1129015587 /nfs/dbraw/zinc/01/55/87/1129015587.db2.gz YIRDIEXYRFSBIW-LBPRGKRZSA-N 1 0 264.369 3.709 20 5 CHBDRO CC[C@H](C)C[N@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180261873 1121970164 /nfs/dbraw/zinc/97/01/64/1121970164.db2.gz CBWTYKFGXPJLBK-NSHDSACASA-N 1 0 264.369 3.690 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@@H]1C ZINC000501927172 1122024183 /nfs/dbraw/zinc/02/41/83/1122024183.db2.gz JQOIBTKJTVYSBP-SWLSCSKDSA-N 1 0 292.379 3.660 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001307450519 1122075526 /nfs/dbraw/zinc/07/55/26/1122075526.db2.gz NNHILEBXVIYHBT-HNNXBMFYSA-N 1 0 276.380 3.914 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C1(C)CC1 ZINC000774282305 1122153012 /nfs/dbraw/zinc/15/30/12/1122153012.db2.gz DBUQJLIWPULVSK-NHYWBVRUSA-N 1 0 274.364 3.750 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCC23CC3)cc1Cl ZINC001183239648 1122213998 /nfs/dbraw/zinc/21/39/98/1122213998.db2.gz YNUYJXIBNXGJET-CYBMUJFWSA-N 1 0 280.755 3.671 20 5 CHBDRO CCC[C@H](C)CC[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC001183572158 1122229674 /nfs/dbraw/zinc/22/96/74/1122229674.db2.gz LKPUHMQZYAPZQR-NSHDSACASA-N 1 0 268.332 3.650 20 5 CHBDRO CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC001183652524 1122233500 /nfs/dbraw/zinc/23/35/00/1122233500.db2.gz RTDHVHWBAIQMOM-DYEKYZERSA-N 1 0 262.353 3.680 20 5 CHBDRO CC1=CC[C@H]([NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC001184046138 1122254110 /nfs/dbraw/zinc/25/41/10/1122254110.db2.gz UTRMQJPZMHXVTB-KGLIPLIRSA-N 1 0 274.364 3.787 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000503938128 1122279803 /nfs/dbraw/zinc/27/98/03/1122279803.db2.gz RDOOSGAUKGQOOP-SGMGOOAPSA-N 1 0 292.379 3.833 20 5 CHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000515433676 1122499507 /nfs/dbraw/zinc/49/95/07/1122499507.db2.gz XLCAUIHHHJTAOA-MISXGVKJSA-N 1 0 262.353 3.606 20 5 CHBDRO CC[C@H](CSC)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000183521968 1129059523 /nfs/dbraw/zinc/05/95/23/1129059523.db2.gz WGQVQVWXVMBZSU-NWDGAFQWSA-N 1 0 282.409 3.695 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001167960564 1122525460 /nfs/dbraw/zinc/52/54/60/1122525460.db2.gz UZLIWNSDHNPNTM-GFCCVEGCSA-N 1 0 280.343 3.746 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC=C(C)C1 ZINC000436274108 1122532668 /nfs/dbraw/zinc/53/26/68/1122532668.db2.gz XRKUNYYDERWWOA-CYBMUJFWSA-N 1 0 260.337 3.616 20 5 CHBDRO Cc1c(C[NH2+][C@H](c2ccccn2)C(C)C)cccc1[N+](=O)[O-] ZINC000775448931 1122590619 /nfs/dbraw/zinc/59/06/19/1122590619.db2.gz MEVHIQZCOIDDNP-KRWDZBQOSA-N 1 0 299.374 3.785 20 5 CHBDRO Cc1cccc(CN(C)Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000505912734 1122600448 /nfs/dbraw/zinc/60/04/48/1122600448.db2.gz NZTMPZOZNMVCGM-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO CCC[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001191986089 1122623483 /nfs/dbraw/zinc/62/34/83/1122623483.db2.gz IWDNXXQUHHNSJR-HNNXBMFYSA-N 1 0 276.380 3.649 20 5 CHBDRO CC1=CCC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000437339248 1122628394 /nfs/dbraw/zinc/62/83/94/1122628394.db2.gz BTFPOMZRDQPPKT-UHFFFAOYSA-N 1 0 274.364 3.870 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426488825 1122804924 /nfs/dbraw/zinc/80/49/24/1122804924.db2.gz XYWRPEXWKYCUAJ-MFKMUULPSA-N 1 0 280.755 3.623 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]3CCC[C@@H]32)c(Cl)c1 ZINC000426525042 1122813965 /nfs/dbraw/zinc/81/39/65/1122813965.db2.gz QCDTYULCFMMBKH-HZMBPMFUSA-N 1 0 280.755 3.623 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]3CCC[C@@H]32)c(Cl)c1 ZINC000426525048 1122814280 /nfs/dbraw/zinc/81/42/80/1122814280.db2.gz QCDTYULCFMMBKH-YGRLFVJLSA-N 1 0 280.755 3.623 20 5 CHBDRO CC(C)[C@@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507187520 1122845431 /nfs/dbraw/zinc/84/54/31/1122845431.db2.gz KUCUGMFMZULRPZ-KKTNHOPESA-N 1 0 274.364 3.728 20 5 CHBDRO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCC[C@@H]1C(C)(C)C ZINC001195279149 1122860023 /nfs/dbraw/zinc/86/00/23/1122860023.db2.gz NAKHHFBUDJJEIB-KBPBESRZSA-N 1 0 291.395 3.636 20 5 CHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000543556615 1122885919 /nfs/dbraw/zinc/88/59/19/1122885919.db2.gz GKJRGRMBXOIPOK-LBPRGKRZSA-N 1 0 268.382 3.811 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CC3)s2)cc1 ZINC000102419051 1122919299 /nfs/dbraw/zinc/91/92/99/1122919299.db2.gz JAUNPALSALZOMN-UHFFFAOYSA-N 1 0 274.345 3.575 20 5 CHBDRO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000507233720 1122942229 /nfs/dbraw/zinc/94/22/29/1122942229.db2.gz VUWMGHHZCKAIDF-UHFFFAOYSA-N 1 0 286.331 3.839 20 5 CHBDRO CCCCC1([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC001198550915 1122999687 /nfs/dbraw/zinc/99/96/87/1122999687.db2.gz AFCSSCDQRLNEMG-UHFFFAOYSA-N 1 0 266.316 3.546 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccsc1 ZINC000052926140 1123061706 /nfs/dbraw/zinc/06/17/06/1123061706.db2.gz BQPBGPQSCDJABN-JTQLQIEISA-N 1 0 262.334 3.507 20 5 CHBDRO Cc1cc(C)cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000052926249 1123061541 /nfs/dbraw/zinc/06/15/41/1123061541.db2.gz SIURRMJOAUUHBX-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2C=CCC2)cc1[N+](=O)[O-] ZINC000850358098 1123255544 /nfs/dbraw/zinc/25/55/44/1123255544.db2.gz GTXZKMYFYFBGRD-ZDUSSCGKSA-N 1 0 260.337 3.526 20 5 CHBDRO Cc1cc(O[C@@H](C)C[N+](C)(C)C)c(C(C)C)cc1N=O ZINC001226737381 1123304703 /nfs/dbraw/zinc/30/47/03/1123304703.db2.gz ZLFXYKWHQOZKQU-ZDUSSCGKSA-N 1 0 279.404 3.990 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1C ZINC000252121434 1123329489 /nfs/dbraw/zinc/32/94/89/1123329489.db2.gz JKNWDXIKNWROJR-MNOVXSKESA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@H]1CCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1C ZINC000252121436 1123330024 /nfs/dbraw/zinc/33/00/24/1123330024.db2.gz JKNWDXIKNWROJR-QWRGUYRKSA-N 1 0 282.771 3.869 20 5 CHBDRO CC[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)F ZINC000852097627 1123397488 /nfs/dbraw/zinc/39/74/88/1123397488.db2.gz YBXMHHQKHLNGRO-QWRGUYRKSA-N 1 0 286.322 3.927 20 5 CHBDRO CS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000219182969 1123435505 /nfs/dbraw/zinc/43/55/05/1123435505.db2.gz IKWBKGRBVIHXKU-UKRRQHHQSA-N 1 0 294.420 3.667 20 5 CHBDRO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCC1CC1 ZINC000544940784 1123505521 /nfs/dbraw/zinc/50/55/21/1123505521.db2.gz UAPYKTQHRZWBPE-FNORWQNLSA-N 1 0 274.364 3.730 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C2(Cl)CC2)cc1[N+](=O)[O-] ZINC000925490858 1123571889 /nfs/dbraw/zinc/57/18/89/1123571889.db2.gz CVDRFDXLZCNDDA-GHMZBOCLSA-N 1 0 282.771 3.714 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000522713142 1123719704 /nfs/dbraw/zinc/71/97/04/1123719704.db2.gz SFZLONBKFORBTH-ZDUSSCGKSA-N 1 0 292.379 3.616 20 5 CHBDRO CC[C@@H](C)C[C@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000088297609 1124005365 /nfs/dbraw/zinc/00/53/65/1124005365.db2.gz SCBDJBIRBSPMER-NEPJUHHUSA-N 1 0 280.368 3.518 20 5 CHBDRO Cc1cccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1F ZINC000865788095 1124014553 /nfs/dbraw/zinc/01/45/53/1124014553.db2.gz YOEKLTGHXVSKLN-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000034995607 1124021273 /nfs/dbraw/zinc/02/12/73/1124021273.db2.gz NMCPDXOSADIIQD-BXUZGUMPSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@H]1CCCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000088507307 1124061528 /nfs/dbraw/zinc/06/15/28/1124061528.db2.gz HKYHIRVTPWDDHJ-WFASDCNBSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC[C@@H]2CCSC2)cccc1[N+](=O)[O-] ZINC000866402520 1124062952 /nfs/dbraw/zinc/06/29/52/1124062952.db2.gz MHMGLEUEUMGZGO-CHWSQXEVSA-N 1 0 294.420 3.697 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000035010002 1124127728 /nfs/dbraw/zinc/12/77/28/1124127728.db2.gz CCXVCVGOTGIGFA-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO COc1ccc(C[N@@H+]2C[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000525637970 1124451324 /nfs/dbraw/zinc/45/13/24/1124451324.db2.gz MRVFYOWGTOFCKZ-OLZOCXBDSA-N 1 0 292.379 3.614 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCC1CC1 ZINC000441254030 1124468364 /nfs/dbraw/zinc/46/83/64/1124468364.db2.gz LYRBNHUJXYZTQA-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO CC[C@@H]([NH2+]C1CC2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000448064668 1124561696 /nfs/dbraw/zinc/56/16/96/1124561696.db2.gz PICBLULNOYCCNX-OAHLLOKOSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@@H]([NH2+]CC1CCSCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872033800 1124661655 /nfs/dbraw/zinc/66/16/55/1124661655.db2.gz GDGQIXFEAJKZAS-SNVBAGLBSA-N 1 0 298.383 3.528 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC(F)(F)C1 ZINC000449189125 1124664263 /nfs/dbraw/zinc/66/42/63/1124664263.db2.gz OXDLRBDTLATWEU-YPMHNXCESA-N 1 0 298.333 3.693 20 5 CHBDRO CSC1(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])CCC1 ZINC000872068451 1124673634 /nfs/dbraw/zinc/67/36/34/1124673634.db2.gz XRMDTHMAJMFLKR-SNVBAGLBSA-N 1 0 298.383 3.670 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[C@H](C)F ZINC000872074034 1124675580 /nfs/dbraw/zinc/67/55/80/1124675580.db2.gz VAJKNNFYKAUTRW-UWVGGRQHSA-N 1 0 286.372 3.715 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CC12CC2 ZINC000872081705 1124677042 /nfs/dbraw/zinc/67/70/42/1124677042.db2.gz JIYDBNHYMWJAKW-ZANVPECISA-N 1 0 278.377 3.520 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1c(F)cccc1[N+](=O)[O-] ZINC000872080424 1124677054 /nfs/dbraw/zinc/67/70/54/1124677054.db2.gz XGKIERMHCFTWLF-HNCHTBHHSA-N 1 0 278.327 3.573 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)CC(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872081067 1124677356 /nfs/dbraw/zinc/67/73/56/1124677356.db2.gz FOBHAUZXTCCGPL-DTWKUNHWSA-N 1 0 290.285 3.676 20 5 CHBDRO C[C@@H]([NH2+]CCC(C)(C)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872085954 1124679642 /nfs/dbraw/zinc/67/96/42/1124679642.db2.gz RFFIYXAJKJJLAX-SECBINFHSA-N 1 0 272.295 3.523 20 5 CHBDRO CC[NH+](CC)CC[C@H](C)Nc1ccc([N+](=O)[O-])cc1Cl ZINC001121180642 1131291289 /nfs/dbraw/zinc/29/12/89/1131291289.db2.gz DRHGLXFFDRUZAD-NSHDSACASA-N 1 0 299.802 3.781 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1C[C@H]1C1CC1 ZINC000449739435 1124858388 /nfs/dbraw/zinc/85/83/88/1124858388.db2.gz AHRAHFQXNQKFQD-FQGYXVRMSA-N 1 0 286.375 3.634 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000129919532 1124914442 /nfs/dbraw/zinc/91/44/42/1124914442.db2.gz UGXYSEHFPVBYIX-XHDPSFHLSA-N 1 0 262.353 3.682 20 5 CHBDRO CSC(C)(C)CC[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000877130847 1125013657 /nfs/dbraw/zinc/01/36/57/1125013657.db2.gz PAMKTOQZRHDISZ-NSHDSACASA-N 1 0 282.409 3.777 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC1(C)CC1 ZINC000530465192 1125157199 /nfs/dbraw/zinc/15/71/99/1125157199.db2.gz JAMSWCISNSQJGC-LBPRGKRZSA-N 1 0 262.353 3.744 20 5 CHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2(C3CC3)CC2)o1 ZINC000532373636 1125257442 /nfs/dbraw/zinc/25/74/42/1125257442.db2.gz VGYUFHDJJPGZQC-UHFFFAOYSA-N 1 0 298.342 3.887 20 5 CHBDRO CC[C@@H](C)[C@@H](C)[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520590530 1125353807 /nfs/dbraw/zinc/35/38/07/1125353807.db2.gz LIGHQTXNIJNEPO-CHWSQXEVSA-N 1 0 276.380 3.994 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000169058569 1125369758 /nfs/dbraw/zinc/36/97/58/1125369758.db2.gz VWTJXGIBBKPULH-MRXNPFEDSA-N 1 0 288.322 3.975 20 5 CHBDRO C[C@H](c1ccccc1F)N(C)Cc1ccc([N+](=O)[O-])cc1 ZINC000052074199 1125373995 /nfs/dbraw/zinc/37/39/95/1125373995.db2.gz VAHUDPCFCQIBGW-GFCCVEGCSA-N 1 0 288.322 3.927 20 5 CHBDRO C[C@H]([N@H+](C)CCc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000532491071 1125407721 /nfs/dbraw/zinc/40/77/21/1125407721.db2.gz WQMXURBVVLFVNA-LBPRGKRZSA-N 1 0 264.369 3.504 20 5 CHBDRO Cc1ccccc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037718995 1129210078 /nfs/dbraw/zinc/21/00/78/1129210078.db2.gz QLSAZAUTQUSWHT-UHFFFAOYSA-N 1 0 290.750 3.846 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000037775523 1129268520 /nfs/dbraw/zinc/26/85/20/1129268520.db2.gz FDSYAVUDGYMTSE-SNVBAGLBSA-N 1 0 292.285 3.724 20 5 CHBDRO Cc1ccccc1C[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037777187 1129268524 /nfs/dbraw/zinc/26/85/24/1129268524.db2.gz HZXIURACCIROBD-GFCCVEGCSA-N 1 0 290.388 3.686 20 5 CHBDRO CC1(C)CCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000094324346 1129442961 /nfs/dbraw/zinc/44/29/61/1129442961.db2.gz UHFDSCPCBKHCFU-ZDUSSCGKSA-N 1 0 282.771 3.917 20 5 CHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)C1CCCCC1 ZINC000302809396 1129502897 /nfs/dbraw/zinc/50/28/97/1129502897.db2.gz KICOZZLOWZLLDS-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO CC(C)=CCC/C(C)=C/C[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168979517 1129686926 /nfs/dbraw/zinc/68/69/26/1129686926.db2.gz YXWKEQNLMYOYAM-BNSCMJDNSA-N 1 0 280.412 3.714 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cc(C)cc(C)c1 ZINC001169001883 1129689090 /nfs/dbraw/zinc/68/90/90/1129689090.db2.gz IHXIAIMNCGBEDG-PVAVHDDUSA-N 1 0 290.407 3.790 20 5 CHBDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169012541 1129690022 /nfs/dbraw/zinc/69/00/22/1129690022.db2.gz QXBXTIXSMMUYRF-INMHGKMJSA-N 1 0 288.391 3.577 20 5 CHBDRO CC[C@H](C)C1CCC([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001168988876 1129690192 /nfs/dbraw/zinc/69/01/92/1129690192.db2.gz ULVMCDWQWICQCX-SXDHFHGXSA-N 1 0 282.428 3.626 20 5 CHBDRO CC[N@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169039778 1129690427 /nfs/dbraw/zinc/69/04/27/1129690427.db2.gz TWABAGUDJOHTAM-UKRRQHHQSA-N 1 0 296.798 3.607 20 5 CHBDRO C[N@H+](Cc1cccc2ccccc21)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169023259 1129691419 /nfs/dbraw/zinc/69/14/19/1129691419.db2.gz DVLVVPWEWHUEEV-RHSMWYFYSA-N 1 0 298.386 3.717 20 5 CHBDRO C[N@H+](CCCC(C)(C)C)CCc1cccc([N+](=O)[O-])c1 ZINC001169666371 1129744834 /nfs/dbraw/zinc/74/48/34/1129744834.db2.gz LCMYHTFFADYLCD-UHFFFAOYSA-N 1 0 278.396 3.895 20 5 CHBDRO Cc1ccc(C[N@@H+](CC2CCC2)C(C)C)cc1[N+](=O)[O-] ZINC001169822760 1129758952 /nfs/dbraw/zinc/75/89/52/1129758952.db2.gz WZMHBBDKKHWAMI-UHFFFAOYSA-N 1 0 276.380 3.914 20 5 CHBDRO Cc1ccc(C[NH+]2CCCCCCC2)cc1[N+](=O)[O-] ZINC000768145081 1129834028 /nfs/dbraw/zinc/83/40/28/1129834028.db2.gz WZMRQPYOIADYBW-UHFFFAOYSA-N 1 0 262.353 3.669 20 5 CHBDRO CNc1ccc(C)cc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000902573971 1130027336 /nfs/dbraw/zinc/02/73/36/1130027336.db2.gz DKCPPOLIBDUGCL-ZDUSSCGKSA-N 1 0 299.374 3.796 20 5 CHBDRO CCO[C@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000903086280 1130110379 /nfs/dbraw/zinc/11/03/79/1130110379.db2.gz FRPXFOOLEKAFMI-MJBXVCDLSA-N 1 0 292.379 3.593 20 5 CHBDRO COc1cc([C@H](C)[NH2+]CCC2(F)CCC2)cc([N+](=O)[O-])c1 ZINC000903169703 1130122943 /nfs/dbraw/zinc/12/29/43/1130122943.db2.gz DDAMKLLVLAXXQC-NSHDSACASA-N 1 0 296.342 3.536 20 5 CHBDRO C[C@H]1CC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000786930459 1130124154 /nfs/dbraw/zinc/12/41/54/1130124154.db2.gz IZVYEOKXKXIDIR-UFBFGSQYSA-N 1 0 288.269 3.502 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1cscn1)c1ccccc1[N+](=O)[O-] ZINC000903246863 1130135819 /nfs/dbraw/zinc/13/58/19/1130135819.db2.gz XWXCYUWSYNWMAO-MNOVXSKESA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000903282338 1130145165 /nfs/dbraw/zinc/14/51/65/1130145165.db2.gz CQNDJWGAGDPHLU-DGCLKSJQSA-N 1 0 294.420 3.920 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C)SC1)c1ccc([N+](=O)[O-])cc1 ZINC000903288593 1130146512 /nfs/dbraw/zinc/14/65/12/1130146512.db2.gz ZYBHVGFZJPDFSV-DMDPSCGWSA-N 1 0 280.393 3.530 20 5 CHBDRO Cc1cncc([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000903287853 1130146604 /nfs/dbraw/zinc/14/66/04/1130146604.db2.gz RHGMTFDYKGCOHI-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO COC1(C[C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000903288322 1130146675 /nfs/dbraw/zinc/14/66/75/1130146675.db2.gz XMZQPLYMCLUMAU-QWHCGFSZSA-N 1 0 292.379 3.593 20 5 CHBDRO CCC[NH+](CCC)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170327250 1130481604 /nfs/dbraw/zinc/48/16/04/1130481604.db2.gz GJYAPTMFUXBGBR-CYBMUJFWSA-N 1 0 294.395 3.656 20 5 CHBDRO CCCC[N@H+](CC)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329557 1130482976 /nfs/dbraw/zinc/48/29/76/1130482976.db2.gz RIQSEGHULUTKSJ-ZDUSSCGKSA-N 1 0 294.395 3.656 20 5 CHBDRO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC1CCC1 ZINC000793351757 1130549347 /nfs/dbraw/zinc/54/93/47/1130549347.db2.gz GMNWMPOFXDVADZ-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000784388952 1130903133 /nfs/dbraw/zinc/90/31/33/1130903133.db2.gz BDELDNHFWATTCO-GFCCVEGCSA-N 1 0 278.327 3.522 20 5 CHBDRO c1cc2ccc3ccc(CN4CC[NH2+]C4)c4ccc(c1)c2c34 ZINC001236842881 1131020646 /nfs/dbraw/zinc/02/06/46/1131020646.db2.gz BXKVRWQSNUTMCQ-UHFFFAOYSA-N 1 0 286.378 3.947 20 5 CHBDRO C[C@H](F)CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816643708 1131117150 /nfs/dbraw/zinc/11/71/50/1131117150.db2.gz NVFHZNQOOZHAKS-ZETCQYMHSA-N 1 0 295.141 3.739 20 5 CHBDRO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000816648931 1131120621 /nfs/dbraw/zinc/12/06/21/1131120621.db2.gz QWSOHKLWVIDRFC-NWDGAFQWSA-N 1 0 286.331 3.695 20 5 CHBDRO CCCC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001116196663 1131133188 /nfs/dbraw/zinc/13/31/88/1131133188.db2.gz OBXJNHIAKXPQRH-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(CF)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000830167603 1131447526 /nfs/dbraw/zinc/44/75/26/1131447526.db2.gz RRPDQVWRCUHBSS-LBPRGKRZSA-N 1 0 288.322 3.915 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000844440927 1131564352 /nfs/dbraw/zinc/56/43/52/1131564352.db2.gz WUDNGKNVWGRDLW-AWEZNQCLSA-N 1 0 296.317 3.524 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC2(CCC2)C1 ZINC000348191942 1131896191 /nfs/dbraw/zinc/89/61/91/1131896191.db2.gz GIPQHGGUBZJNNX-CYBMUJFWSA-N 1 0 274.364 3.922 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)c2ccc[nH]2)cccc1[N+](=O)[O-] ZINC000773116278 1131949043 /nfs/dbraw/zinc/94/90/43/1131949043.db2.gz INTDZUGNLWWYEW-NWDGAFQWSA-N 1 0 273.336 3.643 20 5 CHBDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000773123162 1131952666 /nfs/dbraw/zinc/95/26/66/1131952666.db2.gz ZUCCJQZDRVTQPG-GOSISDBHSA-N 1 0 296.370 3.723 20 5 CHBDRO CC(C)[C@H](C)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000036787258 1131975174 /nfs/dbraw/zinc/97/51/74/1131975174.db2.gz TUBALWQZXQFDBF-JTQLQIEISA-N 1 0 270.760 3.725 20 5 CHBDRO C[N@H+](Cc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000036964888 1131982895 /nfs/dbraw/zinc/98/28/95/1131982895.db2.gz MZSXROIZNBHIMR-UHFFFAOYSA-N 1 0 290.750 3.880 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccns2)cc1[N+](=O)[O-] ZINC000716055108 1132002800 /nfs/dbraw/zinc/00/28/00/1132002800.db2.gz NNJGBOPHYLFIBB-WDEREUQCSA-N 1 0 291.376 3.772 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000037176957 1132007156 /nfs/dbraw/zinc/00/71/56/1132007156.db2.gz IHKCDQQEGUEWQI-TYNCELHUSA-N 1 0 262.353 3.824 20 5 CHBDRO C[N@H+](CC1CCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910451 1132347507 /nfs/dbraw/zinc/34/75/07/1132347507.db2.gz AAKAKLKSLMOWNC-MRXNPFEDSA-N 1 0 288.391 3.574 20 5 CHBDRO CC[C@H](C)[N@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172906302 1132348338 /nfs/dbraw/zinc/34/83/38/1132348338.db2.gz XAQBKBACKQGTJS-SWLSCSKDSA-N 1 0 276.380 3.573 20 5 CHBDRO CCC(CC)C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172896041 1132360677 /nfs/dbraw/zinc/36/06/77/1132360677.db2.gz LELUNMXVNQHCGL-MRXNPFEDSA-N 1 0 290.407 3.868 20 5 CHBDRO CC[C@H](C)C[C@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173218571 1132411271 /nfs/dbraw/zinc/41/12/71/1132411271.db2.gz QQFZUYPQJRSTRN-IHRRRGAJSA-N 1 0 278.396 3.940 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1C[C@H]1c1ccccc1 ZINC001173236317 1132411857 /nfs/dbraw/zinc/41/18/57/1132411857.db2.gz ZSWQWTNTKWSNAQ-JEBQAFNWSA-N 1 0 296.370 3.672 20 5 CHBDRO CCCCC[N@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225898 1132412352 /nfs/dbraw/zinc/41/23/52/1132412352.db2.gz KEJQYBMZUPBNKX-ZDUSSCGKSA-N 1 0 264.369 3.648 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC001173233057 1132413792 /nfs/dbraw/zinc/41/37/92/1132413792.db2.gz GVIMSCXHIPLRFB-DYVFJYSZSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC1CCCC1 ZINC001173235666 1132415122 /nfs/dbraw/zinc/41/51/22/1132415122.db2.gz YKAUQLIBNRDLHL-CYBMUJFWSA-N 1 0 276.380 3.648 20 5 CHBDRO CCC(CC)C[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173209460 1132416197 /nfs/dbraw/zinc/41/61/97/1132416197.db2.gz CCOASWIKONQGEG-LBPRGKRZSA-N 1 0 264.369 3.552 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCC(F)(F)C1 ZINC001173220452 1132416810 /nfs/dbraw/zinc/41/68/10/1132416810.db2.gz AKBVIOQUGSXMLG-AAEUAGOBSA-N 1 0 298.333 3.693 20 5 CHBDRO CCc1ccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173214788 1132416859 /nfs/dbraw/zinc/41/68/59/1132416859.db2.gz QDQAJIZSDKEZHQ-CQSZACIVSA-N 1 0 298.386 3.878 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCC1 ZINC000096554847 1132498932 /nfs/dbraw/zinc/49/89/32/1132498932.db2.gz GIRBWLLZBHLJEK-SNVBAGLBSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1cc(Nc2cccc3nc4ccccc4nc32)cc[nH+]1 ZINC001174656204 1132951422 /nfs/dbraw/zinc/95/14/22/1132951422.db2.gz GWPHBPONRWYRJX-UHFFFAOYSA-N 1 0 286.338 3.652 20 5 CHBDRO C[C@H](C[NH+](C)C)Nc1ccc(-c2ccc([N+](=O)[O-])cc2)cc1 ZINC001163782222 1133174826 /nfs/dbraw/zinc/17/48/26/1133174826.db2.gz CWKQUBWMXHBMEH-CYBMUJFWSA-N 1 0 299.374 3.624 20 5 CHBDRO C[C@H](C[NH+](C)C)Nc1nc2ccccc2c2ccccc21 ZINC001163787162 1133175638 /nfs/dbraw/zinc/17/56/38/1133175638.db2.gz ZRKFBVJUJQTNKF-CYBMUJFWSA-N 1 0 279.387 3.750 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCCC12CC2 ZINC001203331861 1133316492 /nfs/dbraw/zinc/31/64/92/1133316492.db2.gz IQGACTUXOQUYSS-ISBHARSQSA-N 1 0 286.375 3.920 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC(C)(C)CC1 ZINC001204533601 1133459651 /nfs/dbraw/zinc/45/96/51/1133459651.db2.gz ITRMHTDMTPWASL-UHFFFAOYSA-N 1 0 276.380 3.834 20 5 CHBDRO CC(C)(C)[C@H]1CCC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC001206248154 1133676042 /nfs/dbraw/zinc/67/60/42/1133676042.db2.gz RTONEEKDSLYHOS-HOTGVXAUSA-N 1 0 290.407 3.942 20 5 CHBDRO Cc1ccc(Nc2ccc(C[NH+](C)C)cc2)c([N+](=O)[O-])c1 ZINC001214171373 1134515408 /nfs/dbraw/zinc/51/54/08/1134515408.db2.gz DUPBDWSUTRIOMY-UHFFFAOYSA-N 1 0 285.347 3.708 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)c1 ZINC000403451421 1134781952 /nfs/dbraw/zinc/78/19/52/1134781952.db2.gz YHTPOCMDMGVLAS-JBLDHEPKSA-N 1 0 280.755 3.526 20 5 CHBDRO C[C@H]1CCCC[C@]1(C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000308717872 1134978566 /nfs/dbraw/zinc/97/85/66/1134978566.db2.gz YHJNOFPGDSLTKO-WFASDCNBSA-N 1 0 262.353 3.653 20 5 CHBDRO C[NH2+][C@H]1C[C@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001217950967 1135031011 /nfs/dbraw/zinc/03/10/11/1135031011.db2.gz NTFKCHILNUQPCI-SHTZXODSSA-N 1 0 278.355 3.517 20 5 CHBDRO Oc1c2ccccc2c(O[C@@H]2CCC[NH2+]C2)c2ccccc12 ZINC001217962562 1135031619 /nfs/dbraw/zinc/03/16/19/1135031619.db2.gz YOGQEUJRVVOJHM-CYBMUJFWSA-N 1 0 293.366 3.829 20 5 CHBDRO C[C@@H]1CC[NH2+]C[C@H]1Oc1cccc2cc3ccccc3nc21 ZINC001218044548 1135048792 /nfs/dbraw/zinc/04/87/92/1135048792.db2.gz WBSCMWSMKDFAGI-FZKQIMNGSA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@@H]1C[C@H](Oc2cccc3cc4ccccc4nc32)C[NH2+]1 ZINC001218046465 1135049058 /nfs/dbraw/zinc/04/90/58/1135049058.db2.gz QPHASOSGUGZUEN-DOMZBBRYSA-N 1 0 278.355 3.517 20 5 CHBDRO C[C@@H]1C[C@@H](Oc2nccc3c4ccccc4ccc32)CC[NH2+]1 ZINC001218061326 1135052519 /nfs/dbraw/zinc/05/25/19/1135052519.db2.gz PKNDFVVHIMRFFC-HIFRSBDPSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H]1CC[C@@H](Oc2cccc3ccc4cccnc4c32)C[NH2+]1 ZINC001218399393 1135099561 /nfs/dbraw/zinc/09/95/61/1135099561.db2.gz PQYCIXSSVHKXIV-XJKSGUPXSA-N 1 0 292.382 3.907 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccccc2C2CC2)cc1 ZINC000316962275 1135170480 /nfs/dbraw/zinc/17/04/80/1135170480.db2.gz ITTNHEUJCFCBAG-UHFFFAOYSA-N 1 0 296.370 3.805 20 5 CHBDRO C[C@@H](O[C@H]1CC[C@H]([NH+](C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC001223432525 1135344906 /nfs/dbraw/zinc/34/49/06/1135344906.db2.gz VIZPBSJINYYFAP-XNRPHZJLSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@H](C[N+](C)(C)C)O[C@@H](C)c1ccc(Cl)cc1 ZINC001223961551 1135402838 /nfs/dbraw/zinc/40/28/38/1135402838.db2.gz BIJJGBHZVAMMOA-NEPJUHHUSA-N 1 0 256.797 3.512 20 5 CHBDRO Cc1ccc(-c2ccc(CO[C@H](C)C[N+](C)(C)C)cc2)nc1 ZINC001224150703 1135424833 /nfs/dbraw/zinc/42/48/33/1135424833.db2.gz ISQIUOURXGFHKB-MRXNPFEDSA-N 1 0 299.438 3.668 20 5 CHBDRO C[N@H+](CCCCOC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC000354863379 529884893 /nfs/dbraw/zinc/88/48/93/529884893.db2.gz IYLGZIPEWGZUQO-UHFFFAOYSA-N 1 0 294.395 3.622 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000573749727 334963683 /nfs/dbraw/zinc/96/36/83/334963683.db2.gz XHVGZGLDXYUQNW-AEGPPILISA-N 1 0 276.380 3.988 20 5 CHBDRO CSCCCCC[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574650676 335037375 /nfs/dbraw/zinc/03/73/75/335037375.db2.gz HECIYLXJWSYBEQ-CQSZACIVSA-N 1 0 294.420 3.705 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CC[C@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000574662216 335037933 /nfs/dbraw/zinc/03/79/33/335037933.db2.gz GKTAPTWOQKMOMQ-KGLIPLIRSA-N 1 0 276.380 3.818 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCC1CC1)CCC2 ZINC000575082267 335063145 /nfs/dbraw/zinc/06/31/45/335063145.db2.gz AOYASKSMHXYGSY-MRXNPFEDSA-N 1 0 274.364 3.752 20 5 CHBDRO CCC(C)(C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000035368054 172159952 /nfs/dbraw/zinc/15/99/52/172159952.db2.gz ZDAXZTOBJJBLRG-UHFFFAOYSA-N 1 0 256.733 3.526 20 5 CHBDRO CC(C)CCC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000038093591 174107635 /nfs/dbraw/zinc/10/76/35/174107635.db2.gz MYEMUQJEBKHDKZ-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO Cc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000037177090 260072954 /nfs/dbraw/zinc/07/29/54/260072954.db2.gz CXAPEVNUEGHIFV-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO O=[N+]([O-])c1cc(CN[C@H]2CSc3ccccc32)cs1 ZINC000344440598 225074931 /nfs/dbraw/zinc/07/49/31/225074931.db2.gz VFWBYDFIVMXHLC-NSHDSACASA-N 1 0 292.385 3.593 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000346978266 226002188 /nfs/dbraw/zinc/00/21/88/226002188.db2.gz IQHMAMPRQZPNGC-QGZVFWFLSA-N 1 0 297.358 3.635 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C[C@@H]3CC34CC4)o2)c1 ZINC000418101870 228042313 /nfs/dbraw/zinc/04/23/13/228042313.db2.gz UCSDZXOVGZXMKT-ZDUSSCGKSA-N 1 0 298.342 3.745 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](C)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000480666380 228055102 /nfs/dbraw/zinc/05/51/02/228055102.db2.gz ZYWSSKLVLLOUIJ-SCZZXKLOSA-N 1 0 290.285 3.752 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C(CC)CC)cc1[N+](=O)[O-] ZINC000179391097 260045936 /nfs/dbraw/zinc/04/59/36/260045936.db2.gz CCVVJOWHSXXAEB-LLVKDONJSA-N 1 0 280.368 3.833 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2CCCCCC2)cc1 ZINC000089559676 260187941 /nfs/dbraw/zinc/18/79/41/260187941.db2.gz JCKRYSPOIATKEC-UHFFFAOYSA-N 1 0 262.353 3.655 20 5 CHBDRO C[C@H]1CCC[C@H](C[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000089609121 260189939 /nfs/dbraw/zinc/18/99/39/260189939.db2.gz LNLBKOAWOWCMEC-ZFWWWQNUSA-N 1 0 276.380 3.553 20 5 CHBDRO CCC[C@H]([NH2+][C@@H](CC)[C@@H](O)CC)c1cccc([N+](=O)[O-])c1 ZINC000313163687 260255269 /nfs/dbraw/zinc/25/52/69/260255269.db2.gz RSVVMODHZFYUSR-JYJNAYRXSA-N 1 0 294.395 3.575 20 5 CHBDRO CCSCC[C@H](C)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449170155 260271031 /nfs/dbraw/zinc/27/10/31/260271031.db2.gz QHSAFPZLWSVBOY-STQMWFEESA-N 1 0 296.436 3.647 20 5 CHBDRO CCC[C@H]([NH2+]Cc1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000317599457 260284434 /nfs/dbraw/zinc/28/44/34/260284434.db2.gz NVMSFYUMPDBASY-KRWDZBQOSA-N 1 0 299.374 3.929 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCCC(F)(F)C1 ZINC000517962636 260327741 /nfs/dbraw/zinc/32/77/41/260327741.db2.gz YZWCAZCPVXXMKS-GWCFXTLKSA-N 1 0 296.317 3.750 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@H](C)SC)c1cccc([N+](=O)[O-])c1 ZINC000090724892 260393193 /nfs/dbraw/zinc/39/31/93/260393193.db2.gz KDRPHJTZWMNUJI-RISCZKNCSA-N 1 0 282.409 3.777 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCCSC1)c1cccc([N+](=O)[O-])c1 ZINC000132468641 260499510 /nfs/dbraw/zinc/49/95/10/260499510.db2.gz HNCBMWXYZWEPOZ-OCCSQVGLSA-N 1 0 280.393 3.531 20 5 CHBDRO Cc1ccc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)o1 ZINC000525708983 261055089 /nfs/dbraw/zinc/05/50/89/261055089.db2.gz ZZAULYQREGUIJY-UHFFFAOYSA-N 1 0 288.347 3.609 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000152367270 261063582 /nfs/dbraw/zinc/06/35/82/261063582.db2.gz ISVZQQVBVYSFPF-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000163766058 261328655 /nfs/dbraw/zinc/32/86/55/261328655.db2.gz YHIXHHNUJJFXNT-WBMJQRKESA-N 1 0 285.347 3.792 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@@H](C)C2(C)CC2)cccc1[N+](=O)[O-] ZINC000177243289 261341729 /nfs/dbraw/zinc/34/17/29/261341729.db2.gz BSZZDVGAOPWQFP-LBPRGKRZSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@H]([NH2+]CCC[C@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000183995675 262004898 /nfs/dbraw/zinc/00/48/98/262004898.db2.gz FVSBMLJBDJYTJA-XJKSGUPXSA-N 1 0 292.379 3.595 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525786413 262236032 /nfs/dbraw/zinc/23/60/32/262236032.db2.gz FTWMCLALEGCUAT-VNHYZAJKSA-N 1 0 274.364 3.748 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525786411 262236244 /nfs/dbraw/zinc/23/62/44/262236244.db2.gz FTWMCLALEGCUAT-NFAWXSAZSA-N 1 0 274.364 3.748 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCCC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000390899377 262359799 /nfs/dbraw/zinc/35/97/99/262359799.db2.gz GHNUEXXTXNLDNV-ZYHUDNBSSA-N 1 0 284.306 3.681 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1ccnc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000391167324 262385734 /nfs/dbraw/zinc/38/57/34/262385734.db2.gz JLPRYRDETSTCNG-QGZVFWFLSA-N 1 0 299.374 3.929 20 5 CHBDRO Cc1ccc(CNc2ccc([C@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000414812880 263053435 /nfs/dbraw/zinc/05/34/35/263053435.db2.gz PYMSVOAEGJYWGZ-LBPRGKRZSA-N 1 0 285.347 3.535 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)cs1 ZINC000282071862 263074127 /nfs/dbraw/zinc/07/41/27/263074127.db2.gz QPRGDZULAANOPP-SECBINFHSA-N 1 0 290.335 3.571 20 5 CHBDRO Cc1ccsc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000094259804 265232394 /nfs/dbraw/zinc/23/23/94/265232394.db2.gz OODLMHMASBNTNE-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO CC1(C)CCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000094324580 265237292 /nfs/dbraw/zinc/23/72/92/265237292.db2.gz ZTSQDBSFSNYVKF-ZDUSSCGKSA-N 1 0 282.771 3.917 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000537980709 327660559 /nfs/dbraw/zinc/66/05/59/327660559.db2.gz JIYFDCMVIVNFKC-WCFLWFBJSA-N 1 0 264.369 3.988 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000062726460 327894536 /nfs/dbraw/zinc/89/45/36/327894536.db2.gz OHRSFOSCPYNMJC-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO CC1CCC(C)([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000236662606 328001989 /nfs/dbraw/zinc/00/19/89/328001989.db2.gz AGELWLFNQKMFKG-UHFFFAOYSA-N 1 0 262.353 3.653 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cccc(Cl)c2)cc1 ZINC000040675896 328015480 /nfs/dbraw/zinc/01/54/80/328015480.db2.gz YXLABLZCLBBVEY-UHFFFAOYSA-N 1 0 290.750 3.581 20 5 CHBDRO Cc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000040675848 328015513 /nfs/dbraw/zinc/01/55/13/328015513.db2.gz SALLNHBQRAMYGL-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO CCC[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000531562283 328018075 /nfs/dbraw/zinc/01/80/75/328018075.db2.gz KNYUGZYLZAECHD-CYBMUJFWSA-N 1 0 262.353 3.607 20 5 CHBDRO Cc1ccc(CC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000531685521 328021305 /nfs/dbraw/zinc/02/13/05/328021305.db2.gz YSZVBWLXYUTABX-CYBMUJFWSA-N 1 0 288.347 3.698 20 5 CHBDRO Cc1ccc(C)c(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000049256767 328352871 /nfs/dbraw/zinc/35/28/71/328352871.db2.gz HHYNCTXJEJITFX-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000049505919 328366464 /nfs/dbraw/zinc/36/64/64/328366464.db2.gz MWROBOZNKXCPLH-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000049577400 328372593 /nfs/dbraw/zinc/37/25/93/328372593.db2.gz XQWMJCSGANIWPR-SNVBAGLBSA-N 1 0 292.285 3.724 20 5 CHBDRO C[C@@H](CC1CC1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000070102512 328393082 /nfs/dbraw/zinc/39/30/82/328393082.db2.gz GVPJWKNJOYFWBN-VIFPVBQESA-N 1 0 268.744 3.526 20 5 CHBDRO CC1(C2CC2)CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000563781704 328516591 /nfs/dbraw/zinc/51/65/91/328516591.db2.gz IXKQPFZTXGWCBC-UHFFFAOYSA-N 1 0 288.391 3.649 20 5 CHBDRO CCOC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C(C)C ZINC000530491329 326818119 /nfs/dbraw/zinc/81/81/19/326818119.db2.gz WWSSQOMRUJNYOV-XJKSGUPXSA-N 1 0 294.395 3.615 20 5 CHBDRO CC(C)(C)[C@H]1CC[C@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000558220504 327079164 /nfs/dbraw/zinc/07/91/64/327079164.db2.gz QFVMBGKRWUPKSZ-QWHCGFSZSA-N 1 0 262.353 3.509 20 5 CHBDRO CC[C@@H]1CC[C@H]1[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000558252332 327081712 /nfs/dbraw/zinc/08/17/12/327081712.db2.gz JYGWSZUIPLDABY-YRGRVCCFSA-N 1 0 262.353 3.742 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000558257482 327083386 /nfs/dbraw/zinc/08/33/86/327083386.db2.gz LPTQGPDLBRSFFD-GOEBONIOSA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCCC1(F)F ZINC000560351033 327302288 /nfs/dbraw/zinc/30/22/88/327302288.db2.gz DATXZYZZWVYZJO-NEPJUHHUSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc(C[NH2+]CCC2CCCC2)cc1[N+](=O)[O-] ZINC000037492996 328799992 /nfs/dbraw/zinc/79/99/92/328799992.db2.gz IFMURRZCILJVAT-UHFFFAOYSA-N 1 0 262.353 3.573 20 5 CHBDRO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000526989371 328819791 /nfs/dbraw/zinc/81/97/91/328819791.db2.gz RJJNPOQMJYPHJJ-VXGBXAGGSA-N 1 0 286.331 3.838 20 5 CHBDRO CSC1(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000193809240 329063178 /nfs/dbraw/zinc/06/31/78/329063178.db2.gz OXEQAYMNVVBOGC-GFCCVEGCSA-N 1 0 294.420 3.840 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1C)c1cccc([N+](=O)[O-])c1 ZINC000187441167 329357597 /nfs/dbraw/zinc/35/75/97/329357597.db2.gz ZWRVFSRYZULYJY-QGZVFWFLSA-N 1 0 299.374 3.848 20 5 CHBDRO COCC[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000508996258 332854853 /nfs/dbraw/zinc/85/48/53/332854853.db2.gz FQMSQTPGUVJFLN-WFASDCNBSA-N 1 0 294.395 3.697 20 5 CHBDRO Cc1ncc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000123699157 329561485 /nfs/dbraw/zinc/56/14/85/329561485.db2.gz ABYMLFGUQRGUPE-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1CC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000222055301 329657018 /nfs/dbraw/zinc/65/70/18/329657018.db2.gz GXYGJKUMRNVODP-JSGCOSHPSA-N 1 0 262.353 3.682 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000086642105 332877128 /nfs/dbraw/zinc/87/71/28/332877128.db2.gz JHGSMAFICKURKD-UHFFFAOYSA-N 1 0 264.369 3.962 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)C(F)(F)F ZINC000548157553 329935662 /nfs/dbraw/zinc/93/56/62/329935662.db2.gz KWUPJSREKWIAHA-UWVGGRQHSA-N 1 0 290.285 3.752 20 5 CHBDRO CC[C@H](C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000421870643 330100174 /nfs/dbraw/zinc/10/01/74/330100174.db2.gz FTFLOKVPTQWBOL-WFASDCNBSA-N 1 0 276.380 3.552 20 5 CHBDRO CCCC[C@@H](C[NH3+])N[C@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000423301652 330188974 /nfs/dbraw/zinc/18/89/74/330188974.db2.gz UHMWYMNNSWYPOB-GOEBONIOSA-N 1 0 293.411 3.543 20 5 CHBDRO CC1(C)CC(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000527113689 330221975 /nfs/dbraw/zinc/22/19/75/330221975.db2.gz RKNGBNBLTQZALE-ALCCZGGFSA-N 1 0 274.364 3.634 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000396778911 330226066 /nfs/dbraw/zinc/22/60/66/330226066.db2.gz LIYFWUQQOVMKOZ-ZDUSSCGKSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H](C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000396956587 330232195 /nfs/dbraw/zinc/23/21/95/330232195.db2.gz VMKHTFUMDDUAKI-VIFPVBQESA-N 1 0 290.285 3.581 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000035648900 330248356 /nfs/dbraw/zinc/24/83/56/330248356.db2.gz RVMFIRVDLFDEDV-FZMZJTMJSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000035648748 330248422 /nfs/dbraw/zinc/24/84/22/330248422.db2.gz NRFPQAOGBAHQBP-FZMZJTMJSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1ccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000536870691 330263852 /nfs/dbraw/zinc/26/38/52/330263852.db2.gz PBPFNWRSGOQAFS-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(C)CC1 ZINC000536875250 330308031 /nfs/dbraw/zinc/30/80/31/330308031.db2.gz ICTBAHOLBJBQGH-GFCCVEGCSA-N 1 0 294.420 3.855 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC13CC3)CCCC2 ZINC000424327442 330341656 /nfs/dbraw/zinc/34/16/56/330341656.db2.gz PXYLVVXBFRYWMU-HUUCEWRRSA-N 1 0 272.348 3.504 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000424329022 330341850 /nfs/dbraw/zinc/34/18/50/330341850.db2.gz RMPZDDSZRXPRIF-UONOGXRCSA-N 1 0 260.337 3.578 20 5 CHBDRO CC(C)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000445436428 330342642 /nfs/dbraw/zinc/34/26/42/330342642.db2.gz RBVJCHYPCCCBOQ-OLZOCXBDSA-N 1 0 262.353 3.634 20 5 CHBDRO CC1(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000434764189 330644617 /nfs/dbraw/zinc/64/46/17/330644617.db2.gz HQKOIMYLKNMHQH-UHFFFAOYSA-N 1 0 276.380 3.697 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436277757 330672852 /nfs/dbraw/zinc/67/28/52/330672852.db2.gz ZHPXAPOKNJYOFW-UHFFFAOYSA-N 1 0 299.305 3.505 20 5 CHBDRO C[C@H](CC1CC1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447535879 330868637 /nfs/dbraw/zinc/86/86/37/330868637.db2.gz JCIYJBNOEYPXBA-BDJLRTHQSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC(F)(F)C1 ZINC000449189122 330904994 /nfs/dbraw/zinc/90/49/94/330904994.db2.gz OXDLRBDTLATWEU-AAEUAGOBSA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449439599 330925713 /nfs/dbraw/zinc/92/57/13/330925713.db2.gz IORVIKHKOPBJJV-LLVKDONJSA-N 1 0 286.331 3.743 20 5 CHBDRO C[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCCC1 ZINC000451944929 331047878 /nfs/dbraw/zinc/04/78/78/331047878.db2.gz HLNQHXQAVNPLSP-SECBINFHSA-N 1 0 284.306 3.541 20 5 CHBDRO CC/C=C/C[NH2+][C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000453316826 331115728 /nfs/dbraw/zinc/11/57/28/331115728.db2.gz JZWZHORPMMYCAL-SYTKJHMZSA-N 1 0 278.352 3.610 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000453366745 331123549 /nfs/dbraw/zinc/12/35/49/331123549.db2.gz ODQYBPSQBHCBCI-BPUTZDHNSA-N 1 0 274.364 3.682 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C1CC1)C1CCC1 ZINC000453438091 331131798 /nfs/dbraw/zinc/13/17/98/331131798.db2.gz VOIWSAAJEPKLRE-PXAZEXFGSA-N 1 0 288.391 3.694 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](CC)CSC)c1cccc([N+](=O)[O-])c1 ZINC000164056870 331157356 /nfs/dbraw/zinc/15/73/56/331157356.db2.gz XHLBQDMOXCDDNN-GXTWGEPZSA-N 1 0 282.409 3.777 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000195586185 331178242 /nfs/dbraw/zinc/17/82/42/331178242.db2.gz VWWSOQQKFIMKBV-YRGRVCCFSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1c(C[NH2+]C2(C3CCC3)CCC2)cccc1[N+](=O)[O-] ZINC000459753604 331298571 /nfs/dbraw/zinc/29/85/71/331298571.db2.gz CPNJNYZGYPULLB-UHFFFAOYSA-N 1 0 274.364 3.716 20 5 CHBDRO C=Cc1ccc(CC[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000462908551 331334694 /nfs/dbraw/zinc/33/46/94/331334694.db2.gz YBARQLDPKVPRET-UHFFFAOYSA-N 1 0 288.372 3.632 20 5 CHBDRO CCC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])CC(C)C ZINC000463505568 331348762 /nfs/dbraw/zinc/34/87/62/331348762.db2.gz DTWUHEIWXLFPNL-UHFFFAOYSA-N 1 0 298.358 3.611 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000464774803 331367400 /nfs/dbraw/zinc/36/74/00/331367400.db2.gz IXYSNECXRPMPIL-INIZCTEOSA-N 1 0 292.379 3.616 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)c(F)c1 ZINC000478383512 331704983 /nfs/dbraw/zinc/70/49/83/331704983.db2.gz JZZRJFLEAGSJMB-OUCADQQQSA-N 1 0 292.354 3.792 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)CCC(F)(F)F)cccc1[N+](=O)[O-] ZINC000478504261 331707473 /nfs/dbraw/zinc/70/74/73/331707473.db2.gz HSTTVNLRTOHDOY-SECBINFHSA-N 1 0 290.285 3.724 20 5 CHBDRO CC(C)=CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000479294865 331723961 /nfs/dbraw/zinc/72/39/61/331723961.db2.gz UOSPPWGJKHKHAG-HOCLYGCPSA-N 1 0 288.391 3.862 20 5 CHBDRO COCC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000511052602 332925942 /nfs/dbraw/zinc/92/59/42/332925942.db2.gz YPZHRBZFTLEYHF-IUODEOHRSA-N 1 0 294.395 3.697 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2ccsc2Cl)c1 ZINC000480282138 331766175 /nfs/dbraw/zinc/76/61/75/331766175.db2.gz XFFCBWBAXIENCG-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO CC[C@H]([NH2+]C/C=C/c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000487266150 331961319 /nfs/dbraw/zinc/96/13/19/331961319.db2.gz IMKNGVQUXUGKPX-BDUNBXCCSA-N 1 0 297.358 3.744 20 5 CHBDRO COc1cc(C[N@@H+]2CCC[C@@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000489198466 332043253 /nfs/dbraw/zinc/04/32/53/332043253.db2.gz RARDSKBCXVMERC-OAHLLOKOSA-N 1 0 292.379 3.614 20 5 CHBDRO COc1cc(C[N@@H+]2C[C@@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000490029445 332077508 /nfs/dbraw/zinc/07/75/08/332077508.db2.gz KIMCXNCUPXRCHA-STQMWFEESA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1C[C@@H](C)[C@H](C)C1 ZINC000490036534 332077913 /nfs/dbraw/zinc/07/79/13/332077913.db2.gz FVJOFTXDIRHTCX-UPJWGTAASA-N 1 0 262.353 3.552 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1CC(F)(F)C1 ZINC000491589208 332241815 /nfs/dbraw/zinc/24/18/15/332241815.db2.gz OUYYCFSZWQAWNW-VZUCSPMQSA-N 1 0 296.317 3.633 20 5 CHBDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)(C)C ZINC000154931501 334708416 /nfs/dbraw/zinc/70/84/16/334708416.db2.gz TZWWLMOHCJUFGH-IUODEOHRSA-N 1 0 294.395 3.615 20 5 CHBDRO CC[NH+](CC)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000505253932 332735236 /nfs/dbraw/zinc/73/52/36/332735236.db2.gz JBTVOZIYPYRJFR-UHFFFAOYSA-N 1 0 274.320 3.697 20 5 CHBDRO CCC[NH+](CCC)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505354889 332738476 /nfs/dbraw/zinc/73/84/76/332738476.db2.gz AKZKFYRRMHLWTF-UHFFFAOYSA-N 1 0 250.342 3.525 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000516658793 333080238 /nfs/dbraw/zinc/08/02/38/333080238.db2.gz YCZCVCZAPHPIAZ-HNNXBMFYSA-N 1 0 276.380 3.696 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC[C@H](F)C1 ZINC000517235845 333095425 /nfs/dbraw/zinc/09/54/25/333095425.db2.gz WTWNQEDJFBPMTH-PPHUUTPLSA-N 1 0 292.354 3.868 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000219474212 333150592 /nfs/dbraw/zinc/15/05/92/333150592.db2.gz OFZIRFCCNNPEJZ-JSGCOSHPSA-N 1 0 276.380 3.819 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000219474129 333150610 /nfs/dbraw/zinc/15/06/10/333150610.db2.gz OFZIRFCCNNPEJZ-GXTWGEPZSA-N 1 0 276.380 3.819 20 5 CHBDRO CC[C@@H]([NH2+]CC1(C)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000222218372 333177290 /nfs/dbraw/zinc/17/72/90/333177290.db2.gz UGZUQJCIUJVANA-CQSZACIVSA-N 1 0 262.353 3.826 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000522300615 333280772 /nfs/dbraw/zinc/28/07/72/333280772.db2.gz AITYZPZOORCPHZ-ZDUSSCGKSA-N 1 0 282.409 3.914 20 5 CHBDRO Cc1cccc(C[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523701367 333340002 /nfs/dbraw/zinc/34/00/02/333340002.db2.gz IKZYCIUNEVVUKG-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCCc3ccccc32)cc1 ZINC000315728099 333383237 /nfs/dbraw/zinc/38/32/37/333383237.db2.gz LPZKIMFRBMQBDH-SFHVURJKSA-N 1 0 296.370 3.805 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000524766829 333387366 /nfs/dbraw/zinc/38/73/66/333387366.db2.gz PXHLPEOQKNFTAX-HNNXBMFYSA-N 1 0 262.353 3.607 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CSC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000338783272 335138324 /nfs/dbraw/zinc/13/83/24/335138324.db2.gz UTXVZNHRFCKZNS-QWHCGFSZSA-N 1 0 280.393 3.530 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCCC12CC2 ZINC000576004327 335140791 /nfs/dbraw/zinc/14/07/91/335140791.db2.gz TVPXPNKAVFLXTB-CQSZACIVSA-N 1 0 294.782 3.713 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCCC12CC2 ZINC000576004326 335140909 /nfs/dbraw/zinc/14/09/09/335140909.db2.gz TVPXPNKAVFLXTB-AWEZNQCLSA-N 1 0 294.782 3.713 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H](c2ccccc2)C2CC2)c1 ZINC000538117120 333575106 /nfs/dbraw/zinc/57/51/06/333575106.db2.gz RKIYLWIGNUUPGB-SFHVURJKSA-N 1 0 296.370 3.878 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000540162609 333716173 /nfs/dbraw/zinc/71/61/73/333716173.db2.gz LFDPBBHKLBANKW-ZYHUDNBSSA-N 1 0 284.306 3.823 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H](CC)C(C)(C)O)c1cccc([N+](=O)[O-])c1 ZINC000340503819 335156943 /nfs/dbraw/zinc/15/69/43/335156943.db2.gz NUYUBUKYAADSDI-CABCVRRESA-N 1 0 294.395 3.575 20 5 CHBDRO CC(C)([NH2+]C[C@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000545872345 334003501 /nfs/dbraw/zinc/00/35/01/334003501.db2.gz AMXJHEWDVOEKOE-ZDUSSCGKSA-N 1 0 274.364 3.776 20 5 CHBDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000564324902 334101200 /nfs/dbraw/zinc/10/12/00/334101200.db2.gz JIVDRTIKERMZED-GXTWGEPZSA-N 1 0 262.353 3.666 20 5 CHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccc(F)c1 ZINC000135167420 334118535 /nfs/dbraw/zinc/11/85/35/334118535.db2.gz HQADFRKYIOIZQK-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO CCSCC[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000135471888 334131062 /nfs/dbraw/zinc/13/10/62/334131062.db2.gz YKOUMWREMDSQEG-VXGBXAGGSA-N 1 0 282.409 3.777 20 5 CHBDRO CC1(C)CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000079977524 334164657 /nfs/dbraw/zinc/16/46/57/334164657.db2.gz ONTBNBLQELDUBZ-CYBMUJFWSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1ccc(CC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549166969 334186908 /nfs/dbraw/zinc/18/69/08/334186908.db2.gz BPMACGAAGAIQQO-UHFFFAOYSA-N 1 0 298.386 3.620 20 5 CHBDRO CS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000245472143 334195863 /nfs/dbraw/zinc/19/58/63/334195863.db2.gz YRMWAIWOEKDXGC-UXIGCNINSA-N 1 0 294.420 3.920 20 5 CHBDRO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000550079266 334212592 /nfs/dbraw/zinc/21/25/92/334212592.db2.gz LFTFTJIESUGHNM-DZGCQCFKSA-N 1 0 274.364 3.605 20 5 CHBDRO CC1(C)C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@@H]21 ZINC000550442917 334222607 /nfs/dbraw/zinc/22/26/07/334222607.db2.gz BTUXODZBHCEPIJ-JKSUJKDBSA-N 1 0 288.391 3.648 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000248272991 334297766 /nfs/dbraw/zinc/29/77/66/334297766.db2.gz WYXOMCYKBAOTJU-UHFFFAOYSA-N 1 0 262.353 3.749 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000552274179 334311256 /nfs/dbraw/zinc/31/12/56/334311256.db2.gz DSJRJKVPMWUAEO-QGZVFWFLSA-N 1 0 296.370 3.974 20 5 CHBDRO CC(C)[C@@H]1CC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000552283014 334312980 /nfs/dbraw/zinc/31/29/80/334312980.db2.gz VCIIHFOSOPGKMD-GXTWGEPZSA-N 1 0 282.771 3.772 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCSC[C@@H](C)C1 ZINC000248943683 334322283 /nfs/dbraw/zinc/32/22/83/334322283.db2.gz AEEIOIUADBJOLX-AAEUAGOBSA-N 1 0 294.420 3.649 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000249775433 334340380 /nfs/dbraw/zinc/34/03/80/334340380.db2.gz NACPUXICQAZXPI-SDDRHHMPSA-N 1 0 250.342 3.680 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2C=CCCC2)cc1[N+](=O)[O-] ZINC000090392825 334360185 /nfs/dbraw/zinc/36/01/85/334360185.db2.gz HXODSMINGVEXJO-OCCSQVGLSA-N 1 0 260.337 3.663 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000252710747 334385995 /nfs/dbraw/zinc/38/59/95/334385995.db2.gz HPFOQMXHAGQRLD-JMSVASOKSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000252731027 334387706 /nfs/dbraw/zinc/38/77/06/334387706.db2.gz NYXHRVZJLZKHLS-YRGRVCCFSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC(C)(F)F ZINC000567015559 334673410 /nfs/dbraw/zinc/67/34/10/334673410.db2.gz YIMURNOLFSDHLN-NSHDSACASA-N 1 0 286.322 3.989 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000324327600 334884335 /nfs/dbraw/zinc/88/43/35/334884335.db2.gz PTKQSQCSWWJDJR-RISCZKNCSA-N 1 0 262.353 3.742 20 5 CHBDRO CCOCC(C)(C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000581035195 335999304 /nfs/dbraw/zinc/99/93/04/335999304.db2.gz LXAHNBNTLFDODG-ZDUSSCGKSA-N 1 0 294.395 3.617 20 5 CHBDRO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H]1CC2CCC1CC2 ZINC000381776857 336072898 /nfs/dbraw/zinc/07/28/98/336072898.db2.gz ZACLBLNEDXTTKY-UZRPSVAASA-N 1 0 294.420 3.961 20 5 CHBDRO Cc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1F ZINC000384620782 336128054 /nfs/dbraw/zinc/12/80/54/336128054.db2.gz IMBBUKZTSKXREZ-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO C[C@H]1C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000385820712 336157629 /nfs/dbraw/zinc/15/76/29/336157629.db2.gz QUERQLQXVGSQLF-BLLLJJGKSA-N 1 0 282.343 3.933 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000387153592 336186638 /nfs/dbraw/zinc/18/66/38/336186638.db2.gz PTZIRENFOVPIJU-HUUCEWRRSA-N 1 0 274.364 3.968 20 5 CHBDRO CCCC[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000050888497 521008178 /nfs/dbraw/zinc/00/81/78/521008178.db2.gz AQQQZTXIQLWURR-LLVKDONJSA-N 1 0 250.342 3.572 20 5 CHBDRO CC(C)([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000299519226 519323526 /nfs/dbraw/zinc/32/35/26/519323526.db2.gz DJJWLRGZNUEXFS-UHFFFAOYSA-N 1 0 270.332 3.620 20 5 CHBDRO CCO[C@@H](CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000155684037 520303133 /nfs/dbraw/zinc/30/31/33/520303133.db2.gz SCJNNRDUZSLQHO-BBRMVZONSA-N 1 0 294.395 3.697 20 5 CHBDRO CC1(C)CCC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)C1 ZINC000149402778 520343827 /nfs/dbraw/zinc/34/38/27/520343827.db2.gz LSUOYVBLCXNIPJ-LLVKDONJSA-N 1 0 268.382 3.715 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C2CCCC2)cc1[N+](=O)[O-] ZINC000152529573 521257271 /nfs/dbraw/zinc/25/72/71/521257271.db2.gz IEENAXNXBIVJGJ-NSHDSACASA-N 1 0 278.352 3.587 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000062050648 522645211 /nfs/dbraw/zinc/64/52/11/522645211.db2.gz UXUVVKWOUKIRTR-INIZCTEOSA-N 1 0 285.347 3.539 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000037010387 522884632 /nfs/dbraw/zinc/88/46/32/522884632.db2.gz MSKZIQPHYVBHPZ-MRXNPFEDSA-N 1 0 270.332 3.836 20 5 CHBDRO Cc1cccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000050015601 524827847 /nfs/dbraw/zinc/82/78/47/524827847.db2.gz QKLFJZOWPNYOBI-CYBMUJFWSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000280420538 525411606 /nfs/dbraw/zinc/41/16/06/525411606.db2.gz QQVJPFSLVMVRQT-QWRGUYRKSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000037150776 525534653 /nfs/dbraw/zinc/53/46/53/525534653.db2.gz CWRNCZCYWZLQNP-RYUDHWBXSA-N 1 0 286.331 3.712 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCC12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000282212293 525551304 /nfs/dbraw/zinc/55/13/04/525551304.db2.gz OMBMHJCGDZMTEQ-SMDDNHRTSA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1ccoc1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000293385239 525810595 /nfs/dbraw/zinc/81/05/95/525810595.db2.gz IMVHAJPXAJLXSO-HNNXBMFYSA-N 1 0 286.331 3.663 20 5 CHBDRO Cc1ccsc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000070092045 525868380 /nfs/dbraw/zinc/86/83/80/525868380.db2.gz FOUGADQVHFCVAO-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000036959968 525935284 /nfs/dbraw/zinc/93/52/84/525935284.db2.gz PWWPUWRYPQGLQO-RYUDHWBXSA-N 1 0 274.320 3.908 20 5 CHBDRO Cc1ncc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000040997554 527277127 /nfs/dbraw/zinc/27/71/27/527277127.db2.gz ZAFCEDLJRXISAY-SNVBAGLBSA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C1CCC1 ZINC000290981727 527319234 /nfs/dbraw/zinc/31/92/34/527319234.db2.gz YPIXGUFMDMARFG-UHFFFAOYSA-N 1 0 275.135 3.544 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)cs1 ZINC000280602385 527330934 /nfs/dbraw/zinc/33/09/34/527330934.db2.gz JJIKDDNWPGZYPU-HDJSIYSDSA-N 1 0 288.372 3.692 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000280979016 527400100 /nfs/dbraw/zinc/40/01/00/527400100.db2.gz WAYCCSRVLIYBST-KRWDZBQOSA-N 1 0 297.358 3.621 20 5 CHBDRO CC(C)[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC001307529068 1125461588 /nfs/dbraw/zinc/46/15/88/1125461588.db2.gz MRYKZZKKLMZECU-UHFFFAOYSA-N 1 0 292.379 3.627 20 5 CHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215377 1117882992 /nfs/dbraw/zinc/88/29/92/1117882992.db2.gz JIPDYLPUUDZLAQ-STQMWFEESA-N 1 0 262.353 3.605 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CC[C@H](C)C1 ZINC000433038370 1121528655 /nfs/dbraw/zinc/52/86/55/1121528655.db2.gz JRPPGAYJAUCADH-SMDDNHRTSA-N 1 0 262.353 3.524 20 5 CHBDRO CCC[NH+](CCC)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037403740 1123029411 /nfs/dbraw/zinc/02/94/11/1123029411.db2.gz UXKHHASMVKNHDF-UHFFFAOYSA-N 1 0 270.760 3.870 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000122770063 1124533743 /nfs/dbraw/zinc/53/37/43/1124533743.db2.gz IBRNHKAFLKKMCC-VXGBXAGGSA-N 1 0 264.369 3.928 20 5 CHBDRO CCCCc1ccc(CO[C@H](C)C[N+](C)(C)C)cc1 ZINC001223848078 1135389527 /nfs/dbraw/zinc/38/95/27/1135389527.db2.gz RVSMVSFRUULGPR-OAHLLOKOSA-N 1 0 264.433 3.641 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1C[C@H]1C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000348315657 1125537309 /nfs/dbraw/zinc/53/73/09/1125537309.db2.gz UQKIQQFMJQFBOM-FRRDWIJNSA-N 1 0 284.306 3.679 20 5 CHBDRO O=[N+]([O-])c1ncccc1C[NH2+][C@@H](c1ccccc1)C1CCC1 ZINC000886062431 1125643147 /nfs/dbraw/zinc/64/31/47/1125643147.db2.gz PAXOVUINYZGXGN-INIZCTEOSA-N 1 0 297.358 3.621 20 5 CHBDRO CC(C)[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000886215061 1125661227 /nfs/dbraw/zinc/66/12/27/1125661227.db2.gz CQWNYGWDGAMZFB-CQSZACIVSA-N 1 0 299.374 3.961 20 5 CHBDRO C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886205087 1125661122 /nfs/dbraw/zinc/66/11/22/1125661122.db2.gz ZLNNMXKYECYVTL-BBRMVZONSA-N 1 0 297.358 3.573 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000348388414 1125684339 /nfs/dbraw/zinc/68/43/39/1125684339.db2.gz GSJOONBDQCLZIK-BZPMIXESSA-N 1 0 266.316 3.526 20 5 CHBDRO C[C@H]([NH2+]C1(C2CC2)CCC1)c1ccccc1[N+](=O)[O-] ZINC000886825083 1125720805 /nfs/dbraw/zinc/72/08/05/1125720805.db2.gz LYDCJEZPOABMDC-NSHDSACASA-N 1 0 260.337 3.578 20 5 CHBDRO CCC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC1CC1 ZINC000000042907 1129711924 /nfs/dbraw/zinc/71/19/24/1129711924.db2.gz XSNTYIHSVFDYBK-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC(C)(C)C1 ZINC000483107784 1126768280 /nfs/dbraw/zinc/76/82/80/1126768280.db2.gz SDBGSNLQQSATOT-HNNXBMFYSA-N 1 0 276.380 3.648 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(Cc3ccccc3)CC2)cs1 ZINC000187491932 1126911134 /nfs/dbraw/zinc/91/11/34/1126911134.db2.gz WUCYPCKZJYRYDD-UHFFFAOYSA-N 1 0 288.372 3.521 20 5 CHBDRO C[C@H]([NH2+]Cc1cccs1)c1ccc([N+](=O)[O-])cc1 ZINC000037177105 1126923796 /nfs/dbraw/zinc/92/37/96/1126923796.db2.gz OBAHSIGNVXUPIA-JTQLQIEISA-N 1 0 262.334 3.507 20 5 CHBDRO CC[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000485541319 1126924537 /nfs/dbraw/zinc/92/45/37/1126924537.db2.gz HYIIMIXZEAYUHO-ZDUSSCGKSA-N 1 0 292.379 3.616 20 5 CHBDRO COc1ccc(C[NH2+]C[C@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000042863331 1127080653 /nfs/dbraw/zinc/08/06/53/1127080653.db2.gz RPTFZNKNXYZFAG-GXTWGEPZSA-N 1 0 292.379 3.519 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000350053191 1127171407 /nfs/dbraw/zinc/17/14/07/1127171407.db2.gz YYNJMRWUIGIGID-QGZVFWFLSA-N 1 0 297.358 3.539 20 5 CHBDRO C[C@@H](C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000571890687 1127179464 /nfs/dbraw/zinc/17/94/64/1127179464.db2.gz YPEDMPCVCOIYKL-HNNXBMFYSA-N 1 0 298.386 3.873 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C2CC2)C1 ZINC000588977945 1127209311 /nfs/dbraw/zinc/20/93/11/1127209311.db2.gz DZMAALWBHWEIQM-JSGCOSHPSA-N 1 0 274.364 3.778 20 5 CHBDRO CC(C)SCC[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000588926998 1127207561 /nfs/dbraw/zinc/20/75/61/1127207561.db2.gz WPFKADQLGOOGGJ-UHFFFAOYSA-N 1 0 296.436 3.949 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC(C2CC2)CC1 ZINC000590052722 1127246596 /nfs/dbraw/zinc/24/65/96/1127246596.db2.gz IASIVNWRWDBPPE-HYXAFXHYSA-N 1 0 286.375 3.730 20 5 CHBDRO C[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)CC(F)F ZINC000592392223 1127344552 /nfs/dbraw/zinc/34/45/52/1127344552.db2.gz IUNBSYISDLBDAL-IINYFYTJSA-N 1 0 298.333 3.853 20 5 CHBDRO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCC(C)(C)C1 ZINC000355582363 1127350121 /nfs/dbraw/zinc/35/01/21/1127350121.db2.gz LLNKRPBHJHUDHC-LLVKDONJSA-N 1 0 268.382 3.667 20 5 CHBDRO CC(C)O[C@@H]1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000593056120 1127369660 /nfs/dbraw/zinc/36/96/60/1127369660.db2.gz YHKSOAUMOWQJOS-ZIAGYGMSSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@@H]([NH2+][C@H]1C[C@@H](OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000592396124 1127373456 /nfs/dbraw/zinc/37/34/56/1127373456.db2.gz HMVHYEVGZCUNDB-KYOSRNDESA-N 1 0 292.379 3.592 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCCO1 ZINC000594521281 1127421984 /nfs/dbraw/zinc/42/19/84/1127421984.db2.gz TVYHBQOUYUOKSA-KCXAZCMYSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000358408200 1127419948 /nfs/dbraw/zinc/41/99/48/1127419948.db2.gz SBQJEXZGCHWPQT-UONOGXRCSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCSCC1)c1ccccc1[N+](=O)[O-] ZINC000595024827 1127443331 /nfs/dbraw/zinc/44/33/31/1127443331.db2.gz CCXAXFIHXLQUBV-RYUDHWBXSA-N 1 0 280.393 3.531 20 5 CHBDRO CC(C)[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000594994978 1127444536 /nfs/dbraw/zinc/44/45/36/1127444536.db2.gz YLYXBMPMQCZTEJ-WRLNGNIRSA-N 1 0 274.364 3.632 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C1CCC(F)CC1 ZINC000594988752 1127444599 /nfs/dbraw/zinc/44/45/99/1127444599.db2.gz DBGOLXDZHFYIHY-XSRFYTQQSA-N 1 0 298.333 3.740 20 5 CHBDRO CC(C)CC1([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000595000724 1127445200 /nfs/dbraw/zinc/44/52/00/1127445200.db2.gz NTAVTTPQVJFGGN-ALCCZGGFSA-N 1 0 274.364 3.776 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCSCC2)cc1[N+](=O)[O-] ZINC000595027539 1127448673 /nfs/dbraw/zinc/44/86/73/1127448673.db2.gz PNISPOWXJUGBBX-TZMCWYRMSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000595050182 1127451197 /nfs/dbraw/zinc/45/11/97/1127451197.db2.gz QSDOMJJEYNUKBQ-UONOGXRCSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCC[C@H](C)O1 ZINC000595081092 1127453547 /nfs/dbraw/zinc/45/35/47/1127453547.db2.gz QBYARPARHYXNDQ-KCQAQPDRSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC[C@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000595079081 1127453676 /nfs/dbraw/zinc/45/36/76/1127453676.db2.gz CVWHLXXWLMHQOH-BXUZGUMPSA-N 1 0 298.333 3.989 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@]1(C)CC1(F)F ZINC000595081287 1127453762 /nfs/dbraw/zinc/45/37/62/1127453762.db2.gz QYOIWGQQQMFTBH-GWCFXTLKSA-N 1 0 284.306 3.599 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cccc([N+](=O)[O-])c1 ZINC000595090778 1127454051 /nfs/dbraw/zinc/45/40/51/1127454051.db2.gz QYLIPNWWCQRPQN-APPDUMDISA-N 1 0 298.342 3.639 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595091434 1127454303 /nfs/dbraw/zinc/45/43/03/1127454303.db2.gz IFPYBIWUGIWGBI-OLZOCXBDSA-N 1 0 298.333 3.927 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCCc2ccco2)cccc1[N+](=O)[O-] ZINC000595093952 1127455498 /nfs/dbraw/zinc/45/54/98/1127455498.db2.gz QBRVHYGYZCVCQE-CYBMUJFWSA-N 1 0 288.347 3.780 20 5 CHBDRO CC(C)([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000595304380 1127459416 /nfs/dbraw/zinc/45/94/16/1127459416.db2.gz DATPTJZKOPNOJE-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO Cc1noc(C[NH2+][C@H]2CCCC[C@@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595364510 1127461598 /nfs/dbraw/zinc/46/15/98/1127461598.db2.gz SMTBPKHUYUEWQG-RYUDHWBXSA-N 1 0 295.383 3.586 20 5 CHBDRO CC(C)([NH2+]CCC1CCC1)c1ccccc1[N+](=O)[O-] ZINC000595510630 1127464896 /nfs/dbraw/zinc/46/48/96/1127464896.db2.gz LVLULZARRPYUTO-UHFFFAOYSA-N 1 0 262.353 3.610 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1(C2CCC2)CC1 ZINC000593083808 1127468778 /nfs/dbraw/zinc/46/87/78/1127468778.db2.gz YOHYJKUGVSPGDC-GFCCVEGCSA-N 1 0 274.364 3.887 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](CCF)C1 ZINC000595754354 1127474900 /nfs/dbraw/zinc/47/49/00/1127474900.db2.gz ACKRLZNFXOEFEI-QWHCGFSZSA-N 1 0 280.343 3.727 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](CCF)C1 ZINC000595754353 1127475175 /nfs/dbraw/zinc/47/51/75/1127475175.db2.gz ACKRLZNFXOEFEI-OLZOCXBDSA-N 1 0 280.343 3.727 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@H+](CCC2CC2)CC2CC2)cs1 ZINC000595872357 1127479515 /nfs/dbraw/zinc/47/95/15/1127479515.db2.gz WLLFEDQAFFGNBM-UHFFFAOYSA-N 1 0 280.393 3.668 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCc2ccncc2)cc1[N+](=O)[O-] ZINC000360491941 1127500505 /nfs/dbraw/zinc/50/05/05/1127500505.db2.gz OOHOGTLQFYHJDO-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@H]1CCC[N@@H+]1Cc1cccc(-c2ccc([N+](=O)[O-])nc2)c1 ZINC000596637412 1127513867 /nfs/dbraw/zinc/51/38/67/1127513867.db2.gz KTGLZCNZQGMCAD-ZDUSSCGKSA-N 1 0 297.358 3.641 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000293807235 1127522576 /nfs/dbraw/zinc/52/25/76/1127522576.db2.gz RIUIKOXVSRUYSA-LRDDRELGSA-N 1 0 299.374 3.979 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H](CCF)C1 ZINC000597212100 1127534039 /nfs/dbraw/zinc/53/40/39/1127534039.db2.gz RSKQSCWYAMMDAT-BTKRWWFXSA-N 1 0 292.354 3.680 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCCC[C@H]1OC)c1cccc([N+](=O)[O-])c1 ZINC000361755448 1127586946 /nfs/dbraw/zinc/58/69/46/1127586946.db2.gz QTCZFIJGEMDGEB-HRCADAONSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C3CCCCCC3)nc2c1 ZINC000602503836 1127588341 /nfs/dbraw/zinc/58/83/41/1127588341.db2.gz SFVMZIGJOUWYHZ-UHFFFAOYSA-N 1 0 289.335 3.548 20 5 CHBDRO Cc1cc(C)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)n1 ZINC000602803216 1127615417 /nfs/dbraw/zinc/61/54/17/1127615417.db2.gz AADNFRIUCPQPLV-CYBMUJFWSA-N 1 0 299.374 3.766 20 5 CHBDRO Cc1cc(C)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(C)n1 ZINC000602802019 1127614662 /nfs/dbraw/zinc/61/46/62/1127614662.db2.gz OIARBOPFSZUJGM-CYBMUJFWSA-N 1 0 299.374 3.766 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2CC(C)C2)cccc1[N+](=O)[O-] ZINC000598678901 1127631121 /nfs/dbraw/zinc/63/11/21/1127631121.db2.gz AKCVPPPLFAUJTB-YDGIUTOCSA-N 1 0 262.353 3.600 20 5 CHBDRO CC(C)C[C@H](CNc1ccc(Cl)cc1[N+](=O)[O-])[NH+](C)C ZINC000603465701 1127652290 /nfs/dbraw/zinc/65/22/90/1127652290.db2.gz KDTNALANYJBLEO-GFCCVEGCSA-N 1 0 299.802 3.636 20 5 CHBDRO C[C@@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000599085339 1127656555 /nfs/dbraw/zinc/65/65/55/1127656555.db2.gz YQZRPYKHVRDMIC-OEYIWLLWSA-N 1 0 274.364 3.682 20 5 CHBDRO C[C@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000599085341 1127656801 /nfs/dbraw/zinc/65/68/01/1127656801.db2.gz YQZRPYKHVRDMIC-ZIEJDFEHSA-N 1 0 274.364 3.682 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCCC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000599093070 1127657307 /nfs/dbraw/zinc/65/73/07/1127657307.db2.gz USXZJXZPDTWELJ-TZMCWYRMSA-N 1 0 274.364 3.826 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C2CC3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000593720430 1127665796 /nfs/dbraw/zinc/66/57/96/1127665796.db2.gz KXQBSAJUHQHKNP-GFCCVEGCSA-N 1 0 274.364 3.887 20 5 CHBDRO C[C@H]1CCC[C@H]([N@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000603873870 1127679806 /nfs/dbraw/zinc/67/98/06/1127679806.db2.gz JAXMJRSVWSNIIP-BBRMVZONSA-N 1 0 276.380 3.648 20 5 CHBDRO CC(F)(F)CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000297220027 1127691570 /nfs/dbraw/zinc/69/15/70/1127691570.db2.gz HENCQVKJHSGVNY-CYBMUJFWSA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000604439066 1127706102 /nfs/dbraw/zinc/70/61/02/1127706102.db2.gz ZUBGWJAKLWZJRP-UHFFFAOYSA-N 1 0 290.388 3.905 20 5 CHBDRO Cc1ccc(CCC[NH2+]Cc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000604478847 1127706236 /nfs/dbraw/zinc/70/62/36/1127706236.db2.gz YHMIRNJOHJDNHA-UHFFFAOYSA-N 1 0 298.386 3.934 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@H+](C1CC1)C1CCCC1 ZINC000171616970 1127717417 /nfs/dbraw/zinc/71/74/17/1127717417.db2.gz JZTRXTQUXJMATA-UHFFFAOYSA-N 1 0 278.327 3.641 20 5 CHBDRO C[C@@H](c1ccccc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000061801539 1127718347 /nfs/dbraw/zinc/71/83/47/1127718347.db2.gz DTGIMHMPQKWEKB-ZDUSSCGKSA-N 1 0 270.332 3.788 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)CC(C)C ZINC000540151619 1127964420 /nfs/dbraw/zinc/96/44/20/1127964420.db2.gz SPASVZFZKOFIMD-CHWSQXEVSA-N 1 0 264.369 3.988 20 5 CHBDRO CSCCC[N@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000467554103 1127973602 /nfs/dbraw/zinc/97/36/02/1127973602.db2.gz NXBFIUUYCCNSQA-RAXLEYEMSA-N 1 0 294.420 3.683 20 5 CHBDRO CC[N@H+](CCC1CC1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000544896329 1127989142 /nfs/dbraw/zinc/98/91/42/1127989142.db2.gz AXRANWKTBXKAMA-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000540625916 1127987784 /nfs/dbraw/zinc/98/77/84/1127987784.db2.gz WZGYUTGGGDTDRQ-DIECRNLCSA-N 1 0 296.317 3.776 20 5 CHBDRO CS[C@H]1CCCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468258101 1128000173 /nfs/dbraw/zinc/00/01/73/1128000173.db2.gz AVGHYVXOISAXKT-OLZOCXBDSA-N 1 0 294.420 3.873 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H](C)C1 ZINC000468260562 1128000257 /nfs/dbraw/zinc/00/02/57/1128000257.db2.gz KYKAOOKDXIHWFW-CHWSQXEVSA-N 1 0 262.353 3.778 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(C)CCC1 ZINC000468748787 1128019749 /nfs/dbraw/zinc/01/97/49/1128019749.db2.gz WBRGBKSNXAMCBZ-UKTHLTGXSA-N 1 0 274.364 3.778 20 5 CHBDRO C[C@@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000541587452 1128030487 /nfs/dbraw/zinc/03/04/87/1128030487.db2.gz HFTRLBLVYRZKMA-CQSZACIVSA-N 1 0 284.359 3.563 20 5 CHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542003456 1128046834 /nfs/dbraw/zinc/04/68/34/1128046834.db2.gz YDWBENZPLTZNPU-SNVBAGLBSA-N 1 0 268.744 3.623 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccoc1 ZINC000470173520 1128064111 /nfs/dbraw/zinc/06/41/11/1128064111.db2.gz CDKFWHTUPUZHSJ-MDWZMJQESA-N 1 0 286.331 3.723 20 5 CHBDRO CC[C@H]1CC[N@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470182637 1128065064 /nfs/dbraw/zinc/06/50/64/1128065064.db2.gz MHPHNKSZKIWHQU-SSUFTNFISA-N 1 0 274.364 3.730 20 5 CHBDRO CCC[N@H+](CC)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470172787 1128065087 /nfs/dbraw/zinc/06/50/87/1128065087.db2.gz CEBOKEGYMGSXPH-JLHYYAGUSA-N 1 0 262.353 3.730 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CC(C)(C)C ZINC000470173570 1128065435 /nfs/dbraw/zinc/06/54/35/1128065435.db2.gz CTXUSSFBJGLCFS-LCYFTJDESA-N 1 0 276.380 3.976 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]2CCC[C@H]21 ZINC000470207397 1128066002 /nfs/dbraw/zinc/06/60/02/1128066002.db2.gz VPJYJULEFUBZRM-UJDGICINSA-N 1 0 286.375 3.873 20 5 CHBDRO CCOc1cc(C[N@@H+]2CC[C@](C)(CC)C2)ccc1[N+](=O)[O-] ZINC000492698885 1128109916 /nfs/dbraw/zinc/10/99/16/1128109916.db2.gz VCNMAIJAXLBILG-INIZCTEOSA-N 1 0 292.379 3.616 20 5 CHBDRO CCOc1cc(C[N@@H+]2C[C@H](C)CC2(C)C)ccc1[N+](=O)[O-] ZINC000492789868 1128113187 /nfs/dbraw/zinc/11/31/87/1128113187.db2.gz NRBANUSMXIWSAQ-GFCCVEGCSA-N 1 0 292.379 3.614 20 5 CHBDRO CCOc1cc(C[N@H+](CC)CCC2CC2)ccc1[N+](=O)[O-] ZINC000492847980 1128114491 /nfs/dbraw/zinc/11/44/91/1128114491.db2.gz RAEJEXFAHDDVFV-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO Cc1cccc2c1[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC000925310426 1128128182 /nfs/dbraw/zinc/12/81/82/1128128182.db2.gz AFIZTRYBTKZSTG-MRXNPFEDSA-N 1 0 282.343 3.680 20 5 CHBDRO CCCC(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519606 1128133037 /nfs/dbraw/zinc/13/30/37/1128133037.db2.gz BZBVGTJUDUTQOF-UHFFFAOYSA-N 1 0 270.760 3.917 20 5 CHBDRO CC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761528333 1128133475 /nfs/dbraw/zinc/13/34/75/1128133475.db2.gz QQAFXVASARCYKD-YPMHNXCESA-N 1 0 282.771 3.917 20 5 CHBDRO CC(C)[C@H](C)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494189613 1128159533 /nfs/dbraw/zinc/15/95/33/1128159533.db2.gz STYIKJIYIYIZRD-JTQLQIEISA-N 1 0 270.760 3.725 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(CF)cc1)c1ccccc1[N+](=O)[O-] ZINC000777725079 1128254610 /nfs/dbraw/zinc/25/46/10/1128254610.db2.gz GNGSLWKMZUSSFR-LBPRGKRZSA-N 1 0 288.322 3.915 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000927029882 1128209451 /nfs/dbraw/zinc/20/94/51/1128209451.db2.gz GFKYWKZEGRVYOG-NTZNESFSSA-N 1 0 280.393 3.530 20 5 CHBDRO CC(C)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000324478008 1128384067 /nfs/dbraw/zinc/38/40/67/1128384067.db2.gz BLQQECYVBSUJIF-CQSZACIVSA-N 1 0 282.771 3.772 20 5 CHBDRO Cc1ccoc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000565516744 1128527541 /nfs/dbraw/zinc/52/75/41/1128527541.db2.gz DLHCZHPEXWTPCC-GFCCVEGCSA-N 1 0 274.320 3.655 20 5 CHBDRO CC1(C)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@H]1C1CC1 ZINC000565984241 1128535542 /nfs/dbraw/zinc/53/55/42/1128535542.db2.gz SPRWGVDLRFMWLV-YERXGYGTSA-N 1 0 286.375 3.728 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000037565769 1128620313 /nfs/dbraw/zinc/62/03/13/1128620313.db2.gz LIKXQHFDMUCFSC-IUODEOHRSA-N 1 0 282.343 3.585 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1Cc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000037565826 1128623274 /nfs/dbraw/zinc/62/32/74/1128623274.db2.gz GXNOQFMEHLDAMP-IUODEOHRSA-N 1 0 282.343 3.585 20 5 CHBDRO C[N@@H+](Cc1csc([N+](=O)[O-])c1)CC1CCCCC1 ZINC000047265571 1128668449 /nfs/dbraw/zinc/66/84/49/1128668449.db2.gz SYDNHBNLGRXHMP-UHFFFAOYSA-N 1 0 268.382 3.668 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2cccc(C[NH+]3CCCCC3)c2)cn1 ZINC000600787940 1128681137 /nfs/dbraw/zinc/68/11/37/1128681137.db2.gz AFAVJKNAOWLECL-UHFFFAOYSA-N 1 0 297.358 3.643 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(F)c1 ZINC000601118411 1128698812 /nfs/dbraw/zinc/69/88/12/1128698812.db2.gz MOTHYZJIQGWZRH-UHFFFAOYSA-N 1 0 288.322 3.641 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC[C@@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000578012739 1128703302 /nfs/dbraw/zinc/70/33/02/1128703302.db2.gz WTJLDCBQLNJBOB-IPYPFGDCSA-N 1 0 280.343 3.916 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000601307235 1128709271 /nfs/dbraw/zinc/70/92/71/1128709271.db2.gz XOUOTRIMVJRPPJ-FBIMIBRVSA-N 1 0 288.269 3.505 20 5 CHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609672506 1128720991 /nfs/dbraw/zinc/72/09/91/1128720991.db2.gz HLZRRCDVNYGBBU-WMLDXEAASA-N 1 0 296.370 3.973 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609766787 1128724524 /nfs/dbraw/zinc/72/45/24/1128724524.db2.gz QOJZRKRBEKCKEL-CYBMUJFWSA-N 1 0 262.353 3.607 20 5 CHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000610080159 1128738149 /nfs/dbraw/zinc/73/81/49/1128738149.db2.gz JVJFFUDYFAMSTN-GFCCVEGCSA-N 1 0 280.343 3.889 20 5 CHBDRO CCCCC[C@@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000049097971 1128743621 /nfs/dbraw/zinc/74/36/21/1128743621.db2.gz PKIVOVCFFFPKBS-GFCCVEGCSA-N 1 0 280.368 3.662 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c1 ZINC000538399299 1117916837 /nfs/dbraw/zinc/91/68/37/1117916837.db2.gz ORNFJXUBZGORDG-RBSFLKMASA-N 1 0 274.364 3.653 20 5 CHBDRO C[C@H]1CCCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083173421 1118026943 /nfs/dbraw/zinc/02/69/43/1118026943.db2.gz KKCHSQXJDBXJLU-NSHDSACASA-N 1 0 289.335 3.501 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CCC1)CCCC2 ZINC000579571127 1128752198 /nfs/dbraw/zinc/75/21/98/1128752198.db2.gz DZBKNVOOHOPAGJ-HNNXBMFYSA-N 1 0 260.337 3.504 20 5 CHBDRO CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC1CCC1 ZINC000230313533 1118146842 /nfs/dbraw/zinc/14/68/42/1118146842.db2.gz BAHCZCRJIXZBGS-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1(C)C ZINC000801539818 1128759348 /nfs/dbraw/zinc/75/93/48/1128759348.db2.gz BEHAFUNFNLXLQZ-NSHDSACASA-N 1 0 280.343 3.602 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3CC3)s2)cc1 ZINC000102421159 1118178404 /nfs/dbraw/zinc/17/84/04/1118178404.db2.gz JWRPRJWLVJTWMN-UHFFFAOYSA-N 1 0 288.372 3.823 20 5 CHBDRO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)C(C)C ZINC000083173907 1118251027 /nfs/dbraw/zinc/25/10/27/1118251027.db2.gz UMRCRKVLMHLUGL-LLVKDONJSA-N 1 0 291.351 3.602 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000610369522 1118362827 /nfs/dbraw/zinc/36/28/27/1118362827.db2.gz KUFNWEVDXSFLNZ-QWHCGFSZSA-N 1 0 286.331 3.738 20 5 CHBDRO C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000112375697 1118392427 /nfs/dbraw/zinc/39/24/27/1118392427.db2.gz NQBDCNBJYQUDKK-YPUOHESYSA-N 1 0 262.353 3.632 20 5 CHBDRO CC(C)(C[NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccs1 ZINC000083601781 1118456075 /nfs/dbraw/zinc/45/60/75/1118456075.db2.gz VZIPKPIZWKCJIW-UHFFFAOYSA-N 1 0 290.388 3.724 20 5 CHBDRO CC[C@H]([NH2+][C@@H](C)C[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000090918461 1118689320 /nfs/dbraw/zinc/68/93/20/1118689320.db2.gz GRTMLPHWZDPCTE-MAZHCROVSA-N 1 0 292.379 3.593 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000178317009 1118758718 /nfs/dbraw/zinc/75/87/18/1118758718.db2.gz GLUFAYXRGBHPLQ-ABAIWWIYSA-N 1 0 274.320 3.990 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@@H]2C2CC2)cccc1[N+](=O)[O-] ZINC000477741263 1118775936 /nfs/dbraw/zinc/77/59/36/1118775936.db2.gz IDFCDWQMBGGCKF-HUUCEWRRSA-N 1 0 274.364 3.572 20 5 CHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC(C)(C)C ZINC000510676634 1118785673 /nfs/dbraw/zinc/78/56/73/1118785673.db2.gz ALTCYMIKYZDZKZ-CLFYSBASSA-N 1 0 262.353 3.586 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCC[C@H]2CCCF)cc1 ZINC000510731212 1118804693 /nfs/dbraw/zinc/80/46/93/1118804693.db2.gz HRIRZFDSTXBPGZ-HOCLYGCPSA-N 1 0 294.370 3.645 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1Cc2ccccc21 ZINC000610810585 1118894601 /nfs/dbraw/zinc/89/46/01/1118894601.db2.gz CVCVBEYXAIBSBS-UKRRQHHQSA-N 1 0 296.370 3.894 20 5 CHBDRO CC[C@H]([NH2+]C[C@H](C)c1ccncc1)c1cccc([N+](=O)[O-])c1 ZINC000610831188 1118897937 /nfs/dbraw/zinc/89/79/37/1118897937.db2.gz JLBPUGGAOWQIGW-GUYCJALGSA-N 1 0 299.374 3.834 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](C)c2ccncc2)cccc1[N+](=O)[O-] ZINC000610831190 1118897951 /nfs/dbraw/zinc/89/79/51/1118897951.db2.gz JLBWDVJZDNZFSK-GXTWGEPZSA-N 1 0 299.374 3.753 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)c2ccncc2)cc1[N+](=O)[O-] ZINC000610830976 1118899019 /nfs/dbraw/zinc/89/90/19/1118899019.db2.gz SUTYGKDHYFTHKJ-KBPBESRZSA-N 1 0 299.374 3.753 20 5 CHBDRO CCC[C@@](C)([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC000934179885 1118956382 /nfs/dbraw/zinc/95/63/82/1118956382.db2.gz JRVGOIMEYGQBON-QGZVFWFLSA-N 1 0 299.374 3.795 20 5 CHBDRO CC1(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000539087252 1118970281 /nfs/dbraw/zinc/97/02/81/1118970281.db2.gz GNIHMQXLGLSYNA-UKRRQHHQSA-N 1 0 288.391 3.696 20 5 CHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])CCC(C)(C)C ZINC000511065359 1119001039 /nfs/dbraw/zinc/00/10/39/1119001039.db2.gz OESQYXFWVYFHKO-UHFFFAOYSA-N 1 0 264.369 3.505 20 5 CHBDRO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CCC1CCCC1 ZINC000511095179 1119043239 /nfs/dbraw/zinc/04/32/39/1119043239.db2.gz JFFWGIHULRYTRY-UHFFFAOYSA-N 1 0 276.380 3.649 20 5 CHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCCF)c2ccccc2)c1 ZINC000180959302 1128824129 /nfs/dbraw/zinc/82/41/29/1128824129.db2.gz QQBZPIHHWLFZLS-MRXNPFEDSA-N 1 0 288.322 3.633 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000178640476 1119158628 /nfs/dbraw/zinc/15/86/28/1119158628.db2.gz XHNXMYBNPCXTNL-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 ZINC000166516014 1119259880 /nfs/dbraw/zinc/25/98/80/1119259880.db2.gz UMRPBEDQSHJEAG-INIZCTEOSA-N 1 0 288.322 3.975 20 5 CHBDRO CCC1(CC)CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC001167657510 1119306273 /nfs/dbraw/zinc/30/62/73/1119306273.db2.gz XUONRYYVTLXDCB-UHFFFAOYSA-N 1 0 276.380 3.915 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(C3CC3)CC2)c1 ZINC000724811668 1119360120 /nfs/dbraw/zinc/36/01/20/1119360120.db2.gz LDFQUNNLEQDNQP-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)CCc1ccco1 ZINC000349978482 1119463536 /nfs/dbraw/zinc/46/35/36/1119463536.db2.gz UPKKIYDDIGAEHM-ZDUSSCGKSA-N 1 0 288.347 3.607 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000611802022 1119467348 /nfs/dbraw/zinc/46/73/48/1119467348.db2.gz GDUASRAUCDUJMM-JMSVASOKSA-N 1 0 292.354 3.744 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)cc1F ZINC000250894022 1119534906 /nfs/dbraw/zinc/53/49/06/1119534906.db2.gz OEABWWHGLOXPMM-KBPBESRZSA-N 1 0 292.354 3.746 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCCC12CC2 ZINC000601138116 1119811158 /nfs/dbraw/zinc/81/11/58/1119811158.db2.gz PDEZHYFFCYLZDH-ZDTYVGOBSA-N 1 0 272.348 3.530 20 5 CHBDRO Cc1ccc(C[N@@H+](C)C2CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000582233741 1119912852 /nfs/dbraw/zinc/91/28/52/1119912852.db2.gz ACQBFCFPTFEINO-UHFFFAOYSA-N 1 0 298.333 3.913 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2F)cccc1[N+](=O)[O-] ZINC000414285557 1119966838 /nfs/dbraw/zinc/96/68/38/1119966838.db2.gz LUNCGLPPELUZOS-MRVWCRGKSA-N 1 0 280.343 3.835 20 5 CHBDRO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)C1CCC(F)(F)CC1 ZINC000616092166 1120032155 /nfs/dbraw/zinc/03/21/55/1120032155.db2.gz RVJNBXUGZRSVIP-NSHDSACASA-N 1 0 298.333 3.898 20 5 CHBDRO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000103173322 1120068667 /nfs/dbraw/zinc/06/86/67/1120068667.db2.gz VTVUPEKCRYAXGM-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000273615507 1120152071 /nfs/dbraw/zinc/15/20/71/1120152071.db2.gz XCVBLFLYNMYZBV-MRXNPFEDSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@H](F)CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417346903 1120431359 /nfs/dbraw/zinc/43/13/59/1120431359.db2.gz GALWASQGRUCXBE-XHDPSFHLSA-N 1 0 280.343 3.700 20 5 CHBDRO CCOC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000315194866 1120452149 /nfs/dbraw/zinc/45/21/49/1120452149.db2.gz LGQMJTDXLKYBBM-ZDUSSCGKSA-N 1 0 292.379 3.595 20 5 CHBDRO CCCC[C@H](CC)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000069378686 1120501383 /nfs/dbraw/zinc/50/13/83/1120501383.db2.gz DDUBGTBQPWKGDD-ZDUSSCGKSA-N 1 0 250.342 3.653 20 5 CHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1sccc1[N+](=O)[O-] ZINC000301979459 1120511929 /nfs/dbraw/zinc/51/19/29/1120511929.db2.gz FZIGITDRRJPYTR-LBPRGKRZSA-N 1 0 297.424 3.723 20 5 CHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000123138991 1120522270 /nfs/dbraw/zinc/52/22/70/1120522270.db2.gz VLVAQAJOBINXLN-NOLJZWGESA-N 1 0 292.379 3.511 20 5 CHBDRO CC(C)(C)C(C)(C)C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000388913326 1120543665 /nfs/dbraw/zinc/54/36/65/1120543665.db2.gz NQBGXDBRIIXWPK-UHFFFAOYSA-N 1 0 264.369 3.757 20 5 CHBDRO CC1(C)CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000162720862 1120592153 /nfs/dbraw/zinc/59/21/53/1120592153.db2.gz SULDFVSYKZWMSN-LLVKDONJSA-N 1 0 282.771 3.917 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCS[C@@H](C)C1 ZINC000922833408 1120606646 /nfs/dbraw/zinc/60/66/46/1120606646.db2.gz GQVMSCHVBLXWCB-AAEUAGOBSA-N 1 0 294.420 3.585 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCSC3(CCC3)C2)cc1 ZINC000922843295 1120610674 /nfs/dbraw/zinc/61/06/74/1120610674.db2.gz UNMWCDCLSSTGTA-CYBMUJFWSA-N 1 0 292.404 3.503 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c(C)c1 ZINC000500417705 1120618054 /nfs/dbraw/zinc/61/80/54/1120618054.db2.gz AOENRYUULWNZMX-HNNXBMFYSA-N 1 0 291.395 3.580 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(F)c1 ZINC000124308808 1120658127 /nfs/dbraw/zinc/65/81/27/1120658127.db2.gz CWOGDRXFGISZKS-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000466934918 1120661720 /nfs/dbraw/zinc/66/17/20/1120661720.db2.gz GRNQDRVIWPZKIE-MFKMUULPSA-N 1 0 282.771 3.869 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000511857137 1120666493 /nfs/dbraw/zinc/66/64/93/1120666493.db2.gz BUTDIRLCKXFGOS-HUUCEWRRSA-N 1 0 274.364 3.668 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000511970114 1120946280 /nfs/dbraw/zinc/94/62/80/1120946280.db2.gz DYRDWXKGTJYSPO-GFCCVEGCSA-N 1 0 286.331 3.697 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCC2CCC2)c(Cl)c1 ZINC000168134426 1120992408 /nfs/dbraw/zinc/99/24/08/1120992408.db2.gz JIOOJVFWTWVWLA-UHFFFAOYSA-N 1 0 268.744 3.528 20 5 CHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC001174779310 1121027690 /nfs/dbraw/zinc/02/76/90/1121027690.db2.gz DXRJCBXLPSEVDF-GXTWGEPZSA-N 1 0 292.379 3.756 20 5 CHBDRO CC[NH+](CC)CCCSc1ccc([N+](=O)[O-])cc1F ZINC000618963706 1128959705 /nfs/dbraw/zinc/95/97/05/1128959705.db2.gz XCFHPPFLXXRGCR-UHFFFAOYSA-N 1 0 286.372 3.558 20 5 CHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000512230854 1121212576 /nfs/dbraw/zinc/21/25/76/1121212576.db2.gz VJLNWKNJRNKMRF-GDAGCXPBSA-N 1 0 276.380 3.974 20 5 CHBDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000042857642 1121317651 /nfs/dbraw/zinc/31/76/51/1121317651.db2.gz DZQJTRZRYCNHQM-OCCSQVGLSA-N 1 0 262.353 3.511 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000091900462 1121377902 /nfs/dbraw/zinc/37/79/02/1121377902.db2.gz FGRJEUNFBZTVSL-LBPRGKRZSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)C1(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000706956640 1121446579 /nfs/dbraw/zinc/44/65/79/1121446579.db2.gz LZPQLZGAEXGROA-RISCZKNCSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H](C)C(C)C ZINC000543628650 1121534833 /nfs/dbraw/zinc/53/48/33/1121534833.db2.gz VNZKDAKYBQUYGW-ZDUSSCGKSA-N 1 0 264.369 3.770 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](Cc1ccccn1)C(C)C ZINC000543629090 1121535653 /nfs/dbraw/zinc/53/56/53/1121535653.db2.gz GIUWZIPLZFPDPV-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCC(F)(F)C1 ZINC000450977320 1121621091 /nfs/dbraw/zinc/62/10/91/1121621091.db2.gz VIIIRLLDMAPMOB-LBPRGKRZSA-N 1 0 298.333 3.505 20 5 CHBDRO Cc1c(C[N@H+](C)CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000052000173 1121631410 /nfs/dbraw/zinc/63/14/10/1121631410.db2.gz FNLWPFVBZHLERA-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H](OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000611337069 1121637920 /nfs/dbraw/zinc/63/79/20/1121637920.db2.gz OKQKYYOOJUFPSJ-BMFZPTHFSA-N 1 0 292.379 3.593 20 5 CHBDRO CC1(C)C[C@@H]1[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000611468901 1121650268 /nfs/dbraw/zinc/65/02/68/1121650268.db2.gz GROPBOVEGBPPGK-BJJXKVORSA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCC(F)(F)C2)cccc1[N+](=O)[O-] ZINC000611475897 1121651576 /nfs/dbraw/zinc/65/15/76/1121651576.db2.gz OOGYUPNFHQFALH-MNOVXSKESA-N 1 0 284.306 3.742 20 5 CHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCc2ccccc21 ZINC000611549612 1121655898 /nfs/dbraw/zinc/65/58/98/1121655898.db2.gz BYMJVLDICCYQOB-INIZCTEOSA-N 1 0 296.370 3.757 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC000397685865 1121693768 /nfs/dbraw/zinc/69/37/68/1121693768.db2.gz WRXRCWHJZJLEMB-HLPPOEQASA-N 1 0 274.364 3.824 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000052333639 1121702637 /nfs/dbraw/zinc/70/26/37/1121702637.db2.gz VKXPMXASRLOLLB-CYBMUJFWSA-N 1 0 276.380 3.962 20 5 CHBDRO Cc1sccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000293483848 1121715981 /nfs/dbraw/zinc/71/59/81/1121715981.db2.gz GARPFBTYUWWCEK-JTQLQIEISA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1c(C[NH2+]CCCSCC(C)C)cccc1[N+](=O)[O-] ZINC001178204033 1121771053 /nfs/dbraw/zinc/77/10/53/1121771053.db2.gz HXZZJDYRCCDSAA-UHFFFAOYSA-N 1 0 296.436 3.772 20 5 CHBDRO CC1=CCC[C@H](C)[C@H]1C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC001178393840 1121782496 /nfs/dbraw/zinc/78/24/96/1121782496.db2.gz WFKKXZZELJNDSF-YOEHRIQHSA-N 1 0 288.391 3.719 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC001178425408 1121787768 /nfs/dbraw/zinc/78/77/68/1121787768.db2.gz AGSUYEARZUZODX-GFCCVEGCSA-N 1 0 276.380 3.996 20 5 CHBDRO CC/C=C\C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC001178800690 1121817985 /nfs/dbraw/zinc/81/79/85/1121817985.db2.gz INQMPVRKRHDLMB-WAYWQWQTSA-N 1 0 262.353 3.774 20 5 CHBDRO Cc1c(C[NH2+]C2CC(C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001178810218 1121819065 /nfs/dbraw/zinc/81/90/65/1121819065.db2.gz HOHCAHWPDNKTDZ-UHFFFAOYSA-N 1 0 276.380 3.818 20 5 CHBDRO CC(C)(C)c1ccncc1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000414503504 1122077464 /nfs/dbraw/zinc/07/74/64/1122077464.db2.gz WPBYIGFAWGFFMY-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO CC[C@H](C)C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000421387303 1122109761 /nfs/dbraw/zinc/10/97/61/1122109761.db2.gz SJMNZBSDYBHHJV-OXBCTQFSSA-N 1 0 262.353 3.634 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000502727756 1122144719 /nfs/dbraw/zinc/14/47/19/1122144719.db2.gz JYSANHBJQKGRGH-SNVBAGLBSA-N 1 0 270.760 3.869 20 5 CHBDRO CCC([NH2+]CCc1ccc([N+](=O)[O-])cc1)(C1CC1)C1CC1 ZINC001182892532 1122194525 /nfs/dbraw/zinc/19/45/25/1122194525.db2.gz VTTHNGHTENCBJO-UHFFFAOYSA-N 1 0 288.391 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CCC(C)(F)CC1 ZINC001183145748 1122207737 /nfs/dbraw/zinc/20/77/37/1122207737.db2.gz NPQZCJZWLHKKRJ-UHFFFAOYSA-N 1 0 280.343 3.536 20 5 CHBDRO Cc1cc(N2CCC(C)(C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302143377 1122356208 /nfs/dbraw/zinc/35/62/08/1122356208.db2.gz GARLTZQOOUVSQV-UHFFFAOYSA-N 1 0 285.347 3.688 20 5 CHBDRO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CCCCCC1 ZINC000505563540 1122420782 /nfs/dbraw/zinc/42/07/82/1122420782.db2.gz HGOHVKLIAGCLDW-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000505617442 1122438421 /nfs/dbraw/zinc/43/84/21/1122438421.db2.gz YWQYBDOJSVCPDH-VXGBXAGGSA-N 1 0 280.343 3.744 20 5 CHBDRO CCCCC[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000775178318 1122467393 /nfs/dbraw/zinc/46/73/93/1122467393.db2.gz GBUKJNIRJLCGDD-LLVKDONJSA-N 1 0 290.367 3.530 20 5 CHBDRO C[C@H](c1ccc(-c2ccccc2)cc1)[N@H+](C)CC[N+](=O)[O-] ZINC001191290033 1122589627 /nfs/dbraw/zinc/58/96/27/1122589627.db2.gz YLBGXTRMBSNWNE-CQSZACIVSA-N 1 0 284.359 3.623 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C2CC2)cc1 ZINC001192927645 1122664630 /nfs/dbraw/zinc/66/46/30/1122664630.db2.gz ACWQOOLTCQGKIV-QDMKHBRRSA-N 1 0 286.375 3.605 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]1Cc1ccccc1 ZINC000437820733 1122705817 /nfs/dbraw/zinc/70/58/17/1122705817.db2.gz HRNAVBZAWFDAPI-GOEBONIOSA-N 1 0 296.370 3.973 20 5 CHBDRO C[C@@H](Nc1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)[NH+](C)C ZINC000439132098 1122754019 /nfs/dbraw/zinc/75/40/19/1122754019.db2.gz WSOXQTWQKPEWDB-CXAGYDPISA-N 1 0 299.374 3.698 20 5 CHBDRO CCC[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000506496373 1122755708 /nfs/dbraw/zinc/75/57/08/1122755708.db2.gz PTRKQCGWPHPJLN-UHFFFAOYSA-N 1 0 274.320 3.697 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2[nH]1 ZINC000775631186 1122833958 /nfs/dbraw/zinc/83/39/58/1122833958.db2.gz ZBHJVGXSNAWXKA-LBPRGKRZSA-N 1 0 295.342 3.927 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@@H](C)[C@@H]1C ZINC001195277906 1122860192 /nfs/dbraw/zinc/86/01/92/1122860192.db2.gz HDJRJOXALBBZSU-FVCCEPFGSA-N 1 0 262.353 3.632 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507106308 1122926166 /nfs/dbraw/zinc/92/61/66/1122926166.db2.gz XHBVNTUXOYNHFW-KRWDZBQOSA-N 1 0 296.370 3.893 20 5 CHBDRO CCCC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000507189809 1122938090 /nfs/dbraw/zinc/93/80/90/1122938090.db2.gz CAALWRIXAYRCST-VURMDHGXSA-N 1 0 274.364 3.873 20 5 CHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC3(CCCC3)C2)cs1 ZINC000438347601 1122961358 /nfs/dbraw/zinc/96/13/58/1122961358.db2.gz UMOIWIJSUGCCNB-UHFFFAOYSA-N 1 0 280.393 3.813 20 5 CHBDRO CC1(C)CC[C@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000507789561 1123013313 /nfs/dbraw/zinc/01/33/13/1123013313.db2.gz UFALBXRDVDLUMR-VSKVDJIOSA-N 1 0 274.364 3.776 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H]1CCC[C@H]1C ZINC001202134217 1123177198 /nfs/dbraw/zinc/17/71/98/1123177198.db2.gz CQMNACXMKQUVDS-BXUZGUMPSA-N 1 0 276.380 3.737 20 5 CHBDRO COc1ccc(C[NH2+][C@@H](C)CCC(C)(C)C)cc1[N+](=O)[O-] ZINC000237244565 1123234478 /nfs/dbraw/zinc/23/44/78/1123234478.db2.gz SYBVQVRABGONQH-LBPRGKRZSA-N 1 0 294.395 3.908 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C=CCC1 ZINC000850506421 1123276350 /nfs/dbraw/zinc/27/63/50/1123276350.db2.gz APYGBMQFXDEAJL-CHWSQXEVSA-N 1 0 292.404 3.774 20 5 CHBDRO C[C@H](Nc1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)[NH+](C)C ZINC000439132107 1123362604 /nfs/dbraw/zinc/36/26/04/1123362604.db2.gz WSOXQTWQKPEWDB-SUMWQHHRSA-N 1 0 299.374 3.698 20 5 CHBDRO Cc1cccc(F)c1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000749840657 1123391869 /nfs/dbraw/zinc/39/18/69/1123391869.db2.gz NZDMWMUQBUWRPD-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO CCCCC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000776579246 1123401465 /nfs/dbraw/zinc/40/14/65/1123401465.db2.gz KJCLTFYLNWCRKI-MRXNPFEDSA-N 1 0 294.395 3.529 20 5 CHBDRO CSC(C)(C)CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000896512087 1123589772 /nfs/dbraw/zinc/58/97/72/1123589772.db2.gz LYQVVDBEOQSHIF-LLVKDONJSA-N 1 0 282.409 3.777 20 5 CHBDRO Cc1ccncc1CCC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000896511680 1123590425 /nfs/dbraw/zinc/59/04/25/1123590425.db2.gz JMQOMWFYOZCYLL-CQSZACIVSA-N 1 0 299.374 3.582 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]CC1COC1 ZINC000858300926 1123642532 /nfs/dbraw/zinc/64/25/32/1123642532.db2.gz OHVZBSNJYVEKBE-UHFFFAOYSA-N 1 0 277.367 3.729 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC[C@H]1C)c1ccccc1[N+](=O)[O-] ZINC000020526063 1123647342 /nfs/dbraw/zinc/64/73/42/1123647342.db2.gz LZTMFHSPDBMLPH-DYEKYZERSA-N 1 0 262.353 3.824 20 5 CHBDRO CC(C)CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000151765165 1123775691 /nfs/dbraw/zinc/77/56/91/1123775691.db2.gz YKPICAFTDLLZJM-OAHLLOKOSA-N 1 0 276.380 3.552 20 5 CHBDRO CC[N@H+](CCC1CC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000545519101 1123920681 /nfs/dbraw/zinc/92/06/81/1123920681.db2.gz UEBVWSDADQDZBE-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCc1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000866243524 1124040306 /nfs/dbraw/zinc/04/03/06/1124040306.db2.gz RSTPATGNTQODLG-UONOGXRCSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000088508026 1124061484 /nfs/dbraw/zinc/06/14/84/1124061484.db2.gz RMDGVAWKMVALRE-OCCSQVGLSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCCC12CC2 ZINC000866411405 1124064505 /nfs/dbraw/zinc/06/45/05/1124064505.db2.gz LCTPGOSJNGGUJH-XHDPSFHLSA-N 1 0 292.354 3.587 20 5 CHBDRO CC[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000446722392 1124120584 /nfs/dbraw/zinc/12/05/84/1124120584.db2.gz FLCIEXGGXBRJAM-ZDUSSCGKSA-N 1 0 292.379 3.614 20 5 CHBDRO COc1ccc(C[N@@H+]2C[C@@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000525637971 1124451491 /nfs/dbraw/zinc/45/14/91/1124451491.db2.gz MRVFYOWGTOFCKZ-QWHCGFSZSA-N 1 0 292.379 3.614 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1C2CCC1CC2 ZINC000527304362 1124564827 /nfs/dbraw/zinc/56/48/27/1124564827.db2.gz DOUUTVFIIUVFFV-FMIVXFBMSA-N 1 0 272.348 3.625 20 5 CHBDRO CSC1(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])CCC1 ZINC000872068449 1124673649 /nfs/dbraw/zinc/67/36/49/1124673649.db2.gz XRMDTHMAJMFLKR-JTQLQIEISA-N 1 0 298.383 3.670 20 5 CHBDRO C[C@@H]([NH2+]CCCc1ccco1)c1c(F)cccc1[N+](=O)[O-] ZINC000872089502 1124680724 /nfs/dbraw/zinc/68/07/24/1124680724.db2.gz YULCZLTUFWNJGT-LLVKDONJSA-N 1 0 292.310 3.610 20 5 CHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000449755296 1124863499 /nfs/dbraw/zinc/86/34/99/1124863499.db2.gz NXZXZQLBHLLVSW-HKBVPSITSA-N 1 0 274.364 3.776 20 5 CHBDRO CC[C@@H]([NH2+]C[C@@H](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000129919123 1124913546 /nfs/dbraw/zinc/91/35/46/1124913546.db2.gz UGXYSEHFPVBYIX-IAQYHMDHSA-N 1 0 262.353 3.682 20 5 CHBDRO CC(F)(F)CCC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000295932643 1125182156 /nfs/dbraw/zinc/18/21/56/1125182156.db2.gz FVLCWLAWIMSMJF-UHFFFAOYSA-N 1 0 292.713 3.773 20 5 CHBDRO Cc1ccc(C[N@H+](CC2CC2)C2CCC2)cc1[N+](=O)[O-] ZINC000475675171 1125196685 /nfs/dbraw/zinc/19/66/85/1125196685.db2.gz RWEDZOKASQPWCG-UHFFFAOYSA-N 1 0 274.364 3.668 20 5 CHBDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000531202532 1125200730 /nfs/dbraw/zinc/20/07/30/1125200730.db2.gz QSGLMCHWFXHFGL-RDTXWAMCSA-N 1 0 296.370 3.973 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](CC2CC2)CC2CCC2)c1 ZINC000475679154 1125222458 /nfs/dbraw/zinc/22/24/58/1125222458.db2.gz YVWUBBLGTMHAFL-UHFFFAOYSA-N 1 0 274.364 3.607 20 5 CHBDRO Cc1ccc(C[NH2+]C2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000520214709 1125227219 /nfs/dbraw/zinc/22/72/19/1125227219.db2.gz VPDUWRKPUXESQA-STQMWFEESA-N 1 0 276.380 3.818 20 5 CHBDRO CCC[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532326840 1125249218 /nfs/dbraw/zinc/24/92/18/1125249218.db2.gz LMIVVCIVXBYBJG-ZDUSSCGKSA-N 1 0 262.353 3.607 20 5 CHBDRO CC(C)C[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001168146851 1125263184 /nfs/dbraw/zinc/26/31/84/1125263184.db2.gz SUSDHCPLOGGVLN-CQSZACIVSA-N 1 0 276.380 3.853 20 5 CHBDRO Cc1c(C[NH+]2C3CCCC2CCC3)cccc1[N+](=O)[O-] ZINC000610369923 1125329685 /nfs/dbraw/zinc/32/96/85/1125329685.db2.gz ADAOWKAGYPAETL-UHFFFAOYSA-N 1 0 274.364 3.810 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCC12CCC2)c1ccccc1[N+](=O)[O-] ZINC000282846750 1125431440 /nfs/dbraw/zinc/43/14/40/1125431440.db2.gz TURJSPJFEPEDCD-BXUZGUMPSA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1c(C[NH2+]CCC2CCCC2)cccc1[N+](=O)[O-] ZINC000037741238 1129258615 /nfs/dbraw/zinc/25/86/15/1129258615.db2.gz OFQKYUIVKMVTPI-UHFFFAOYSA-N 1 0 262.353 3.573 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000766224952 1129384030 /nfs/dbraw/zinc/38/40/30/1129384030.db2.gz NHUZRQSTMZGWQE-YRGRVCCFSA-N 1 0 294.420 3.838 20 5 CHBDRO CS[C@@H]1CC[C@H]([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000766224943 1129384396 /nfs/dbraw/zinc/38/43/96/1129384396.db2.gz NHUZRQSTMZGWQE-MBNYWOFBSA-N 1 0 294.420 3.838 20 5 CHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)CC1CCCCC1 ZINC000094774535 1129452063 /nfs/dbraw/zinc/45/20/63/1129452063.db2.gz SBPVFJGAJNVTIJ-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCCCC1 ZINC000094774128 1129452076 /nfs/dbraw/zinc/45/20/76/1129452076.db2.gz BKDLRPDPDPBNKK-UHFFFAOYSA-N 1 0 280.343 3.889 20 5 CHBDRO CCCC[NH+](CCCC)Cc1ccccc1[N+](=O)[O-] ZINC000302806951 1129503050 /nfs/dbraw/zinc/50/30/50/1129503050.db2.gz GHWSGRFOTKOOFT-UHFFFAOYSA-N 1 0 264.369 3.997 20 5 CHBDRO CC(C)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1Cl ZINC001168984289 1129686860 /nfs/dbraw/zinc/68/68/60/1129686860.db2.gz LRKHAOFMMNDMTH-VXGBXAGGSA-N 1 0 296.798 3.610 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c2ccccc12 ZINC001168979225 1129686871 /nfs/dbraw/zinc/68/68/71/1129686871.db2.gz XGAKLCVGFJQSCQ-GDBMZVCRSA-N 1 0 298.386 3.683 20 5 CHBDRO CCCCc1ccc(C[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001168965963 1129687634 /nfs/dbraw/zinc/68/76/34/1129687634.db2.gz FGMVWWHPUVXZEJ-IRXDYDNUSA-N 1 0 290.407 3.564 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001169001264 1129688571 /nfs/dbraw/zinc/68/85/71/1129688571.db2.gz FBEDHCMVGMYSBR-CWRNSKLLSA-N 1 0 276.380 3.563 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCCC[C@H]2c2ccccc2)C1 ZINC001169006020 1129689169 /nfs/dbraw/zinc/68/91/69/1129689169.db2.gz FIPBYULVNOJYAP-PVAVHDDUSA-N 1 0 288.391 3.659 20 5 CHBDRO CCc1ccc([C@@H](CC)[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169005891 1129689314 /nfs/dbraw/zinc/68/93/14/1129689314.db2.gz VQAAZRRNSREIOO-DJIMGWMZSA-N 1 0 290.407 3.735 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1Cl ZINC001168988648 1129690113 /nfs/dbraw/zinc/69/01/13/1129690113.db2.gz UADYFJYDKQNEFQ-XUJVJEKNSA-N 1 0 296.798 3.826 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1Cl ZINC001168988576 1129690205 /nfs/dbraw/zinc/69/02/05/1129690205.db2.gz SNQBJMSURXUFQV-SCRDCRAPSA-N 1 0 296.798 3.744 20 5 CHBDRO [NH3+]Cc1ccn(-c2nc3ccccc3c3ccccc32)c1 ZINC001169725225 1129747963 /nfs/dbraw/zinc/74/79/63/1129747963.db2.gz APOZPJWPRLDCDH-UHFFFAOYSA-N 1 0 273.339 3.637 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001461381891 1129912684 /nfs/dbraw/zinc/91/26/84/1129912684.db2.gz KLULGXJADRHSNI-ZWNOBZJWSA-N 1 0 282.771 3.569 20 5 CHBDRO CCO[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000902893916 1130080399 /nfs/dbraw/zinc/08/03/99/1130080399.db2.gz FRPXFOOLEKAFMI-MELADBBJSA-N 1 0 292.379 3.593 20 5 CHBDRO CCO[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000902999365 1130097923 /nfs/dbraw/zinc/09/79/23/1130097923.db2.gz BLSLTKNGWPRANH-JGGQBBKZSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1nccs1)c1ccccc1[N+](=O)[O-] ZINC000903244933 1130135171 /nfs/dbraw/zinc/13/51/71/1130135171.db2.gz GQAMQUXKKHZNRK-MNOVXSKESA-N 1 0 291.376 3.506 20 5 CHBDRO CC(C)[C@H](C)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746654668 1130135372 /nfs/dbraw/zinc/13/53/72/1130135372.db2.gz JYYZSNPPWJZJAW-JTQLQIEISA-N 1 0 270.760 3.725 20 5 CHBDRO CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC(C)C ZINC000746674276 1130145624 /nfs/dbraw/zinc/14/56/24/1130145624.db2.gz SJSDCTBNBWYABK-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO CO[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000903286807 1130146395 /nfs/dbraw/zinc/14/63/95/1130146395.db2.gz HCHPRUNKFNAXJQ-IVMMDQJWSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903341525 1130163098 /nfs/dbraw/zinc/16/30/98/1130163098.db2.gz ZFFDDZIKSDPZTA-YVEFUNNKSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903341522 1130163296 /nfs/dbraw/zinc/16/32/96/1130163296.db2.gz ZFFDDZIKSDPZTA-PXAZEXFGSA-N 1 0 297.358 3.792 20 5 CHBDRO C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903427769 1130176100 /nfs/dbraw/zinc/17/61/00/1130176100.db2.gz JUWFZSMXHFILGS-YVEFUNNKSA-N 1 0 297.358 3.792 20 5 CHBDRO CC(C)CC[C@@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788498157 1130191475 /nfs/dbraw/zinc/19/14/75/1130191475.db2.gz LKYSKPIMIWMVCR-NEPJUHHUSA-N 1 0 279.384 3.652 20 5 CHBDRO CC[C@@H]1CC[C@H](C)[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC001170281244 1130477817 /nfs/dbraw/zinc/47/78/17/1130477817.db2.gz ZGQNXNLAIZUUAS-GXTWGEPZSA-N 1 0 276.380 3.914 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCCCCCCC2)c1 ZINC001170341803 1130487280 /nfs/dbraw/zinc/48/72/80/1130487280.db2.gz GASXXQRQSJESJO-UHFFFAOYSA-N 1 0 262.353 3.751 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1(C)CC1 ZINC000783601902 1130841531 /nfs/dbraw/zinc/84/15/31/1130841531.db2.gz YDMOXFCUBYWEBK-SECBINFHSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678030 1130847162 /nfs/dbraw/zinc/84/71/62/1130847162.db2.gz BCZSWMOMLCIVPU-MFKMUULPSA-N 1 0 282.771 3.869 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccsc1 ZINC000815624439 1131010856 /nfs/dbraw/zinc/01/08/56/1131010856.db2.gz YNOHFQZGZAPSAP-UWVGGRQHSA-N 1 0 291.376 3.650 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C2CC3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC001118493291 1131230108 /nfs/dbraw/zinc/23/01/08/1131230108.db2.gz RUGRIDZZSLVLNP-CDWSIMAYSA-N 1 0 296.317 3.742 20 5 CHBDRO CCc1cccc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000846209729 1131695808 /nfs/dbraw/zinc/69/58/08/1131695808.db2.gz SWFLRXQBWXPZRK-LBPRGKRZSA-N 1 0 299.374 3.590 20 5 CHBDRO Cc1cc(Cl)cc(Cl)c1O[C@@H](C)C[N+](C)(C)C ZINC001227722941 1131728390 /nfs/dbraw/zinc/72/83/90/1131728390.db2.gz OSUUYKOQCPUTRM-JTQLQIEISA-N 1 0 277.215 3.775 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cc(Cl)cc(C(F)(F)F)c1 ZINC001227845634 1131749613 /nfs/dbraw/zinc/74/96/13/1131749613.db2.gz MFVRZKRFYQTRKT-VIFPVBQESA-N 1 0 296.740 3.832 20 5 CHBDRO c1ccc2c(c1)nc(NC[C@H]1CCCC[NH2+]1)c1ccccc21 ZINC001171341763 1131879382 /nfs/dbraw/zinc/87/93/82/1131879382.db2.gz YSHAMDDTWWEZPH-CQSZACIVSA-N 1 0 291.398 3.942 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)c2ccc[nH]2)cccc1[N+](=O)[O-] ZINC000773116280 1131948505 /nfs/dbraw/zinc/94/85/05/1131948505.db2.gz INTDZUGNLWWYEW-VXGBXAGGSA-N 1 0 273.336 3.643 20 5 CHBDRO C[NH+](C)[C@H]1CCC[C@@H](Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000715573262 1131988482 /nfs/dbraw/zinc/98/84/82/1131988482.db2.gz OODDTVGWXPNXAW-NEPJUHHUSA-N 1 0 297.786 3.533 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccns1)c1cccc([N+](=O)[O-])c1 ZINC000716059468 1132003636 /nfs/dbraw/zinc/00/36/36/1132003636.db2.gz ZMNKIZSZWCSJSB-GXFFZTMASA-N 1 0 291.376 3.853 20 5 CHBDRO CC[C@@H](C)C[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037173076 1132006643 /nfs/dbraw/zinc/00/66/43/1132006643.db2.gz NBGVGJUXHAUOQF-SNVBAGLBSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@H](CCc1ccco1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000037177118 1132006732 /nfs/dbraw/zinc/00/67/32/1132006732.db2.gz DDFUMHACGGFHNJ-OLZOCXBDSA-N 1 0 288.347 3.860 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000037253573 1132024427 /nfs/dbraw/zinc/02/44/27/1132024427.db2.gz SZCGAHQZXRTWFN-DYEKYZERSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)(C)C ZINC001172899994 1132347337 /nfs/dbraw/zinc/34/73/37/1132347337.db2.gz RBICNVMNICDFER-DOMZBBRYSA-N 1 0 290.407 3.866 20 5 CHBDRO CCC[NH+](CCC)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907126 1132348064 /nfs/dbraw/zinc/34/80/64/1132348064.db2.gz DGTAMRIPYACYGT-INIZCTEOSA-N 1 0 290.407 3.964 20 5 CHBDRO CC[C@@H](C)[N@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172906301 1132348320 /nfs/dbraw/zinc/34/83/20/1132348320.db2.gz XAQBKBACKQGTJS-IUODEOHRSA-N 1 0 276.380 3.573 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C1CCC1 ZINC001172906315 1132348427 /nfs/dbraw/zinc/34/84/27/1132348427.db2.gz NYURLPIYELSJKI-BLLLJJGKSA-N 1 0 288.391 3.620 20 5 CHBDRO CC[C@@H](C)[N@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172906295 1132348823 /nfs/dbraw/zinc/34/88/23/1132348823.db2.gz XAQBKBACKQGTJS-DOMZBBRYSA-N 1 0 276.380 3.573 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC12CCCCC2 ZINC001173221358 1132411090 /nfs/dbraw/zinc/41/10/90/1132411090.db2.gz MLJUCRKYYUGGKW-CZUORRHYSA-N 1 0 288.391 3.838 20 5 CHBDRO C=Cc1ccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173219054 1132411394 /nfs/dbraw/zinc/41/13/94/1132411394.db2.gz WCUXNDHVBHERFF-CQSZACIVSA-N 1 0 296.370 3.959 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC12CCCC2 ZINC001173220737 1132411747 /nfs/dbraw/zinc/41/17/47/1132411747.db2.gz CCLGFAIKYOAVQY-CYBMUJFWSA-N 1 0 274.364 3.544 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1[C@H](C)CC[C@@H]1C ZINC001173218484 1132411767 /nfs/dbraw/zinc/41/17/67/1132411767.db2.gz BFUIXJHBNQXWRH-IATRGZMQSA-N 1 0 276.380 3.550 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC12CCCCC2 ZINC001173221356 1132411774 /nfs/dbraw/zinc/41/17/74/1132411774.db2.gz MLJUCRKYYUGGKW-BBRMVZONSA-N 1 0 288.391 3.838 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC2(CCCC2)C1 ZINC001173228148 1132412302 /nfs/dbraw/zinc/41/23/02/1132412302.db2.gz UAZDLLNUAVXQSM-CQSZACIVSA-N 1 0 288.391 3.792 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)CC1CC1 ZINC001173225576 1132412454 /nfs/dbraw/zinc/41/24/54/1132412454.db2.gz SDLFBWYTFIZIRW-CYBMUJFWSA-N 1 0 290.407 3.942 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@](C)(F)CC1 ZINC001173229114 1132412814 /nfs/dbraw/zinc/41/28/14/1132412814.db2.gz PZRCPOGRUSSVTJ-CJNGLKHVSA-N 1 0 294.370 3.740 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C)(C)CC1 ZINC001173225641 1132412903 /nfs/dbraw/zinc/41/29/03/1132412903.db2.gz FBCGJAKDWFQARU-CYBMUJFWSA-N 1 0 276.380 3.648 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CC[C@@H]2CCC[C@@H]21 ZINC001173234969 1132413675 /nfs/dbraw/zinc/41/36/75/1132413675.db2.gz RIWIRYYDJIUTFS-CSFVBSKPSA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001173231988 1132413942 /nfs/dbraw/zinc/41/39/42/1132413942.db2.gz BXZDICBYTFDADM-KBPBESRZSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H](C)c1ccccc1 ZINC001173213034 1132416596 /nfs/dbraw/zinc/41/65/96/1132416596.db2.gz CXILCUVGOGLZST-LSDHHAIUSA-N 1 0 298.386 3.919 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCCC[C@@H]1C ZINC001173211116 1132416703 /nfs/dbraw/zinc/41/67/03/1132416703.db2.gz PKPULPWHKKWTQA-SQWLQELKSA-N 1 0 290.407 3.942 20 5 CHBDRO Cc1csc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173211590 1132416711 /nfs/dbraw/zinc/41/67/11/1132416711.db2.gz TYDOQTYLXZYMGE-GFCCVEGCSA-N 1 0 290.388 3.686 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCC[C@@H](C)C1 ZINC001173210710 1132416837 /nfs/dbraw/zinc/41/68/37/1132416837.db2.gz MPBMJGPVIMTWBZ-IPYPFGDCSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cccc(-c2ccc(F)cc2)c1 ZINC001233822863 1132684971 /nfs/dbraw/zinc/68/49/71/1132684971.db2.gz BDGZGHKHUFQGDC-CQSZACIVSA-N 1 0 288.386 3.966 20 5 CHBDRO Cc1ccc(Nc2ccc(C(C)(C)C[NH3+])cc2)cc1[N+](=O)[O-] ZINC001159582051 1132868972 /nfs/dbraw/zinc/86/89/72/1132868972.db2.gz QJIFVNKYKILHDD-UHFFFAOYSA-N 1 0 299.374 3.883 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2cc[nH+]c(C3CC3)c2)cc1 ZINC001174476831 1132881328 /nfs/dbraw/zinc/88/13/28/1132881328.db2.gz AGDBBBDOTBOASS-UHFFFAOYSA-N 1 0 255.277 3.611 20 5 CHBDRO c1ccc2nc3ccc(NC4=CC[NH2+]CC4)cc3cc2c1 ZINC001159742376 1132902663 /nfs/dbraw/zinc/90/26/63/1132902663.db2.gz XOISABUWDKHSLQ-UHFFFAOYSA-N 1 0 275.355 3.677 20 5 CHBDRO O=[N+]([O-])c1ccc(Nc2ccccc2C2=CC[NH2+]CC2)cc1 ZINC001160021990 1132935566 /nfs/dbraw/zinc/93/55/66/1132935566.db2.gz QCVHLLXIAZHTSJ-UHFFFAOYSA-N 1 0 295.342 3.715 20 5 CHBDRO CC[C@@H]1CC[C@@H](C)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001174614575 1132942751 /nfs/dbraw/zinc/94/27/51/1132942751.db2.gz HTAWGZYVHPWIGR-VXGBXAGGSA-N 1 0 280.343 3.744 20 5 CHBDRO CC(C)(C)c1ccc(N[C@H]2CCC[C@@H]([NH3+])C2)c([N+](=O)[O-])c1 ZINC001162400301 1133075407 /nfs/dbraw/zinc/07/54/07/1133075407.db2.gz GVLAYHNEEKUXQS-OLZOCXBDSA-N 1 0 291.395 3.574 20 5 CHBDRO CCC[C@H](C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)OCC ZINC001203249644 1133308493 /nfs/dbraw/zinc/30/84/93/1133308493.db2.gz TYTYRKVOCOIUIC-CQSZACIVSA-N 1 0 294.395 3.506 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H]2CCC=CCCC2)c1 ZINC001203992887 1133394619 /nfs/dbraw/zinc/39/46/19/1133394619.db2.gz CEJPLEBLMFIYPS-AWEZNQCLSA-N 1 0 274.364 3.821 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)CC(C)(C)C ZINC001204374561 1133441259 /nfs/dbraw/zinc/44/12/59/1133441259.db2.gz MTXGNXRTNZIYJB-UHFFFAOYSA-N 1 0 264.369 3.690 20 5 CHBDRO C[NH+](C)Cc1ccccc1Nc1ccc(F)cc1[N+](=O)[O-] ZINC001210953351 1134338270 /nfs/dbraw/zinc/33/82/70/1134338270.db2.gz HXFOSKZIJYRBSO-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO C[NH2+][C@H]1C[C@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001217955546 1135030156 /nfs/dbraw/zinc/03/01/56/1135030156.db2.gz VYSMJSYGGKBGTQ-HDJSIYSDSA-N 1 0 278.355 3.517 20 5 CHBDRO c1cc2ccc3ccc(OC4C[NH2+]C4)c4ccc(c1)c2c34 ZINC001218049410 1135050177 /nfs/dbraw/zinc/05/01/77/1135050177.db2.gz HWYXSTODACINRP-UHFFFAOYSA-N 1 0 273.335 3.935 20 5 CHBDRO C[C@H]1C[C@@H](Oc2cccc3cc4ccccc4nc32)CC[NH2+]1 ZINC001218058409 1135052302 /nfs/dbraw/zinc/05/23/02/1135052302.db2.gz WYLFGFUZJQQHQO-BBRMVZONSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H](Oc1c2ccccc2cc2ccccc21)C1C[NH2+]C1 ZINC001218198605 1135068137 /nfs/dbraw/zinc/06/81/37/1135068137.db2.gz NVIWNHBUOAFCHA-ZDUSSCGKSA-N 1 0 277.367 3.980 20 5 CHBDRO C[C@@H](Oc1ccc2cc3ccccc3cc2c1)C1C[NH2+]C1 ZINC001218199094 1135068267 /nfs/dbraw/zinc/06/82/67/1135068267.db2.gz ZTXUIKIXUZTXDW-CYBMUJFWSA-N 1 0 277.367 3.980 20 5 CHBDRO C[C@@H]1CC[NH2+]C[C@@H]1Oc1nccc2c3ccccc3ccc21 ZINC001218484338 1135114127 /nfs/dbraw/zinc/11/41/27/1135114127.db2.gz RSTBFNDRWDUFMY-ACJLOTCBSA-N 1 0 292.382 3.765 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1cccc([N+](=O)[O-])c1 ZINC000316885947 1135170683 /nfs/dbraw/zinc/17/06/83/1135170683.db2.gz VYNDSWCDHTZGTR-LRDDRELGSA-N 1 0 297.358 3.718 20 5 CHBDRO C[C@H](O[C@H]1CC[C@H]([NH+](C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC001223432523 1135345306 /nfs/dbraw/zinc/34/53/06/1135345306.db2.gz VIZPBSJINYYFAP-NOLJZWGESA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@@H](OCCC[N+](C)(C)C)c1csc(Cl)c1 ZINC001224620769 1135462208 /nfs/dbraw/zinc/46/22/08/1135462208.db2.gz AXDYUVBCGOTKRA-SNVBAGLBSA-N 1 0 262.826 3.575 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccccc1Cc1ccccc1 ZINC001225222170 1135517766 /nfs/dbraw/zinc/51/77/66/1135517766.db2.gz XUWBCBPRAPKTFI-MRXNPFEDSA-N 1 0 284.423 3.751 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1c(Cl)cc(F)cc1Cl ZINC001226006676 1135651696 /nfs/dbraw/zinc/65/16/96/1135651696.db2.gz XVVCPGUYJUQARH-MRVPVSSYSA-N 1 0 281.178 3.606 20 5 CHBDRO C[C@H](C[NH+](C)C)Oc1nc2ccccc2c2ccccc21 ZINC001226992080 1135772369 /nfs/dbraw/zinc/77/23/69/1135772369.db2.gz HTVAVUXHJFNBSH-CYBMUJFWSA-N 1 0 280.371 3.717 20 5 CHBDRO CC[C@H]([NH2+]CCNc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000352776825 529603712 /nfs/dbraw/zinc/60/37/12/529603712.db2.gz DTFHASWDLKFFQU-KRWDZBQOSA-N 1 0 299.374 3.748 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C2CCC2)cc1[N+](=O)[O-] ZINC000090217583 260240187 /nfs/dbraw/zinc/24/01/87/260240187.db2.gz HYWNFSHSRLNHTQ-RYUDHWBXSA-N 1 0 262.353 3.742 20 5 CHBDRO CC[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)C ZINC000574788788 335047593 /nfs/dbraw/zinc/04/75/93/335047593.db2.gz KDYFXZFSVMYNTG-OAHLLOKOSA-N 1 0 289.379 3.643 20 5 CHBDRO Cc1c(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000519968895 260035533 /nfs/dbraw/zinc/03/55/33/260035533.db2.gz UFZFOHOFEHLEQK-DOMZBBRYSA-N 1 0 276.380 3.914 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CC(C)(C)C)cc1[N+](=O)[O-] ZINC000179408650 260047080 /nfs/dbraw/zinc/04/70/80/260047080.db2.gz IOFPRUZEQGPKAG-NSHDSACASA-N 1 0 280.368 3.690 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000019981535 170959356 /nfs/dbraw/zinc/95/93/56/170959356.db2.gz LYYPYCLMZKZCLM-HUBLWGQQSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccs2)cc1[N+](=O)[O-] ZINC000020091125 170990367 /nfs/dbraw/zinc/99/03/67/170990367.db2.gz XTCCSSNRQRDPDQ-GFCCVEGCSA-N 1 0 290.388 3.858 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000020095897 170995019 /nfs/dbraw/zinc/99/50/19/170995019.db2.gz QUSCTFJKSJDIEK-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000020130148 171018735 /nfs/dbraw/zinc/01/87/35/171018735.db2.gz DSTRSRNUSFCSNX-SJKOYZFVSA-N 1 0 282.343 3.933 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(C)C)cc1[N+](=O)[O-] ZINC000020522582 171235572 /nfs/dbraw/zinc/23/55/72/171235572.db2.gz JGLKRVQAMWBLOI-NEPJUHHUSA-N 1 0 250.342 3.598 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000034959153 171904443 /nfs/dbraw/zinc/90/44/43/171904443.db2.gz GMLXAWJLCIDTCE-RISCZKNCSA-N 1 0 250.342 3.680 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)c2cccs2)cccc1[N+](=O)[O-] ZINC000035737039 172390426 /nfs/dbraw/zinc/39/04/26/172390426.db2.gz SKYGEMOYDDDGJF-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO CC[C@H]([NH2+]CCc1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000036721103 172657831 /nfs/dbraw/zinc/65/78/31/172657831.db2.gz GPOOVYCHCQBCQP-HNNXBMFYSA-N 1 0 290.388 3.940 20 5 CHBDRO O=[N+]([O-])c1cc(CN[C@@H]2CSc3ccccc32)cs1 ZINC000344440597 225075119 /nfs/dbraw/zinc/07/51/19/225075119.db2.gz VFWBYDFIVMXHLC-LLVKDONJSA-N 1 0 292.385 3.593 20 5 CHBDRO COCCC(C)(C)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000344695103 225129103 /nfs/dbraw/zinc/12/91/03/225129103.db2.gz BYPCTUPSXFIBKZ-UHFFFAOYSA-N 1 0 294.395 3.623 20 5 CHBDRO Cc1cccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000035230259 260016834 /nfs/dbraw/zinc/01/68/34/260016834.db2.gz URQGHWRETKZZJE-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000037668352 260115678 /nfs/dbraw/zinc/11/56/78/260115678.db2.gz XTPFYXSBCNHGHC-LLVKDONJSA-N 1 0 274.320 3.655 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000088747221 260234571 /nfs/dbraw/zinc/23/45/71/260234571.db2.gz UIDJKGNVZNTBMM-DZGCQCFKSA-N 1 0 260.337 3.744 20 5 CHBDRO CCN(Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1F ZINC000313616372 260305249 /nfs/dbraw/zinc/30/52/49/260305249.db2.gz FAHNWAQVRCOGJN-UHFFFAOYSA-N 1 0 294.351 3.818 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000517962640 260327362 /nfs/dbraw/zinc/32/73/62/260327362.db2.gz YZWCAZCPVXXMKS-ZWNOBZJWSA-N 1 0 296.317 3.750 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000040675949 260349936 /nfs/dbraw/zinc/34/99/36/260349936.db2.gz DZAWLAZWPLVMJQ-LBPRGKRZSA-N 1 0 288.347 3.698 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccoc1)c1cccc([N+](=O)[O-])c1 ZINC000129308403 260385010 /nfs/dbraw/zinc/38/50/10/260385010.db2.gz DMYQVRJVMQQVHP-HNNXBMFYSA-N 1 0 274.320 3.819 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCC1(C)C)c1ccccc1[N+](=O)[O-] ZINC000094322267 261184549 /nfs/dbraw/zinc/18/45/49/261184549.db2.gz HSQKIHKEPQIOHD-SMDDNHRTSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1cccc([N+](=O)[O-])c1 ZINC000183995639 262004947 /nfs/dbraw/zinc/00/49/47/262004947.db2.gz FVSBMLJBDJYTJA-BBRMVZONSA-N 1 0 292.379 3.595 20 5 CHBDRO CSCCCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000185160550 262043824 /nfs/dbraw/zinc/04/38/24/262043824.db2.gz QOFJAUXIGDSUGK-UHFFFAOYSA-N 1 0 282.409 3.526 20 5 CHBDRO CC(C)(C)C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000310907613 262181988 /nfs/dbraw/zinc/18/19/88/262181988.db2.gz BXWVIEBFWUPVGE-UHFFFAOYSA-N 1 0 250.342 3.509 20 5 CHBDRO C[C@H]([NH2+]C1CCC2(CC2)CC1)c1ccccc1[N+](=O)[O-] ZINC000488440071 262321674 /nfs/dbraw/zinc/32/16/74/262321674.db2.gz IVPPMUYQGKXNAH-LBPRGKRZSA-N 1 0 274.364 3.968 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)c2ccsc2)cccc1[N+](=O)[O-] ZINC000061363027 262396206 /nfs/dbraw/zinc/39/62/06/262396206.db2.gz RRFCGFRSRPMCIG-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)cc1[N+](=O)[O-] ZINC000187861138 263280332 /nfs/dbraw/zinc/28/03/32/263280332.db2.gz HLCYRONMGPJBHR-GXTWGEPZSA-N 1 0 292.379 3.511 20 5 CHBDRO CCC[C@H]([NH2+]C[C@H]1CC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000417340143 263803141 /nfs/dbraw/zinc/80/31/41/263803141.db2.gz ACKFVKLNWGLSBP-HIFRSBDPSA-N 1 0 274.364 3.826 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC(CC(F)F)C1 ZINC000425366755 264211916 /nfs/dbraw/zinc/21/19/16/264211916.db2.gz QWAVJFOVWFKXCM-VZUCSPMQSA-N 1 0 296.317 3.585 20 5 CHBDRO CCOC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000189348600 264292090 /nfs/dbraw/zinc/29/20/90/264292090.db2.gz FPAQHVOQYPIXCI-UKRRQHHQSA-N 1 0 294.395 3.615 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000094279353 265232411 /nfs/dbraw/zinc/23/24/11/265232411.db2.gz JEQAVMCCZLJAJX-CQSZACIVSA-N 1 0 262.353 3.653 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000094279352 265232465 /nfs/dbraw/zinc/23/24/65/265232465.db2.gz JEQAVMCCZLJAJX-AWEZNQCLSA-N 1 0 262.353 3.653 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000094321451 265236542 /nfs/dbraw/zinc/23/65/42/265236542.db2.gz BSNHDCKWOLLJQD-RISCZKNCSA-N 1 0 262.353 3.824 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000094323297 265236607 /nfs/dbraw/zinc/23/66/07/265236607.db2.gz KHVYQKQEOOHRLR-NSHDSACASA-N 1 0 268.382 3.715 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1F ZINC000094837836 265263163 /nfs/dbraw/zinc/26/31/63/265263163.db2.gz YTWHBLKSKVUYJD-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1occc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000358011656 266395651 /nfs/dbraw/zinc/39/56/51/266395651.db2.gz GRDGKZQOHMJUCZ-NSHDSACASA-N 1 0 274.320 3.655 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)cc1 ZINC000362932131 267063802 /nfs/dbraw/zinc/06/38/02/267063802.db2.gz UQOOGFUPIBAEEU-UHFFFAOYSA-N 1 0 299.305 3.505 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]C(C2CC2)C2CC2)cc1 ZINC000537982171 327709021 /nfs/dbraw/zinc/70/90/21/327709021.db2.gz NLKCJQBVHFNZJT-UHFFFAOYSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000537984296 327778333 /nfs/dbraw/zinc/77/83/33/327778333.db2.gz PFENMNBZRHQLOY-FDQGKXFDSA-N 1 0 296.370 3.877 20 5 CHBDRO CS[C@H]1CCC[C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000117393170 327831289 /nfs/dbraw/zinc/83/12/89/327831289.db2.gz JSHUQAMPNORMHB-KBPBESRZSA-N 1 0 294.420 3.667 20 5 CHBDRO CS[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000117393173 327831425 /nfs/dbraw/zinc/83/14/25/327831425.db2.gz JSHUQAMPNORMHB-ZIAGYGMSSA-N 1 0 294.420 3.667 20 5 CHBDRO Cc1ccccc1[C@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000040675893 328015554 /nfs/dbraw/zinc/01/55/54/328015554.db2.gz JOIZQSOZUPWSBQ-AWEZNQCLSA-N 1 0 284.359 3.797 20 5 CHBDRO COc1ccc(C[NH2+]CC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000063145521 328034511 /nfs/dbraw/zinc/03/45/11/328034511.db2.gz RKKBFEIIFPNYSC-UHFFFAOYSA-N 1 0 292.379 3.519 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](c2cccnc2)C2CC2)cc1[N+](=O)[O-] ZINC000340102861 328240103 /nfs/dbraw/zinc/24/01/03/328240103.db2.gz GUPIHLMQWJFLTP-KRWDZBQOSA-N 1 0 297.358 3.539 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000395140689 328617118 /nfs/dbraw/zinc/61/71/18/328617118.db2.gz FNULXZYNAVJXJG-NRWUCQMLSA-N 1 0 262.353 3.598 20 5 CHBDRO CC[C@H](C)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000049963579 328380048 /nfs/dbraw/zinc/38/00/48/328380048.db2.gz ZTSMYMWLRJQCTQ-UWVGGRQHSA-N 1 0 270.760 3.772 20 5 CHBDRO C[C@H](CC[NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000050015654 328381966 /nfs/dbraw/zinc/38/19/66/328381966.db2.gz NUDYFOAWFXQKEO-CQSZACIVSA-N 1 0 284.359 3.878 20 5 CHBDRO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000112676028 328445186 /nfs/dbraw/zinc/44/51/86/328445186.db2.gz ZRAJQXNVDKEQSQ-HZPDHXFCSA-N 1 0 276.380 3.899 20 5 CHBDRO COc1cc(C[NH2+][C@@H](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000563776998 328515408 /nfs/dbraw/zinc/51/54/08/328515408.db2.gz FOJGPUKMWWLLTR-LBPRGKRZSA-N 1 0 292.379 3.662 20 5 CHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000035257022 326815492 /nfs/dbraw/zinc/81/54/92/326815492.db2.gz YPCIHQHRDHAXFJ-DZGCQCFKSA-N 1 0 262.353 3.653 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000037010428 326834085 /nfs/dbraw/zinc/83/40/85/326834085.db2.gz RJKHNXIWNYSTLN-QGZVFWFLSA-N 1 0 284.359 3.878 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCCC[C@H]1C ZINC000255955120 327037229 /nfs/dbraw/zinc/03/72/29/327037229.db2.gz SZAPHYCDVLUGDT-IUODEOHRSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccc(F)cc1 ZINC000584183178 327062140 /nfs/dbraw/zinc/06/21/40/327062140.db2.gz XTBXQSIUAUVMTG-OAHLLOKOSA-N 1 0 286.306 3.511 20 5 CHBDRO C[C@@H]1CCC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000088195113 327130455 /nfs/dbraw/zinc/13/04/55/327130455.db2.gz LTJLEDDJBLEDTJ-OCCSQVGLSA-N 1 0 262.353 3.511 20 5 CHBDRO C[C@H]1CCC[C@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000088195110 327130474 /nfs/dbraw/zinc/13/04/74/327130474.db2.gz RIUBXHRJTWCZQF-STQMWFEESA-N 1 0 262.353 3.511 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(C(F)F)cc2)c1 ZINC000131384705 327161617 /nfs/dbraw/zinc/16/16/17/327161617.db2.gz RNWDWOKYGCRGOC-UHFFFAOYSA-N 1 0 292.285 3.822 20 5 CHBDRO CCOCC(C)(C)C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000561782506 327420520 /nfs/dbraw/zinc/42/05/20/327420520.db2.gz NLOKDLRAOGNTOC-CYBMUJFWSA-N 1 0 294.395 3.617 20 5 CHBDRO C[C@H]([NH2+][C@@H](C1CC1)C1CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000324713840 328782113 /nfs/dbraw/zinc/78/21/13/328782113.db2.gz XCYJCHRCKVQAET-MEDUHNTESA-N 1 0 274.364 3.824 20 5 CHBDRO CCC[C@@H]([NH2+]CC1(SC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000193825346 329063501 /nfs/dbraw/zinc/06/35/01/329063501.db2.gz QQVLFZDJUYQXDN-CQSZACIVSA-N 1 0 294.420 3.921 20 5 CHBDRO CCO[C@H](CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000178661222 329201822 /nfs/dbraw/zinc/20/18/22/329201822.db2.gz VVFXMRQNTKLIRX-CZUORRHYSA-N 1 0 294.395 3.697 20 5 CHBDRO CC[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000508989973 332853759 /nfs/dbraw/zinc/85/37/59/332853759.db2.gz GDCZBNVXMYCBKM-ZDUSSCGKSA-N 1 0 286.322 3.787 20 5 CHBDRO CC[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000508989972 332853909 /nfs/dbraw/zinc/85/39/09/332853909.db2.gz GDCZBNVXMYCBKM-CYBMUJFWSA-N 1 0 286.322 3.787 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)C(F)(F)F ZINC000548157554 329935748 /nfs/dbraw/zinc/93/57/48/329935748.db2.gz KWUPJSREKWIAHA-VHSXEESVSA-N 1 0 290.285 3.752 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CCC1=CCCC1 ZINC000255588264 329965950 /nfs/dbraw/zinc/96/59/50/329965950.db2.gz MYKZSBDNGQWXOW-UITAMQMPSA-N 1 0 272.348 3.698 20 5 CHBDRO Cc1ccc(C[N@@H+](C)[C@@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000433035692 330128398 /nfs/dbraw/zinc/12/83/98/330128398.db2.gz NRGAOLBONJSEKA-SMDDNHRTSA-N 1 0 262.353 3.524 20 5 CHBDRO C[C@@H]([NH2+]CC1=CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000379588857 330137861 /nfs/dbraw/zinc/13/78/61/330137861.db2.gz PUUMICBBSRHPPV-GFCCVEGCSA-N 1 0 260.337 3.746 20 5 CHBDRO CC(C)[C@H]1CC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000445428456 330216114 /nfs/dbraw/zinc/21/61/14/330216114.db2.gz WJGOQIDUDYUYKD-JSGCOSHPSA-N 1 0 262.353 3.634 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000035648746 330248191 /nfs/dbraw/zinc/24/81/91/330248191.db2.gz NRFPQAOGBAHQBP-SMDDNHRTSA-N 1 0 262.353 3.572 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCCC1CC1)C1CC1 ZINC000536857104 330252229 /nfs/dbraw/zinc/25/22/29/330252229.db2.gz KCHIQEQSQSRGHV-INIZCTEOSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1(C)CC1 ZINC000536878904 330313497 /nfs/dbraw/zinc/31/34/97/330313497.db2.gz YJXUZIJSDZOGML-CYBMUJFWSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCOCCC(C)C)cc1[N+](=O)[O-] ZINC000045093983 330338428 /nfs/dbraw/zinc/33/84/28/330338428.db2.gz VYUBMQGOXUSWRY-CQSZACIVSA-N 1 0 294.395 3.617 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2C[C@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000424334396 330342887 /nfs/dbraw/zinc/34/28/87/330342887.db2.gz VKTNTYLDFINJRO-BYCMXARLSA-N 1 0 274.364 3.742 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000045628993 330347284 /nfs/dbraw/zinc/34/72/84/330347284.db2.gz NXJUDYMCCJNWQP-CHWSQXEVSA-N 1 0 260.337 3.602 20 5 CHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCCCCC1 ZINC000108079905 330351811 /nfs/dbraw/zinc/35/18/11/330351811.db2.gz AEUNHGUZPYUVNZ-UHFFFAOYSA-N 1 0 276.380 3.792 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@]1(C)CCCS1 ZINC000120443188 330387945 /nfs/dbraw/zinc/38/79/45/330387945.db2.gz QAYBZCAKNUKLSQ-SWLSCSKDSA-N 1 0 294.420 3.840 20 5 CHBDRO Cc1ccc(C[NH2+]CC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000058872511 330392074 /nfs/dbraw/zinc/39/20/74/330392074.db2.gz IVPYKKXGONSZGX-UHFFFAOYSA-N 1 0 276.380 3.819 20 5 CHBDRO C[C@@]1([NH2+]Cc2ccccc2[N+](=O)[O-])CCCc2ccccc21 ZINC000537595967 330443432 /nfs/dbraw/zinc/44/34/32/330443432.db2.gz GSDLLRLPYFYAHZ-GOSISDBHSA-N 1 0 296.370 3.936 20 5 CHBDRO C[C@@H]1C[C@@H]1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433161404 330618544 /nfs/dbraw/zinc/61/85/44/330618544.db2.gz RGMOXPFYIXQSRN-UEKVPHQBSA-N 1 0 274.364 3.563 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1CCC2(CC2)CC1 ZINC000434772250 330644842 /nfs/dbraw/zinc/64/48/42/330644842.db2.gz CMCJEBPKPLXTDF-HYXAFXHYSA-N 1 0 286.375 3.920 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CC13CCCC3)CCC2 ZINC000447599009 330872895 /nfs/dbraw/zinc/87/28/95/330872895.db2.gz IODNHCUPKCBYCP-HOTGVXAUSA-N 1 0 286.375 3.895 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000449299007 330912904 /nfs/dbraw/zinc/91/29/04/330912904.db2.gz JYTZPEQTCINCFA-NEPJUHHUSA-N 1 0 298.333 3.551 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000162483346 330919285 /nfs/dbraw/zinc/91/92/85/330919285.db2.gz YJNBTYQNAZHMIJ-YPMHNXCESA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H]1CCCCC1(F)F ZINC000449376912 330920576 /nfs/dbraw/zinc/92/05/76/330920576.db2.gz NGEJUZUCMVWVOL-ZDUSSCGKSA-N 1 0 298.333 3.818 20 5 CHBDRO CC(C)=CCC[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000449442188 330925841 /nfs/dbraw/zinc/92/58/41/330925841.db2.gz KATAFGSPSUNVDM-LLVKDONJSA-N 1 0 268.382 3.881 20 5 CHBDRO CC[C@@H]1C[C@H]1C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000449483736 330929747 /nfs/dbraw/zinc/92/97/47/330929747.db2.gz KCPOJFHRNLFJBB-GUTXKFCHSA-N 1 0 276.380 3.552 20 5 CHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCC(F)(F)C1 ZINC000450941017 331008224 /nfs/dbraw/zinc/00/82/24/331008224.db2.gz PGVBZXYQBIRBKS-ZDUSSCGKSA-N 1 0 298.333 3.505 20 5 CHBDRO CCC[C@@H]([NH2+][C@@H]1CCC[C@H]1OC)c1cccc([N+](=O)[O-])c1 ZINC000453323991 331116831 /nfs/dbraw/zinc/11/68/31/331116831.db2.gz KIERCRVRXGXKPN-BZUAXINKSA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CCC1CC(F)(F)C1 ZINC000453593813 331135395 /nfs/dbraw/zinc/13/53/95/331135395.db2.gz VMHKZYCJZGGURD-HWKANZROSA-N 1 0 296.317 3.633 20 5 CHBDRO Cc1cccc2c1CC[C@@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468004599 331426530 /nfs/dbraw/zinc/42/65/30/331426530.db2.gz LORIETQHLJQAHQ-KRWDZBQOSA-N 1 0 296.370 3.723 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccs1 ZINC000468648349 331438213 /nfs/dbraw/zinc/43/82/13/331438213.db2.gz OYLWHOVOUHPSNG-WQLSENKSSA-N 1 0 288.372 3.849 20 5 CHBDRO CC(C)=CCC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479276764 331723436 /nfs/dbraw/zinc/72/34/36/331723436.db2.gz CORDXDGSDDEQKD-INIZCTEOSA-N 1 0 288.391 3.862 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])[C@H](C)C1 ZINC000481185162 331800462 /nfs/dbraw/zinc/80/04/62/331800462.db2.gz DNJDAGIEHSWNPM-JTNHKYCSSA-N 1 0 280.343 3.648 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000482896200 331851449 /nfs/dbraw/zinc/85/14/49/331851449.db2.gz FLLGIKHDCNHOHE-CZUORRHYSA-N 1 0 296.370 3.975 20 5 CHBDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])CS1 ZINC000488420176 332006011 /nfs/dbraw/zinc/00/60/11/332006011.db2.gz PWJJBRDNFOVKFM-JSGCOSHPSA-N 1 0 294.420 3.605 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC(C)(C)C1 ZINC000490092079 332081008 /nfs/dbraw/zinc/08/10/08/332081008.db2.gz XYACLOMXGBMLBM-GFCCVEGCSA-N 1 0 262.353 3.696 20 5 CHBDRO CCc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cn1 ZINC000492154962 332384816 /nfs/dbraw/zinc/38/48/16/332384816.db2.gz USDJMMDCYKDMLI-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)CC1CC1 ZINC000492416213 332396549 /nfs/dbraw/zinc/39/65/49/332396549.db2.gz JKPOPMBQOORSRT-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO C[C@@H]1C[C@@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@H]1C ZINC000495068421 332503076 /nfs/dbraw/zinc/50/30/76/332503076.db2.gz KUZYLJPEZMJVDO-DVOMOZLQSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccc(C[NH2+]C(C)(C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000311737308 333071822 /nfs/dbraw/zinc/07/18/22/333071822.db2.gz ZTTSONLKWLXCJI-UHFFFAOYSA-N 1 0 264.369 3.818 20 5 CHBDRO C[C@H]([NH2+]Cc1cc(F)cc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178643232 333076347 /nfs/dbraw/zinc/07/63/47/333076347.db2.gz MQRBXNCKEUCMNW-JTQLQIEISA-N 1 0 292.285 3.724 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CC12CCCC2 ZINC000517173032 333093989 /nfs/dbraw/zinc/09/39/89/333093989.db2.gz POXNNIRFVXIGJW-ZFWWWQNUSA-N 1 0 272.348 3.504 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC[C@@H](F)C1 ZINC000517235844 333095520 /nfs/dbraw/zinc/09/55/20/333095520.db2.gz WTWNQEDJFBPMTH-OFCDUSSDSA-N 1 0 292.354 3.868 20 5 CHBDRO CCCc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000187136224 333168293 /nfs/dbraw/zinc/16/82/93/333168293.db2.gz ONMZKTLYLLHHLK-UHFFFAOYSA-N 1 0 284.359 3.837 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCC12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000189086178 333180591 /nfs/dbraw/zinc/18/05/91/333180591.db2.gz YVSVPPZFWXMSLK-WFASDCNBSA-N 1 0 274.364 3.968 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000230659893 333319835 /nfs/dbraw/zinc/31/98/35/333319835.db2.gz GSPMXODWJGTFBA-OBJOEFQTSA-N 1 0 262.353 3.682 20 5 CHBDRO CCC[C@@H]([NH2+]CC=C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000233295786 333351119 /nfs/dbraw/zinc/35/11/19/333351119.db2.gz MQYMCQPLIVECEV-OAHLLOKOSA-N 1 0 262.353 3.992 20 5 CHBDRO CC[C@H]1CCCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000524610295 333368748 /nfs/dbraw/zinc/36/87/48/333368748.db2.gz XRLISXNGBRSMOD-AWEZNQCLSA-N 1 0 292.379 3.628 20 5 CHBDRO CC1=C[C@H](C)C[C@@H](C[NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000235392129 333368858 /nfs/dbraw/zinc/36/88/58/333368858.db2.gz SWRYJQAQEYPDIY-GXTWGEPZSA-N 1 0 274.364 3.677 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000235579007 333370836 /nfs/dbraw/zinc/37/08/36/333370836.db2.gz ISNSWPUMMXHSKQ-SMDDNHRTSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@H](CC[NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000237462177 333379544 /nfs/dbraw/zinc/37/95/44/333379544.db2.gz MIXPYPHYVQJKLN-OAHLLOKOSA-N 1 0 298.386 3.921 20 5 CHBDRO CC(C)C[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000037260423 333525971 /nfs/dbraw/zinc/52/59/71/333525971.db2.gz DOLRANKKZGZLRZ-VXGBXAGGSA-N 1 0 250.342 3.680 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]CCC2CCCCC2)cs1 ZINC000037740191 333537238 /nfs/dbraw/zinc/53/72/38/333537238.db2.gz VWCUGJLHYFTXIT-UHFFFAOYSA-N 1 0 268.382 3.716 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)cc1 ZINC000538399649 333588667 /nfs/dbraw/zinc/58/86/67/333588667.db2.gz VWSBLOYCCWUCMY-RBSFLKMASA-N 1 0 274.364 3.653 20 5 CHBDRO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000539218443 333661768 /nfs/dbraw/zinc/66/17/68/333661768.db2.gz TZURSOICCKYTPZ-CHWSQXEVSA-N 1 0 299.374 3.964 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCCCS1 ZINC000541568353 333781018 /nfs/dbraw/zinc/78/10/18/333781018.db2.gz NDMGTCGTOASTIL-TZMCWYRMSA-N 1 0 294.420 3.840 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1ccc(F)cc1[N+](=O)[O-] ZINC000130241813 333825661 /nfs/dbraw/zinc/82/56/61/333825661.db2.gz VMPKSMOXAHYLQN-GFCCVEGCSA-N 1 0 297.374 3.656 20 5 CHBDRO CCC(CC)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000130708777 333868111 /nfs/dbraw/zinc/86/81/11/333868111.db2.gz WVMARLOIUUSMSZ-LBPRGKRZSA-N 1 0 264.369 3.990 20 5 CHBDRO C[C@@H](C[NH2+]CCc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000544404325 333929457 /nfs/dbraw/zinc/92/94/57/333929457.db2.gz KXRDKRZSDJUSFX-OAHLLOKOSA-N 1 0 298.386 3.606 20 5 CHBDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000564324904 334101140 /nfs/dbraw/zinc/10/11/40/334101140.db2.gz JIVDRTIKERMZED-JSGCOSHPSA-N 1 0 262.353 3.666 20 5 CHBDRO C[C@H]1CCCCC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000547931338 334129888 /nfs/dbraw/zinc/12/98/88/334129888.db2.gz JZHYRYDFUNLXLB-RNVIBTMRSA-N 1 0 274.364 3.873 20 5 CHBDRO C[C@H]([NH2+]CCC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000135457207 334130463 /nfs/dbraw/zinc/13/04/63/334130463.db2.gz BWOAWHKJAAZVKA-NSHDSACASA-N 1 0 250.342 3.682 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000078422222 334133281 /nfs/dbraw/zinc/13/32/81/334133281.db2.gz KHJCMLBAMCXPDL-NSHDSACASA-N 1 0 262.353 3.606 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCF)s2)cc1 ZINC000136511288 334156629 /nfs/dbraw/zinc/15/66/29/334156629.db2.gz IDHWSVFGXBCSAT-UHFFFAOYSA-N 1 0 294.351 3.773 20 5 CHBDRO CC1(C)CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000079977519 334164736 /nfs/dbraw/zinc/16/47/36/334164736.db2.gz ONTBNBLQELDUBZ-ZDUSSCGKSA-N 1 0 262.353 3.653 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC2CC(c3ccccc3)C2)c1 ZINC000549247417 334188823 /nfs/dbraw/zinc/18/88/23/334188823.db2.gz WUJNYPKAHHHUIB-UHFFFAOYSA-N 1 0 296.370 3.878 20 5 CHBDRO CC[C@@H]([NH2+][C@H]1CCC[C@H]1F)c1cccc([N+](=O)[O-])c1 ZINC000550934187 334234262 /nfs/dbraw/zinc/23/42/62/334234262.db2.gz XTXYKZYFLFXBQM-MCIONIFRSA-N 1 0 266.316 3.526 20 5 CHBDRO CC(F)(F)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000551240973 334242312 /nfs/dbraw/zinc/24/23/12/334242312.db2.gz IZEPLPJFKMCWHO-WCQYABFASA-N 1 0 298.333 3.551 20 5 CHBDRO CC(F)(F)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000551240971 334242354 /nfs/dbraw/zinc/24/23/54/334242354.db2.gz IZEPLPJFKMCWHO-DGCLKSJQSA-N 1 0 298.333 3.551 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC000247333956 334279247 /nfs/dbraw/zinc/27/92/47/334279247.db2.gz PZPARNVOTDXTTD-KRWDZBQOSA-N 1 0 296.370 3.802 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@H](c1ccccc1)C1CC1 ZINC000552060444 334282949 /nfs/dbraw/zinc/28/29/49/334282949.db2.gz VRVQNHGZZCQCCD-QGZVFWFLSA-N 1 0 296.370 3.878 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000552323679 334316935 /nfs/dbraw/zinc/31/69/35/334316935.db2.gz OQOPALRJXUZZDF-WKPIXPDZSA-N 1 0 274.364 3.705 20 5 CHBDRO C[C@H]([NH2+]CC(C1CC1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000088455752 334338833 /nfs/dbraw/zinc/33/88/33/334338833.db2.gz LCBZEFBRQVRSSM-NSHDSACASA-N 1 0 274.364 3.682 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC2(C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000090772751 334367712 /nfs/dbraw/zinc/36/77/12/334367712.db2.gz MBBCWCGGFXKBBR-LBPRGKRZSA-N 1 0 274.364 3.744 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@H]1C ZINC000252195128 334376219 /nfs/dbraw/zinc/37/62/19/334376219.db2.gz SFRMHZKYFACQCC-TYNCELHUSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)[C@H]1C ZINC000252434519 334379776 /nfs/dbraw/zinc/37/97/76/334379776.db2.gz YZDZCUFAZBCMCC-SCVCMEIPSA-N 1 0 268.382 3.571 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCCSC1 ZINC000554363281 334424864 /nfs/dbraw/zinc/42/48/64/334424864.db2.gz IEXGYDOJGBJVPU-STQMWFEESA-N 1 0 294.420 3.697 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CC12CCCC2 ZINC000555665808 334486705 /nfs/dbraw/zinc/48/67/05/334486705.db2.gz XTZSOAAWBLSMRH-WFASDCNBSA-N 1 0 274.364 3.887 20 5 CHBDRO CO[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C(C)(C)C ZINC000154945280 334708517 /nfs/dbraw/zinc/70/85/17/334708517.db2.gz ZWLPXJIVNAJMJZ-SWLSCSKDSA-N 1 0 294.395 3.615 20 5 CHBDRO CO[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C(C)(C)C ZINC000154945060 334708561 /nfs/dbraw/zinc/70/85/61/334708561.db2.gz ZWLPXJIVNAJMJZ-WFASDCNBSA-N 1 0 294.395 3.615 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000577191365 335320044 /nfs/dbraw/zinc/32/00/44/335320044.db2.gz ISVIIDYGCMTVQL-WBMJQRKESA-N 1 0 282.343 3.933 20 5 CHBDRO CCOCC(C)(C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000581035194 335999323 /nfs/dbraw/zinc/99/93/23/335999323.db2.gz LXAHNBNTLFDODG-CYBMUJFWSA-N 1 0 294.395 3.617 20 5 CHBDRO CCSCC[C@H](C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000581954012 336178734 /nfs/dbraw/zinc/17/87/34/336178734.db2.gz GPGXOAWDRSNGPP-SMDDNHRTSA-N 1 0 294.420 3.703 20 5 CHBDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)o1 ZINC000344594373 533817348 /nfs/dbraw/zinc/81/73/48/533817348.db2.gz BLJACOZSGWVRER-GFCCVEGCSA-N 1 0 288.347 3.607 20 5 CHBDRO CC(C)([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000291713836 519324292 /nfs/dbraw/zinc/32/42/92/519324292.db2.gz LTIAHONTLPSPHM-UHFFFAOYSA-N 1 0 288.322 3.759 20 5 CHBDRO CC(C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236712386 519726779 /nfs/dbraw/zinc/72/67/79/519726779.db2.gz HPHMIVHILZBZCU-UHFFFAOYSA-N 1 0 276.361 3.821 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000020141423 520782676 /nfs/dbraw/zinc/78/26/76/520782676.db2.gz NBRQCFNNPHJENL-MRXNPFEDSA-N 1 0 285.347 3.621 20 5 CHBDRO COCC(C)(C)CCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000287013241 522807960 /nfs/dbraw/zinc/80/79/60/522807960.db2.gz KSHQGFXXGOVBTL-CYBMUJFWSA-N 1 0 294.395 3.698 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ncccc1C)c1cccc([N+](=O)[O-])c1 ZINC000071339512 522895218 /nfs/dbraw/zinc/89/52/18/522895218.db2.gz QVJIVHRGHNSLGZ-OAHLLOKOSA-N 1 0 285.347 3.539 20 5 CHBDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000130172413 522965057 /nfs/dbraw/zinc/96/50/57/522965057.db2.gz NUKYCZJRQWGDDU-MRXNPFEDSA-N 1 0 299.374 3.881 20 5 CHBDRO CCc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000131361335 523941615 /nfs/dbraw/zinc/94/16/15/523941615.db2.gz WFNBVGQVYAXRNG-UHFFFAOYSA-N 1 0 290.388 3.817 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000049956724 524776310 /nfs/dbraw/zinc/77/63/10/524776310.db2.gz DUDYFFRJOSNGEP-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000037718976 525167994 /nfs/dbraw/zinc/16/79/94/525167994.db2.gz BSJSGXGPFPZRPZ-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@@H]([NH2+]CCc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000049153244 525467488 /nfs/dbraw/zinc/46/74/88/525467488.db2.gz DBXBNFOJXHKOAG-LLVKDONJSA-N 1 0 276.361 3.550 20 5 CHBDRO CSC[C@@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000292453506 525652730 /nfs/dbraw/zinc/65/27/30/525652730.db2.gz PQTBXNRCVVKRHP-QWHCGFSZSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000036959967 525742988 /nfs/dbraw/zinc/74/29/88/525742988.db2.gz PWWPUWRYPQGLQO-NWDGAFQWSA-N 1 0 274.320 3.908 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@]2(C)CCCS2)cccc1[N+](=O)[O-] ZINC000120443669 525897349 /nfs/dbraw/zinc/89/73/49/525897349.db2.gz RKPIEPPSTSTOHP-DOMZBBRYSA-N 1 0 294.420 3.840 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH+]2CCC3(CCCC3)CC2)cs1 ZINC000353421491 527328803 /nfs/dbraw/zinc/32/88/03/527328803.db2.gz KSGDHEKLBYTBPH-UHFFFAOYSA-N 1 0 280.393 3.813 20 5 CHBDRO CC(C)(C)CC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000133824842 1125497782 /nfs/dbraw/zinc/49/77/82/1125497782.db2.gz IAVIIYFUUAMYSX-UHFFFAOYSA-N 1 0 270.760 3.774 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000050345061 1125504342 /nfs/dbraw/zinc/50/43/42/1125504342.db2.gz UOXXBTIWPOKQIB-JTQLQIEISA-N 1 0 262.334 3.507 20 5 CHBDRO CC1(C)CC[C@@H]1[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000348304008 1125505827 /nfs/dbraw/zinc/50/58/27/1125505827.db2.gz NOZZOBZPQRLWFU-GJZGRUSLSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001190660482 1122548448 /nfs/dbraw/zinc/54/84/48/1122548448.db2.gz KEHREJCNUDZGOP-LLVKDONJSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@H](OCCC[N+](C)(C)C)c1cccc(C(F)(F)F)c1 ZINC001224620283 1135462662 /nfs/dbraw/zinc/46/26/62/1135462662.db2.gz WALPWWWTYYXWAR-LBPRGKRZSA-N 1 0 290.349 3.879 20 5 CHBDRO C[C@@]1(C2CCCCC2)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886312163 1125669035 /nfs/dbraw/zinc/66/90/35/1125669035.db2.gz VIPAVMSPVARUGN-INIZCTEOSA-N 1 0 289.379 3.535 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH2+]CCc2ccc(Cl)cc2)cs1 ZINC000037562559 1125788882 /nfs/dbraw/zinc/78/88/82/1125788882.db2.gz FZSFQBRTGZNKEJ-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO C[C@@H](CSC(C)(C)C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000766193678 1129281591 /nfs/dbraw/zinc/28/15/91/1129281591.db2.gz OKEVFOVWWIMDEE-LBPRGKRZSA-N 1 0 296.436 3.647 20 5 CHBDRO CCCCC[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000042308114 1126733596 /nfs/dbraw/zinc/73/35/96/1126733596.db2.gz SHWHUAKIDXXJHB-LBPRGKRZSA-N 1 0 280.368 3.662 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H](C)C1 ZINC000482293841 1126749510 /nfs/dbraw/zinc/74/95/10/1126749510.db2.gz SHQXIQMASYJZNX-GFCCVEGCSA-N 1 0 262.353 3.525 20 5 CHBDRO CCOc1ccc([N+](=O)[O-])cc1CN1CCC(C)=C(C)C1 ZINC000482457082 1126756888 /nfs/dbraw/zinc/75/68/88/1126756888.db2.gz JBPBQDOBDMXFQM-UHFFFAOYSA-N 1 0 290.363 3.536 20 5 CHBDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000482489455 1126761048 /nfs/dbraw/zinc/76/10/48/1126761048.db2.gz KJWJYVJZIUHWQI-ABAIWWIYSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000482507479 1126762176 /nfs/dbraw/zinc/76/21/76/1126762176.db2.gz JNLYCRAWSMKSHQ-TZMCWYRMSA-N 1 0 262.353 3.524 20 5 CHBDRO CC[C@@H]([NH2+]CCCc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000181497566 1126856846 /nfs/dbraw/zinc/85/68/46/1126856846.db2.gz SFBVEZTXUVAAHT-QGZVFWFLSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@@H]([NH2+]Cc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000037177196 1126923117 /nfs/dbraw/zinc/92/31/17/1126923117.db2.gz AYIQGBCPOPVUEC-LLVKDONJSA-N 1 0 274.295 3.585 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cccs1)CCC2 ZINC000192605914 1126962498 /nfs/dbraw/zinc/96/24/98/1126962498.db2.gz ZFXIPUQCSBSTGJ-OAHLLOKOSA-N 1 0 288.372 3.824 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000037260533 1126984456 /nfs/dbraw/zinc/98/44/56/1126984456.db2.gz GARYVBMJXARMEN-NWDGAFQWSA-N 1 0 250.342 3.680 20 5 CHBDRO CC(C)CCC[C@@H](C)CCO[C@H](C)C[N+](C)(C)C ZINC001224771810 1126984525 /nfs/dbraw/zinc/98/45/25/1126984525.db2.gz SABMXUYFAZFFEB-HZPDHXFCSA-N 1 0 258.470 3.950 20 5 CHBDRO COc1ccc(C[NH2+]C[C@@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000042863337 1127080550 /nfs/dbraw/zinc/08/05/50/1127080550.db2.gz RPTFZNKNXYZFAG-JSGCOSHPSA-N 1 0 292.379 3.519 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2c3ccccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000111410777 1127126275 /nfs/dbraw/zinc/12/62/75/1127126275.db2.gz JQAZSFGBUJZAKC-FZKQIMNGSA-N 1 0 296.370 3.926 20 5 CHBDRO O=[N+]([O-])c1ccccc1CN(Cc1cccs1)C1CC1 ZINC000045006613 1127167101 /nfs/dbraw/zinc/16/71/01/1127167101.db2.gz QHPZASKRIAHTLM-UHFFFAOYSA-N 1 0 288.372 3.821 20 5 CHBDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000350046540 1127171416 /nfs/dbraw/zinc/17/14/16/1127171416.db2.gz FDXQIIPVUHQOPJ-CYBMUJFWSA-N 1 0 299.374 3.711 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1c(F)cccc1[N+](=O)[O-] ZINC000588977337 1127209192 /nfs/dbraw/zinc/20/91/92/1127209192.db2.gz WEWMUTZSDIWVGF-UHFFFAOYSA-N 1 0 268.332 3.744 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@@H](C2CC2)C1 ZINC000589209392 1127216221 /nfs/dbraw/zinc/21/62/21/1127216221.db2.gz KXHRHBVMMGDYNU-WUTVXBCWSA-N 1 0 286.375 3.730 20 5 CHBDRO CC1(C)C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000590204420 1127251348 /nfs/dbraw/zinc/25/13/48/1127251348.db2.gz IEXOXACGTIRLIE-WFASDCNBSA-N 1 0 292.354 3.744 20 5 CHBDRO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@@H]21 ZINC000590204440 1127251560 /nfs/dbraw/zinc/25/15/60/1127251560.db2.gz MMPXQBMFCIKLGR-LSDHHAIUSA-N 1 0 274.364 3.605 20 5 CHBDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000224276723 1127257120 /nfs/dbraw/zinc/25/71/20/1127257120.db2.gz CKTSNSINEHMNDS-IACUBPJLSA-N 1 0 294.420 3.838 20 5 CHBDRO CCS[C@@H]1CCCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000353611236 1127271261 /nfs/dbraw/zinc/27/12/61/1127271261.db2.gz YEQYOQKPFKENDO-OAHLLOKOSA-N 1 0 294.420 3.702 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H](F)C1)CCCC2 ZINC000591348166 1127298947 /nfs/dbraw/zinc/29/89/47/1127298947.db2.gz AXBFKUZLDQVIRO-WOSRLPQWSA-N 1 0 292.354 3.843 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC2=CCCC2)cc1[N+](=O)[O-] ZINC000592098263 1127336063 /nfs/dbraw/zinc/33/60/63/1127336063.db2.gz NHUNIHYRHNNCHA-GFCCVEGCSA-N 1 0 260.337 3.664 20 5 CHBDRO Cc1ccccc1C1([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000592140045 1127338928 /nfs/dbraw/zinc/33/89/28/1127338928.db2.gz WENASAHSMONBKR-UHFFFAOYSA-N 1 0 282.343 3.682 20 5 CHBDRO CC[C@H]([NH2+]C[C@H](C)CC(F)F)c1cccc([N+](=O)[O-])c1 ZINC000592392232 1127344565 /nfs/dbraw/zinc/34/45/65/1127344565.db2.gz JCDCTBDUEVWOGP-MFKMUULPSA-N 1 0 286.322 3.927 20 5 CHBDRO O[C@H]1CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000157665107 1127349074 /nfs/dbraw/zinc/34/90/74/1127349074.db2.gz OTBAFWFIUQXIGJ-INIZCTEOSA-N 1 0 277.367 3.560 20 5 CHBDRO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000358373379 1127418253 /nfs/dbraw/zinc/41/82/53/1127418253.db2.gz DGCNGKKPKULYIL-SJKOYZFVSA-N 1 0 297.358 3.792 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCCO1 ZINC000594518679 1127421207 /nfs/dbraw/zinc/42/12/07/1127421207.db2.gz IXHNHLRPVLAYJV-UHOFOFEASA-N 1 0 292.379 3.593 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1(C(F)F)CC1)CCC2 ZINC000358996302 1127443090 /nfs/dbraw/zinc/44/30/90/1127443090.db2.gz DHGNJPNDIWOISC-CYBMUJFWSA-N 1 0 296.317 3.607 20 5 CHBDRO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1CCC(F)CC1 ZINC000594988592 1127443698 /nfs/dbraw/zinc/44/36/98/1127443698.db2.gz AJTIECJAAPUERB-GCVQQVDUSA-N 1 0 286.372 3.663 20 5 CHBDRO CC(C)c1ccc(C[NH2+]C[C@]2(C)CC2(F)F)cc1[N+](=O)[O-] ZINC000594985312 1127443763 /nfs/dbraw/zinc/44/37/63/1127443763.db2.gz LEKGLAXHZAOVRZ-AWEZNQCLSA-N 1 0 298.333 3.853 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000595050180 1127451035 /nfs/dbraw/zinc/45/10/35/1127451035.db2.gz QSDOMJJEYNUKBQ-KBPBESRZSA-N 1 0 299.374 3.753 20 5 CHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1(C2CCC2)CC1 ZINC000595045841 1127451250 /nfs/dbraw/zinc/45/12/50/1127451250.db2.gz HWAFWMGYGYTJLB-NSHDSACASA-N 1 0 290.363 3.587 20 5 CHBDRO Cc1noc(C[N@@H+](CCC(C)C)C2CCCC2)c1[N+](=O)[O-] ZINC000595296741 1127457200 /nfs/dbraw/zinc/45/72/00/1127457200.db2.gz IGXFHAKRDDESQT-UHFFFAOYSA-N 1 0 295.383 3.682 20 5 CHBDRO CCSC1(C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000595100253 1127452277 /nfs/dbraw/zinc/45/22/77/1127452277.db2.gz QQLHIWAADDDRAS-CQSZACIVSA-N 1 0 294.420 3.921 20 5 CHBDRO CC(C)[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])C1CC1 ZINC000595107386 1127452808 /nfs/dbraw/zinc/45/28/08/1127452808.db2.gz XXWCNXNUEMLESL-HOCLYGCPSA-N 1 0 274.364 3.606 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCOC(C)(C)C ZINC000595075726 1127452812 /nfs/dbraw/zinc/45/28/12/1127452812.db2.gz BGMQWFVBCOSUQS-CYBMUJFWSA-N 1 0 294.395 3.759 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCCOC(C)(C)C)cccc1[N+](=O)[O-] ZINC000595075732 1127453037 /nfs/dbraw/zinc/45/30/37/1127453037.db2.gz BNBQKCMEXMGAGR-CYBMUJFWSA-N 1 0 294.395 3.759 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@H](C)O2)cc1[N+](=O)[O-] ZINC000595078908 1127453463 /nfs/dbraw/zinc/45/34/63/1127453463.db2.gz HGPNAELRXDIQKP-KCQAQPDRSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@]2(C)CC2(F)F)cccc1[N+](=O)[O-] ZINC000595080036 1127453575 /nfs/dbraw/zinc/45/35/75/1127453575.db2.gz NLMMJTWTNLOLFY-MFKMUULPSA-N 1 0 284.306 3.599 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](CC)C2CC2)cc1[N+](=O)[O-] ZINC000595082289 1127453678 /nfs/dbraw/zinc/45/36/78/1127453678.db2.gz XZXYZXXEFMESKQ-BXUZGUMPSA-N 1 0 292.379 3.833 20 5 CHBDRO CC[C@H]([NH2+]CCC(C)(C)F)c1cccc([N+](=O)[O-])c1 ZINC000595086605 1127454005 /nfs/dbraw/zinc/45/40/05/1127454005.db2.gz MCLPEHIEHTZZDD-ZDUSSCGKSA-N 1 0 268.332 3.774 20 5 CHBDRO CC[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000595091438 1127454267 /nfs/dbraw/zinc/45/42/67/1127454267.db2.gz IFPYBIWUGIWGBI-STQMWFEESA-N 1 0 298.333 3.927 20 5 CHBDRO CC[C@@H](CC(F)F)C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000595289093 1127458373 /nfs/dbraw/zinc/45/83/73/1127458373.db2.gz NZBIOCDKTIIFOY-NSHDSACASA-N 1 0 286.322 3.708 20 5 CHBDRO Cc1noc(C[N@@H+]2CCC[C@@H](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000595321182 1127459433 /nfs/dbraw/zinc/45/94/33/1127459433.db2.gz KTIFFIJGHHBYCW-GFCCVEGCSA-N 1 0 295.383 3.539 20 5 CHBDRO CC(C)[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000359376201 1127460807 /nfs/dbraw/zinc/46/08/07/1127460807.db2.gz VBHFJKHJEXZIIE-KRWDZBQOSA-N 1 0 299.374 3.519 20 5 CHBDRO CC[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CC(F)F ZINC000595413704 1127461536 /nfs/dbraw/zinc/46/15/36/1127461536.db2.gz GBQMSDZJDJOAJQ-QWRGUYRKSA-N 1 0 286.322 3.927 20 5 CHBDRO CC(C)CC1([NH2+]Cc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000595832505 1127478657 /nfs/dbraw/zinc/47/86/57/1127478657.db2.gz WIHRQPUAJQNMJG-UHFFFAOYSA-N 1 0 284.306 3.541 20 5 CHBDRO CC(C)C1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000227832241 1127507905 /nfs/dbraw/zinc/50/79/05/1127507905.db2.gz SAMMCXCQYZVJQO-UHFFFAOYSA-N 1 0 282.771 3.774 20 5 CHBDRO C[C@@H]1CCC[N@@H+]1Cc1cccc(-c2ccc([N+](=O)[O-])nc2)c1 ZINC000596637411 1127513987 /nfs/dbraw/zinc/51/39/87/1127513987.db2.gz KTGLZCNZQGMCAD-CYBMUJFWSA-N 1 0 297.358 3.641 20 5 CHBDRO CC[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C[C@H](C)OC ZINC000361025656 1127531515 /nfs/dbraw/zinc/53/15/15/1127531515.db2.gz NWQPSNOVCAYITH-ZDUSSCGKSA-N 1 0 294.395 3.575 20 5 CHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]4C[C@H]4C3)o2)cc1 ZINC000597222439 1127536066 /nfs/dbraw/zinc/53/60/66/1127536066.db2.gz CMZYBDVSSKRDQH-KBPBESRZSA-N 1 0 298.342 3.697 20 5 CHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CC1(F)F ZINC000602560638 1127592727 /nfs/dbraw/zinc/59/27/27/1127592727.db2.gz ODBFJCVENKCRMK-SMDDNHRTSA-N 1 0 298.333 3.551 20 5 CHBDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000362187307 1127617945 /nfs/dbraw/zinc/61/79/45/1127617945.db2.gz DBZJOXICYSYMHD-ZYHUDNBSSA-N 1 0 296.342 3.505 20 5 CHBDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000362187304 1127617958 /nfs/dbraw/zinc/61/79/58/1127617958.db2.gz DBZJOXICYSYMHD-CMPLNLGQSA-N 1 0 296.342 3.505 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC[C@@H]2CC2(F)F)cc1[N+](=O)[O-] ZINC000598647363 1127630612 /nfs/dbraw/zinc/63/06/12/1127630612.db2.gz LCRZGJOSQQWZKZ-GFCCVEGCSA-N 1 0 298.333 3.853 20 5 CHBDRO CCC(=O)CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000295441103 1127643207 /nfs/dbraw/zinc/64/32/07/1127643207.db2.gz GJXHFAGIWOJRHA-UHFFFAOYSA-N 1 0 292.379 3.565 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]CC2CC=CC2)cc1[N+](=O)[O-] ZINC000599063787 1127654794 /nfs/dbraw/zinc/65/47/94/1127654794.db2.gz HOWHRKATVSNJLK-LBPRGKRZSA-N 1 0 290.363 3.610 20 5 CHBDRO CC[C@H]([NH2+]C1(C2CCC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000593725254 1127666956 /nfs/dbraw/zinc/66/69/56/1127666956.db2.gz WMJFNCGIHHSUIU-HNNXBMFYSA-N 1 0 274.364 3.968 20 5 CHBDRO CCC(CC)[N@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000604434832 1127705370 /nfs/dbraw/zinc/70/53/70/1127705370.db2.gz YNBOXEKUWLQOHI-UHFFFAOYSA-N 1 0 292.379 3.627 20 5 CHBDRO C[NH+](C)C1(CNc2ccsc2[N+](=O)[O-])CCCCCC1 ZINC000604433356 1127705532 /nfs/dbraw/zinc/70/55/32/1127705532.db2.gz JJKKWTYSTWGRJK-UHFFFAOYSA-N 1 0 297.424 3.723 20 5 CHBDRO CSCCCCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000230149158 1127744187 /nfs/dbraw/zinc/74/41/87/1127744187.db2.gz SNEWHSWORORYFN-UHFFFAOYSA-N 1 0 282.409 3.608 20 5 CHBDRO CCCC[NH+](CCCC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000062351171 1127748485 /nfs/dbraw/zinc/74/84/85/1127748485.db2.gz VMLMHOYMEUQHBJ-MRXNPFEDSA-N 1 0 294.395 3.530 20 5 CHBDRO C[C@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000608976740 1127896549 /nfs/dbraw/zinc/89/65/49/1127896549.db2.gz MFNCBMLEDZODOL-CQSZACIVSA-N 1 0 284.359 3.830 20 5 CHBDRO C[C@@H](C[N@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000608977261 1127895988 /nfs/dbraw/zinc/89/59/88/1127895988.db2.gz WKZSUSWFCJKPLH-AWEZNQCLSA-N 1 0 284.359 3.830 20 5 CHBDRO C[C@@H](C[N@H+](C)Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000608976710 1127896728 /nfs/dbraw/zinc/89/67/28/1127896728.db2.gz JGMIVFLSDZQIPS-AWEZNQCLSA-N 1 0 284.359 3.830 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccccc1[N+](=O)[O-] ZINC000429795848 1127904645 /nfs/dbraw/zinc/90/46/45/1127904645.db2.gz ZTOXBWUCNRWPRL-WDEREUQCSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@H]1CC=CCC1 ZINC000544116848 1127959654 /nfs/dbraw/zinc/95/96/54/1127959654.db2.gz KKGCFDFTKBKRJQ-UONOGXRCSA-N 1 0 274.364 3.944 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CC=CCC1 ZINC000540172292 1127966023 /nfs/dbraw/zinc/96/60/23/1127966023.db2.gz YDMOGPHCKUBPDF-OLZOCXBDSA-N 1 0 260.337 3.663 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000544610925 1127978304 /nfs/dbraw/zinc/97/83/04/1127978304.db2.gz FOEKJJCZEODVTK-GASCZTMLSA-N 1 0 274.364 3.525 20 5 CHBDRO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000544612067 1127979575 /nfs/dbraw/zinc/97/95/75/1127979575.db2.gz XCLWUGLXMADCNQ-SMDDNHRTSA-N 1 0 262.353 3.524 20 5 CHBDRO Cc1cccc2c1CC[C@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468004600 1127987227 /nfs/dbraw/zinc/98/72/27/1127987227.db2.gz LORIETQHLJQAHQ-QGZVFWFLSA-N 1 0 296.370 3.723 20 5 CHBDRO CC[N@H+](CCC1CC1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000544896330 1127989319 /nfs/dbraw/zinc/98/93/19/1127989319.db2.gz AXRANWKTBXKAMA-LBPRGKRZSA-N 1 0 262.353 3.778 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]2C2CC2)c(Cl)c1 ZINC000468031402 1127988393 /nfs/dbraw/zinc/98/83/93/1127988393.db2.gz QAUXQJNIQITSEK-UKRRQHHQSA-N 1 0 294.782 3.917 20 5 CHBDRO CC[C@]1(C)CC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000468136739 1127995003 /nfs/dbraw/zinc/99/50/03/1127995003.db2.gz AIXQRXXTNGOSSU-OAHLLOKOSA-N 1 0 262.353 3.525 20 5 CHBDRO CS[C@@H]1CCCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468258102 1128000377 /nfs/dbraw/zinc/00/03/77/1128000377.db2.gz AVGHYVXOISAXKT-QWHCGFSZSA-N 1 0 294.420 3.873 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC[C@@H](C)C1 ZINC000468257579 1127999290 /nfs/dbraw/zinc/99/92/90/1127999290.db2.gz SUNANIUJYJEGTC-OLZOCXBDSA-N 1 0 262.353 3.778 20 5 CHBDRO COc1cc(C[N@H+](C)[C@H](C)C(C)(C)C)c([N+](=O)[O-])cc1F ZINC000545206066 1128004463 /nfs/dbraw/zinc/00/44/63/1128004463.db2.gz IKNCFIIPABOJFX-SNVBAGLBSA-N 1 0 298.358 3.609 20 5 CHBDRO CC(C)[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000324061633 1128005065 /nfs/dbraw/zinc/00/50/65/1128005065.db2.gz BVPCYXPBWQOHJU-NHYWBVRUSA-N 1 0 262.353 3.680 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC=CCC1 ZINC000468650537 1128014974 /nfs/dbraw/zinc/01/49/74/1128014974.db2.gz YUBCSTGZFDHHMP-BAAYTWLHSA-N 1 0 286.375 3.944 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C)[C@H]1C ZINC000541770315 1128038426 /nfs/dbraw/zinc/03/84/26/1128038426.db2.gz FDVKOJSTSDDTCB-DGCLKSJQSA-N 1 0 262.353 3.524 20 5 CHBDRO CC(C)CSCCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000443627466 1128043650 /nfs/dbraw/zinc/04/36/50/1128043650.db2.gz QAHVXQZMTDSGSC-UHFFFAOYSA-N 1 0 296.436 3.806 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C(C1CC1)C1CC1 ZINC000542000351 1128047445 /nfs/dbraw/zinc/04/74/45/1128047445.db2.gz QJDVQODFBHKACM-UHFFFAOYSA-N 1 0 294.782 3.869 20 5 CHBDRO CC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C(C)C ZINC000470175012 1128064693 /nfs/dbraw/zinc/06/46/93/1128064693.db2.gz XPXLXIXXLRYZRP-UKTHLTGXSA-N 1 0 262.353 3.728 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C)[C@@H]1C ZINC000470180542 1128064912 /nfs/dbraw/zinc/06/49/12/1128064912.db2.gz OQZOPUGEGPPXTC-BHBDMTODSA-N 1 0 274.364 3.728 20 5 CHBDRO Cc1cccc2c1[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CC2 ZINC000925310532 1128128173 /nfs/dbraw/zinc/12/81/73/1128128173.db2.gz MXPZZOCJGVILAX-OAHLLOKOSA-N 1 0 282.343 3.680 20 5 CHBDRO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC(C)C ZINC000761505994 1128132211 /nfs/dbraw/zinc/13/22/11/1128132211.db2.gz KZMINJVZOHHIHC-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761509957 1128132447 /nfs/dbraw/zinc/13/24/47/1128132447.db2.gz DTMUUCRIJJJGAC-UHFFFAOYSA-N 1 0 290.750 3.880 20 5 CHBDRO C[C@H]1CCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519540 1128132972 /nfs/dbraw/zinc/13/29/72/1128132972.db2.gz BILLYDYJKVYZNX-JOYOIKCWSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609194477 1128170672 /nfs/dbraw/zinc/17/06/72/1128170672.db2.gz OHIWICHNTNMWTR-AWEZNQCLSA-N 1 0 292.379 3.756 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000609193717 1128170950 /nfs/dbraw/zinc/17/09/50/1128170950.db2.gz YOMKLKZOQVROCG-CYBMUJFWSA-N 1 0 292.379 3.614 20 5 CHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1ccccc1[N+](=O)[O-] ZINC000301069829 1128301429 /nfs/dbraw/zinc/30/14/29/1128301429.db2.gz DMBYVDILCAFYIE-CQSZACIVSA-N 1 0 291.395 3.661 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000035648796 1128323946 /nfs/dbraw/zinc/32/39/46/1128323946.db2.gz DCRBHKBIAOVQFO-TYNCELHUSA-N 1 0 276.380 3.818 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)c1ccc(F)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000930594576 1128327383 /nfs/dbraw/zinc/32/73/83/1128327383.db2.gz MBGVRNNUTVPHRX-QWRGUYRKSA-N 1 0 289.310 3.541 20 5 CHBDRO C[C@@H](C[N@@H+]1Cc2ccc([N+](=O)[O-])cc2C1)C(C)(C)C ZINC001327187824 1128345210 /nfs/dbraw/zinc/34/52/10/1128345210.db2.gz NGJAEKXTKABHSZ-NSHDSACASA-N 1 0 262.353 3.593 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C2CC(c3ccccc3)C2)cc1 ZINC000194415674 1128377898 /nfs/dbraw/zinc/37/78/98/1128377898.db2.gz CTRLXVNIUNNPIH-UHFFFAOYSA-N 1 0 296.370 3.673 20 5 CHBDRO CSCC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000932594884 1128416986 /nfs/dbraw/zinc/41/69/86/1128416986.db2.gz JPZGWSGLOOBRIE-LBPRGKRZSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1cncs1 ZINC000934194817 1128453564 /nfs/dbraw/zinc/45/35/64/1128453564.db2.gz HPPMIMUIMVJBTI-QWRGUYRKSA-N 1 0 291.376 3.772 20 5 CHBDRO C[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154218699 1128460068 /nfs/dbraw/zinc/46/00/68/1128460068.db2.gz DYOMXPPFKYKFSU-AOOOYVTPSA-N 1 0 268.744 3.621 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]C1CC=CC1 ZINC000130505912 1128493380 /nfs/dbraw/zinc/49/33/80/1128493380.db2.gz IHXOKNYQBWPKIY-CJNGLKHVSA-N 1 0 286.375 3.614 20 5 CHBDRO CC1([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCCC1 ZINC000042176795 1128568092 /nfs/dbraw/zinc/56/80/92/1128568092.db2.gz XYSYLRPIVUTTRL-UHFFFAOYSA-N 1 0 268.744 3.671 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@H](F)C1 ZINC000570720116 1128630673 /nfs/dbraw/zinc/63/06/73/1128630673.db2.gz ZVLDHTVUGOKUKC-VHDGCEQUSA-N 1 0 294.370 3.786 20 5 CHBDRO Cc1ccc(-c2cccc([C@H]3CCC[NH2+]3)c2)cc1[N+](=O)[O-] ZINC000600788931 1128681738 /nfs/dbraw/zinc/68/17/38/1128681738.db2.gz BZSXODCBGFYNRU-MRXNPFEDSA-N 1 0 282.343 3.995 20 5 CHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000609440710 1128714392 /nfs/dbraw/zinc/71/43/92/1128714392.db2.gz ITNVFKHHSXLHCN-KRWDZBQOSA-N 1 0 296.370 3.989 20 5 CHBDRO CC(C)(C)C1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609705576 1128722867 /nfs/dbraw/zinc/72/28/67/1128722867.db2.gz JSJVSQGUAQYFHS-UHFFFAOYSA-N 1 0 290.407 3.895 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000609846172 1128728732 /nfs/dbraw/zinc/72/87/32/1128728732.db2.gz NXCFYEYUTALFMI-RTXFEEFZSA-N 1 0 280.393 3.809 20 5 CHBDRO CC(C)CC[N@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000072579059 1117769449 /nfs/dbraw/zinc/76/94/49/1117769449.db2.gz YWGMHBHCPDOTAA-GFCCVEGCSA-N 1 0 250.342 3.634 20 5 CHBDRO Cc1ccoc1C[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000430152710 1117786800 /nfs/dbraw/zinc/78/68/00/1117786800.db2.gz XFIVYPMTAJVWKZ-FNORWQNLSA-N 1 0 286.331 3.641 20 5 CHBDRO CC[C@H]1CC[N@@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000430193496 1117834553 /nfs/dbraw/zinc/83/45/53/1117834553.db2.gz FJBQNRBUSIOIIH-ZDUSSCGKSA-N 1 0 262.353 3.703 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)C1CCCCC1 ZINC000430208370 1117870459 /nfs/dbraw/zinc/87/04/59/1117870459.db2.gz OPHVLKLVRLQSMF-UHFFFAOYSA-N 1 0 292.379 3.758 20 5 CHBDRO CC1(C)CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000610216291 1117884028 /nfs/dbraw/zinc/88/40/28/1117884028.db2.gz GOMVZRCAATWAMY-UHFFFAOYSA-N 1 0 262.353 3.607 20 5 CHBDRO Cc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cs1 ZINC000336814677 1117938184 /nfs/dbraw/zinc/93/81/84/1117938184.db2.gz XTFOJTPYIUOERK-UHFFFAOYSA-N 1 0 276.361 3.563 20 5 CHBDRO CC[C@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000509535926 1117958447 /nfs/dbraw/zinc/95/84/47/1117958447.db2.gz AEDVNCQHEJFENM-MRZGDXHCSA-N 1 0 274.364 3.730 20 5 CHBDRO CC1=C[C@H](C)C[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000430284711 1117993058 /nfs/dbraw/zinc/99/30/58/1117993058.db2.gz OVDUSJLZULTVCY-AAEUAGOBSA-N 1 0 260.337 3.554 20 5 CHBDRO CC1=C[C@H](C)C[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000430284714 1117993272 /nfs/dbraw/zinc/99/32/72/1117993272.db2.gz OVDUSJLZULTVCY-WCQYABFASA-N 1 0 260.337 3.554 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccoc1C ZINC000615720624 1128760646 /nfs/dbraw/zinc/76/06/46/1128760646.db2.gz YKOJKEHXGUVNOY-XYOKQWHBSA-N 1 0 286.331 3.689 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCC(F)(F)C1 ZINC000615721950 1128761030 /nfs/dbraw/zinc/76/10/30/1128761030.db2.gz MNRVKJVMIHEPOD-LWMSPQMPSA-N 1 0 296.317 3.776 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H]1C1CC1 ZINC000615835589 1128764244 /nfs/dbraw/zinc/76/42/44/1128764244.db2.gz TYWXAQDVWOAMFW-RTGRKSDTSA-N 1 0 286.375 3.873 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)CC(F)(F)F)cccc1[N+](=O)[O-] ZINC000468044373 1118293107 /nfs/dbraw/zinc/29/31/07/1118293107.db2.gz HLKREVCOIUKOLK-SCZZXKLOSA-N 1 0 290.285 3.895 20 5 CHBDRO CC[C@@H]1CCC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000071120257 1118436843 /nfs/dbraw/zinc/43/68/43/1118436843.db2.gz DMAMXXAIVRHYMV-HIFRSBDPSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc(C[N@H+]2CC3(CCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000432789117 1118478625 /nfs/dbraw/zinc/47/86/25/1118478625.db2.gz PMNWMWWOGKUKGW-ZDUSSCGKSA-N 1 0 274.364 3.668 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)n1 ZINC000616357119 1128787116 /nfs/dbraw/zinc/78/71/16/1128787116.db2.gz DILPHXRRRADDSM-CYBMUJFWSA-N 1 0 299.374 3.766 20 5 CHBDRO C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000493891819 1118644247 /nfs/dbraw/zinc/64/42/47/1118644247.db2.gz PXBAIKHJTULFTG-UHFFFAOYSA-N 1 0 294.782 3.869 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCSC2)cc1[N+](=O)[O-] ZINC000287138560 1118703295 /nfs/dbraw/zinc/70/32/95/1118703295.db2.gz SAMOIUMQRFPOCL-CHWSQXEVSA-N 1 0 294.420 3.697 20 5 CHBDRO CC[C@H]([NH2+]C1CC(C)(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000395286441 1118709982 /nfs/dbraw/zinc/70/99/82/1118709982.db2.gz HAUZJSOKYIMWAZ-AWEZNQCLSA-N 1 0 262.353 3.824 20 5 CHBDRO CCC[C@H]([NH2+][C@H](C)CSC)c1cccc([N+](=O)[O-])c1 ZINC000131566910 1118761783 /nfs/dbraw/zinc/76/17/83/1118761783.db2.gz BGDMMKJTYVYWTJ-RISCZKNCSA-N 1 0 282.409 3.777 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000610787689 1118869583 /nfs/dbraw/zinc/86/95/83/1118869583.db2.gz BBLNXMJBTASKCR-LBPRGKRZSA-N 1 0 298.333 3.996 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)C1CC1 ZINC000610805128 1118894692 /nfs/dbraw/zinc/89/46/92/1118894692.db2.gz AORNDYQWXYASFV-NEPJUHHUSA-N 1 0 262.353 3.600 20 5 CHBDRO COC(C)(C)C[N@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000535850285 1118907141 /nfs/dbraw/zinc/90/71/41/1118907141.db2.gz QEWDXCHZUABJBS-UHFFFAOYSA-N 1 0 294.395 3.575 20 5 CHBDRO C[C@H](C[N@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511105283 1119062386 /nfs/dbraw/zinc/06/23/86/1119062386.db2.gz IPWOJOIHKJRQOX-OAHLLOKOSA-N 1 0 298.386 3.873 20 5 CHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000479579261 1119125352 /nfs/dbraw/zinc/12/53/52/1119125352.db2.gz NTWFDMBBDZSRHX-WFASDCNBSA-N 1 0 262.353 3.605 20 5 CHBDRO CCC[C@H]([NH2+]C1CC=CC1)c1cccc([N+](=O)[O-])c1 ZINC000122060401 1119291654 /nfs/dbraw/zinc/29/16/54/1119291654.db2.gz KHXZQNKECDLLKT-HNNXBMFYSA-N 1 0 260.337 3.744 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccncc2)C1 ZINC000583603105 1119384147 /nfs/dbraw/zinc/38/41/47/1119384147.db2.gz UUMXNDKARUPQEH-HIFRSBDPSA-N 1 0 297.358 3.540 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000601306258 1119532352 /nfs/dbraw/zinc/53/23/52/1119532352.db2.gz DZKKSTLFKMUWBL-GRYCIOLGSA-N 1 0 288.269 3.586 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCOCC(C)C ZINC000163295313 1119766947 /nfs/dbraw/zinc/76/69/47/1119766947.db2.gz OXSPPWZWJYWAII-AWEZNQCLSA-N 1 0 294.395 3.617 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2)cc1[N+](=O)[O-] ZINC000414153612 1119919537 /nfs/dbraw/zinc/91/95/37/1119919537.db2.gz ZTIFKRMXJJGDQD-AEGPPILISA-N 1 0 292.379 3.510 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2F)cccc1[N+](=O)[O-] ZINC000414285556 1119966932 /nfs/dbraw/zinc/96/69/32/1119966932.db2.gz LUNCGLPPELUZOS-IACUBPJLSA-N 1 0 280.343 3.835 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2F)cc1[N+](=O)[O-] ZINC000414296445 1119970127 /nfs/dbraw/zinc/97/01/27/1119970127.db2.gz XVUOTQFUMFLHIM-MRVWCRGKSA-N 1 0 280.343 3.835 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NC1CCC(OC)CC1 ZINC001168613874 1120021911 /nfs/dbraw/zinc/02/19/11/1120021911.db2.gz IPLUQGOABPJVQW-UHFFFAOYSA-N 1 0 291.459 3.652 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C)CC[C@@H]1C ZINC000542701427 1120122150 /nfs/dbraw/zinc/12/21/50/1120122150.db2.gz FDIKXQCYPQTBHL-YPMHNXCESA-N 1 0 262.353 3.524 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3c2cccc3F)cc1 ZINC000111158742 1120138359 /nfs/dbraw/zinc/13/83/59/1120138359.db2.gz WEAWQAVFKLBCHJ-INIZCTEOSA-N 1 0 286.306 3.511 20 5 CHBDRO CC[C@@H]1CC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000554371343 1120160445 /nfs/dbraw/zinc/16/04/45/1120160445.db2.gz LIRAZYPRRAJALQ-RNCFNFMXSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCc2ccsc2C1 ZINC000341041344 1120191868 /nfs/dbraw/zinc/19/18/68/1120191868.db2.gz GIHMPYPLTLLWPY-NSHDSACASA-N 1 0 288.372 3.776 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000062726522 1120205444 /nfs/dbraw/zinc/20/54/44/1120205444.db2.gz FFKOLDVWOMZVET-LBPRGKRZSA-N 1 0 288.347 3.698 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccco1)CCCC2 ZINC000417299628 1120423509 /nfs/dbraw/zinc/42/35/09/1120423509.db2.gz NHMUYSVBVZXCLM-MRXNPFEDSA-N 1 0 286.331 3.745 20 5 CHBDRO CSCCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417313320 1120425912 /nfs/dbraw/zinc/42/59/12/1120425912.db2.gz PBQJTPUBAFMUKB-OAHLLOKOSA-N 1 0 294.420 3.705 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+][C@H]1CCOC1 ZINC000181992492 1128917327 /nfs/dbraw/zinc/91/73/27/1128917327.db2.gz LGTOSWNJEIGWRO-INIZCTEOSA-N 1 0 277.367 3.872 20 5 CHBDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000068592621 1120478929 /nfs/dbraw/zinc/47/89/29/1120478929.db2.gz VUZCAKODVDYGFT-TZMCWYRMSA-N 1 0 292.379 3.662 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000020091229 1120481683 /nfs/dbraw/zinc/48/16/83/1120481683.db2.gz WKZCMPGETCZZPU-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO CC(C)c1ccc(C[N@H+](C)C2CCC2)cc1[N+](=O)[O-] ZINC000093475823 1120560667 /nfs/dbraw/zinc/56/06/67/1120560667.db2.gz MKAALIIBKYXBAA-UHFFFAOYSA-N 1 0 262.353 3.703 20 5 CHBDRO C[C@@H]([NH2+]CC1(C2CC2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000155035912 1120567596 /nfs/dbraw/zinc/56/75/96/1120567596.db2.gz XUCKIQCYZSOPKA-GFCCVEGCSA-N 1 0 274.364 3.826 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000020095901 1120583149 /nfs/dbraw/zinc/58/31/49/1120583149.db2.gz SAGNBNKOXNNANW-NSHDSACASA-N 1 0 274.295 3.585 20 5 CHBDRO CC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C1CCC1 ZINC000470174892 1120605619 /nfs/dbraw/zinc/60/56/19/1120605619.db2.gz NPNJJMILDPMEMX-JLHYYAGUSA-N 1 0 274.364 3.873 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCS[C@H](C)C1 ZINC000922833409 1120606639 /nfs/dbraw/zinc/60/66/39/1120606639.db2.gz GQVMSCHVBLXWCB-DGCLKSJQSA-N 1 0 294.420 3.585 20 5 CHBDRO Cc1cc(N2C[C@H](C)[C@@H](C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302158000 1120649355 /nfs/dbraw/zinc/64/93/55/1120649355.db2.gz JCOPGDRXBRTRLN-QWRGUYRKSA-N 1 0 285.347 3.544 20 5 CHBDRO CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000509155322 1120679055 /nfs/dbraw/zinc/67/90/55/1120679055.db2.gz RYWJLQUAEWSSHM-LLVKDONJSA-N 1 0 268.332 3.600 20 5 CHBDRO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1(C)CCCC1 ZINC000618779819 1128938116 /nfs/dbraw/zinc/93/81/16/1128938116.db2.gz DNMYJXNJTFAHEO-UHFFFAOYSA-N 1 0 289.335 3.501 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CC1CCCC1 ZINC000107701348 1120721700 /nfs/dbraw/zinc/72/17/00/1120721700.db2.gz MYJMRNDGOZBTHL-GFCCVEGCSA-N 1 0 262.353 3.778 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000112017767 1120812337 /nfs/dbraw/zinc/81/23/37/1120812337.db2.gz UFZJSFORYVHRIV-OAHLLOKOSA-N 1 0 286.306 3.511 20 5 CHBDRO C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000511970254 1120946293 /nfs/dbraw/zinc/94/62/93/1120946293.db2.gz BVRYCWBQXWWRIV-LBPRGKRZSA-N 1 0 286.331 3.697 20 5 CHBDRO CCSCC[C@H](C)[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000072901282 1120949835 /nfs/dbraw/zinc/94/98/35/1120949835.db2.gz UCPHQSSNNDTBRR-JTQLQIEISA-N 1 0 288.438 3.620 20 5 CHBDRO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000051634440 1120963345 /nfs/dbraw/zinc/96/33/45/1120963345.db2.gz DTYGGLZBWLAAHD-MRXNPFEDSA-N 1 0 288.322 3.975 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC000344004478 1121051224 /nfs/dbraw/zinc/05/12/24/1121051224.db2.gz ZRLUDOCQKCOMER-JTQLQIEISA-N 1 0 268.382 3.524 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)C[C@H]1CC1(C)C ZINC001174908300 1121087980 /nfs/dbraw/zinc/08/79/80/1121087980.db2.gz ZAACLRWAYGBKJU-QWHCGFSZSA-N 1 0 276.380 3.942 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C1CCC1 ZINC000618572285 1121192485 /nfs/dbraw/zinc/19/24/85/1121192485.db2.gz GZQVJVYMUQCZMJ-ZBEGNZNMSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@H]1CCCC[C@H]1CC[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000512226841 1121211695 /nfs/dbraw/zinc/21/16/95/1121211695.db2.gz PPUZFKZKKWAZLO-ZFWWWQNUSA-N 1 0 276.380 3.901 20 5 CHBDRO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CC3CCC2CC3)c(F)c1 ZINC000432997846 1121508507 /nfs/dbraw/zinc/50/85/07/1121508507.db2.gz YOIYNRFFCVYINP-HKJQSTPSSA-N 1 0 296.317 3.541 20 5 CHBDRO Cc1ccc(C[N@H+]2CCC[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000512653209 1121511182 /nfs/dbraw/zinc/51/11/82/1121511182.db2.gz VGMYTIWHJKWOGZ-YPMHNXCESA-N 1 0 262.353 3.524 20 5 CHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccnc1 ZINC000611191207 1121630955 /nfs/dbraw/zinc/63/09/55/1121630955.db2.gz KGQLVFTUCNHIBK-CQSZACIVSA-N 1 0 299.374 3.615 20 5 CHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC1CC1 ZINC000611336529 1121638119 /nfs/dbraw/zinc/63/81/19/1121638119.db2.gz WAJBCEDDQQTDMA-ZDUSSCGKSA-N 1 0 294.420 3.855 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1sccc1[N+](=O)[O-] ZINC000611411032 1121644987 /nfs/dbraw/zinc/64/49/87/1121644987.db2.gz MSCDOINTKKJWRX-LLVKDONJSA-N 1 0 285.413 3.579 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCCCO1 ZINC000611477474 1121651275 /nfs/dbraw/zinc/65/12/75/1121651275.db2.gz QGUYONXMLLYDIE-ZENOOKHLSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H]1CCCCS1 ZINC001178290319 1121778450 /nfs/dbraw/zinc/77/84/50/1121778450.db2.gz BHSCDUCEIGFIAV-ZDUSSCGKSA-N 1 0 294.420 3.587 20 5 CHBDRO CC[C@H]([NH2+]CC1CC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000293664849 1121823933 /nfs/dbraw/zinc/82/39/33/1121823933.db2.gz MCZYGKOVNOKNML-ZDUSSCGKSA-N 1 0 284.306 3.681 20 5 CHBDRO CC[C@@H](C)C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000421387304 1122109489 /nfs/dbraw/zinc/10/94/89/1122109489.db2.gz SJMNZBSDYBHHJV-YFBAIUBQSA-N 1 0 262.353 3.634 20 5 CHBDRO CSCC[C@@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774198455 1122138908 /nfs/dbraw/zinc/13/89/08/1122138908.db2.gz BDMRZZUVNDABCK-IAQYHMDHSA-N 1 0 294.420 3.703 20 5 CHBDRO C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000035010019 1122147999 /nfs/dbraw/zinc/14/79/99/1122147999.db2.gz JUZRDWZZKOTBOU-JTQLQIEISA-N 1 0 292.285 3.724 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCC23CC3)cc1Cl ZINC001183239649 1122214201 /nfs/dbraw/zinc/21/42/01/1122214201.db2.gz YNUYJXIBNXGJET-ZDUSSCGKSA-N 1 0 280.755 3.671 20 5 CHBDRO C[C@H]([NH2+][C@@H]1C[C@@H]2CC[C@@H](C2)C1)c1ccc([N+](=O)[O-])cc1 ZINC001183788258 1122239139 /nfs/dbraw/zinc/23/91/39/1122239139.db2.gz KLEFASVWVBTMHQ-XPCVCDNBSA-N 1 0 274.364 3.824 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC001184044779 1122252847 /nfs/dbraw/zinc/25/28/47/1122252847.db2.gz DJXWQOXYOQKOPP-OLZOCXBDSA-N 1 0 276.380 3.867 20 5 CHBDRO CCC[NH+](C/C=C\c1ccccc1[N+](=O)[O-])CCC ZINC000505352938 1122361102 /nfs/dbraw/zinc/36/11/02/1122361102.db2.gz ZTVXTIQPAGCKGF-CLFYSBASSA-N 1 0 262.353 3.730 20 5 CHBDRO CCC[NH+](C/C=C/c1ccccc1[N+](=O)[O-])CCC ZINC000505352939 1122361139 /nfs/dbraw/zinc/36/11/39/1122361139.db2.gz ZTVXTIQPAGCKGF-VQHVLOKHSA-N 1 0 262.353 3.730 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)c1 ZINC000435788427 1122488219 /nfs/dbraw/zinc/48/82/19/1122488219.db2.gz SWLBLNYZLRRNGG-WKILWMFISA-N 1 0 282.343 3.631 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000435780720 1122489050 /nfs/dbraw/zinc/48/90/50/1122489050.db2.gz XFKFXMZEXSAOSJ-QAQDUYKDSA-N 1 0 296.370 3.939 20 5 CHBDRO CCC(CC)[C@@H](CNc1ccc([N+](=O)[O-])c(C)c1)[NH+](C)C ZINC000515541297 1122510125 /nfs/dbraw/zinc/51/01/25/1122510125.db2.gz SVIVULDISIKFMS-MRXNPFEDSA-N 1 0 293.411 3.682 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000437041323 1122606331 /nfs/dbraw/zinc/60/63/31/1122606331.db2.gz AGONLUBLMUHACH-WQVCFCJDSA-N 1 0 288.391 3.694 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1C[C@H]1C(F)(F)F ZINC000601306350 1122631581 /nfs/dbraw/zinc/63/15/81/1122631581.db2.gz HAAOFLLARQOMNE-GGZOMVNGSA-N 1 0 288.269 3.505 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001192481312 1122649993 /nfs/dbraw/zinc/64/99/93/1122649993.db2.gz LKLWKALARQQGME-AWEZNQCLSA-N 1 0 276.380 3.771 20 5 CHBDRO CC1(C)CN(Cc2csc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC001193095204 1122678754 /nfs/dbraw/zinc/67/87/54/1122678754.db2.gz WMEWEWUFFIDJIE-UHFFFAOYSA-N 1 0 282.409 3.914 20 5 CHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000438262863 1122689064 /nfs/dbraw/zinc/68/90/64/1122689064.db2.gz UFROPBUVIAOPQJ-UHFFFAOYSA-N 1 0 296.370 3.758 20 5 CHBDRO CC[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000506356825 1122724122 /nfs/dbraw/zinc/72/41/22/1122724122.db2.gz QCAPAZZDCCJROW-UHFFFAOYSA-N 1 0 276.361 3.775 20 5 CHBDRO CC[C@@H]1CC[C@H](C)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001194323332 1122765383 /nfs/dbraw/zinc/76/53/83/1122765383.db2.gz HTAWGZYVHPWIGR-NWDGAFQWSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000518562273 1122768280 /nfs/dbraw/zinc/76/82/80/1122768280.db2.gz DLUZQHFVDYDIOT-INIZCTEOSA-N 1 0 282.343 3.680 20 5 CHBDRO CSCCC[N@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000439472201 1122781914 /nfs/dbraw/zinc/78/19/14/1122781914.db2.gz RMZCURCGQVIUHM-LBPRGKRZSA-N 1 0 282.409 3.649 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@H+](CCc2ccccc2)C2CC2)c1 ZINC000506613556 1122791132 /nfs/dbraw/zinc/79/11/32/1122791132.db2.gz RNFIKPFELYDXKL-UHFFFAOYSA-N 1 0 296.370 3.802 20 5 CHBDRO Cc1ccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1C ZINC000507163533 1122794893 /nfs/dbraw/zinc/79/48/93/1122794893.db2.gz YNHSRPKZBNYEAF-UHFFFAOYSA-N 1 0 284.359 3.844 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc2ccccc2[nH]1 ZINC000775626732 1122830780 /nfs/dbraw/zinc/83/07/80/1122830780.db2.gz KJTMZFJCLJZVHO-GFCCVEGCSA-N 1 0 295.342 3.927 20 5 CHBDRO COCC(C)(C)CCC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000286936301 1122849785 /nfs/dbraw/zinc/84/97/85/1122849785.db2.gz GPYBCQOBURGXDQ-CYBMUJFWSA-N 1 0 294.395 3.698 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC001195509435 1122871382 /nfs/dbraw/zinc/87/13/82/1122871382.db2.gz WGTHFTYHBOYFIM-GJZGRUSLSA-N 1 0 274.364 3.668 20 5 CHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000507170378 1122935075 /nfs/dbraw/zinc/93/50/75/1122935075.db2.gz MXJUQFFOCSILQO-CQSZACIVSA-N 1 0 262.353 3.605 20 5 CHBDRO CC(C)c1ccc(C[N@H+](C)[C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000507439650 1122954922 /nfs/dbraw/zinc/95/49/22/1122954922.db2.gz DXAJTHWYSFHUOQ-GFCCVEGCSA-N 1 0 276.380 3.949 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C1(C)CC1 ZINC000776883488 1123557232 /nfs/dbraw/zinc/55/72/32/1123557232.db2.gz YWWRBXZRHGQUOT-STQMWFEESA-N 1 0 276.380 3.694 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)c2ccns2)cccc1[N+](=O)[O-] ZINC000858577109 1123664855 /nfs/dbraw/zinc/66/48/55/1123664855.db2.gz PCNFXMZOTXPZFV-GHMZBOCLSA-N 1 0 291.376 3.772 20 5 CHBDRO Cc1c(C[N@@H+](Cc2ccco2)C(C)C)cccc1[N+](=O)[O-] ZINC000346321950 1123678489 /nfs/dbraw/zinc/67/84/89/1123678489.db2.gz UGSUTLTTYYOYAR-UHFFFAOYSA-N 1 0 288.347 3.907 20 5 CHBDRO CC(C)(O)C=CNc1ccc2cc3ccc(N)cc3[nH+]c2c1 ZINC001203221144 1123851616 /nfs/dbraw/zinc/85/16/16/1123851616.db2.gz UTMVRAFSODFDLS-BQYQJAHWSA-N 1 0 293.370 3.667 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000323752605 1123947800 /nfs/dbraw/zinc/94/78/00/1123947800.db2.gz SIIWLUWUFXJRCY-ZDUSSCGKSA-N 1 0 268.744 3.526 20 5 CHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1cccs1 ZINC000866216858 1124038596 /nfs/dbraw/zinc/03/85/96/1124038596.db2.gz VVGXPMKGMDSISF-JTQLQIEISA-N 1 0 294.351 3.516 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCc1cccnc1)c1ccccc1[N+](=O)[O-] ZINC000866316121 1124051661 /nfs/dbraw/zinc/05/16/61/1124051661.db2.gz WTXWCATTYGVNIF-UONOGXRCSA-N 1 0 299.374 3.662 20 5 CHBDRO Cc1c([C@H](C)[NH2+]CC[C@H]2CCSC2)cccc1[N+](=O)[O-] ZINC000866402525 1124063075 /nfs/dbraw/zinc/06/30/75/1124063075.db2.gz MHMGLEUEUMGZGO-STQMWFEESA-N 1 0 294.420 3.697 20 5 CHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCCC12CC2 ZINC000866411404 1124064759 /nfs/dbraw/zinc/06/47/59/1124064759.db2.gz LCTPGOSJNGGUJH-NHYWBVRUSA-N 1 0 292.354 3.587 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000037668269 1129164362 /nfs/dbraw/zinc/16/43/62/1129164362.db2.gz GKPHNGYVRROJRL-VXGBXAGGSA-N 1 0 262.353 3.509 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)C2CCSCC2)cc1[N+](=O)[O-] ZINC000866541134 1124080002 /nfs/dbraw/zinc/08/00/02/1124080002.db2.gz WVMJBLVPSNLCOL-LBPRGKRZSA-N 1 0 294.420 3.525 20 5 CHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000525273839 1124119806 /nfs/dbraw/zinc/11/98/06/1124119806.db2.gz ZKALKBJZKFXEEQ-INWMFGNUSA-N 1 0 274.364 3.748 20 5 CHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000525989572 1124492457 /nfs/dbraw/zinc/49/24/57/1124492457.db2.gz MNNKODDOIWKBMI-ZDUSSCGKSA-N 1 0 276.380 3.696 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2ccccc21 ZINC000449068093 1124644655 /nfs/dbraw/zinc/64/46/55/1124644655.db2.gz QUWNURGXCCISER-DYVFJYSZSA-N 1 0 296.370 3.803 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCO[C@H](CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000449177119 1124661860 /nfs/dbraw/zinc/66/18/60/1124661860.db2.gz UUVNEPUDMXHTOA-FVQBIDKESA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1c(F)cccc1[N+](=O)[O-] ZINC000872042906 1124664378 /nfs/dbraw/zinc/66/43/78/1124664378.db2.gz FHJCUDDFQKDAES-QMTHXVAHSA-N 1 0 298.383 3.670 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCC1=CCCC1 ZINC000449207417 1124669721 /nfs/dbraw/zinc/66/97/21/1124669721.db2.gz BZGPUTHBBDYSED-CYBMUJFWSA-N 1 0 274.364 3.616 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCCCS1)c1c(F)cccc1[N+](=O)[O-] ZINC000872060264 1124669944 /nfs/dbraw/zinc/66/99/44/1124669944.db2.gz OLJZAYBIJBKOHI-GHMZBOCLSA-N 1 0 298.383 3.670 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872081049 1124677034 /nfs/dbraw/zinc/67/70/34/1124677034.db2.gz DYSSNXWZKRDYSZ-IRCOFANPSA-N 1 0 278.327 3.573 20 5 CHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CC12CC2 ZINC000872081703 1124677674 /nfs/dbraw/zinc/67/76/74/1124677674.db2.gz JIYDBNHYMWJAKW-RNCFNFMXSA-N 1 0 278.377 3.520 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC[C@]1(C)CC1(F)F ZINC000873138650 1124741020 /nfs/dbraw/zinc/74/10/20/1124741020.db2.gz UZUJKEPTFQURPK-CQSZACIVSA-N 1 0 298.333 3.737 20 5 CHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCC1(F)F ZINC000449491020 1124761790 /nfs/dbraw/zinc/76/17/90/1124761790.db2.gz DUSMHBOVERGBCZ-WCQYABFASA-N 1 0 298.333 3.551 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)C[C@H]1CCCO1 ZINC000532220157 1125241292 /nfs/dbraw/zinc/24/12/92/1125241292.db2.gz JVUCJRMLDHBAOE-KCQAQPDRSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000129899098 1125353374 /nfs/dbraw/zinc/35/33/74/1125353374.db2.gz XYTQUJPSKNBSPV-VXGBXAGGSA-N 1 0 262.353 3.600 20 5 CHBDRO C=C/C=C/CC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000883269150 1125389091 /nfs/dbraw/zinc/38/90/91/1125389091.db2.gz AFHQUVNLDVVSDX-ZWNMCFTASA-N 1 0 264.300 3.517 20 5 CHBDRO C[C@H]1CC[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000132295088 1125416583 /nfs/dbraw/zinc/41/65/83/1125416583.db2.gz PHDIHARCTRFUBU-CABZTGNLSA-N 1 0 268.744 3.526 20 5 CHBDRO CC[C@@H]([NH2+]CC(C)(C)SC)c1cccc([N+](=O)[O-])c1 ZINC000132414644 1125417498 /nfs/dbraw/zinc/41/74/98/1125417498.db2.gz MLBZARSCOGVONL-CYBMUJFWSA-N 1 0 282.409 3.777 20 5 CHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-])C1CC(F)(F)C1 ZINC000897461883 1125423677 /nfs/dbraw/zinc/42/36/77/1125423677.db2.gz ZUEFBJPMXFFOQN-GHMZBOCLSA-N 1 0 298.333 3.722 20 5 CHBDRO C[C@@H](C[NH2+][C@H]1CCCSCC1)c1ccccc1[N+](=O)[O-] ZINC000897461447 1125424102 /nfs/dbraw/zinc/42/41/02/1125424102.db2.gz PCIKGUMDMGEHAE-STQMWFEESA-N 1 0 294.420 3.574 20 5 CHBDRO C[C@H](C[NH2+][C@H]1CCC12CCC2)c1ccccc1[N+](=O)[O-] ZINC000897465031 1125424758 /nfs/dbraw/zinc/42/47/58/1125424758.db2.gz QZOMXYSXDSUYFJ-DOMZBBRYSA-N 1 0 274.364 3.621 20 5 CHBDRO Cc1ccc(O[C@@H](C)C[N+](C)(C)C)c(C(C)C)c1 ZINC001229126602 1125430488 /nfs/dbraw/zinc/43/04/88/1125430488.db2.gz WELXPCPVLVQXJO-AWEZNQCLSA-N 1 0 250.406 3.592 20 5 CHBDRO C[C@@H](CSC(C)(C)C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000089511901 1129238488 /nfs/dbraw/zinc/23/84/88/1129238488.db2.gz CMBIXBWWMZXMIA-NSHDSACASA-N 1 0 282.409 3.605 20 5 CHBDRO C[C@H](C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000734509743 1129310450 /nfs/dbraw/zinc/31/04/50/1129310450.db2.gz LIPFUWKJNFZEDG-BUUCAEBMSA-N 1 0 276.380 3.880 20 5 CHBDRO CCC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccn1 ZINC000090909923 1129336265 /nfs/dbraw/zinc/33/62/65/1129336265.db2.gz XJJLVGJWTNSAST-INIZCTEOSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094774539 1129451985 /nfs/dbraw/zinc/45/19/85/1129451985.db2.gz JTDHEEBWYRQVLH-WCQYABFASA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1cc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC000742373796 1129475584 /nfs/dbraw/zinc/47/55/84/1129475584.db2.gz FRZWFSQCXYCVME-UHFFFAOYSA-N 1 0 290.388 3.871 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCNc2ccccc2)cccc1[N+](=O)[O-] ZINC000766514950 1129678075 /nfs/dbraw/zinc/67/80/75/1129678075.db2.gz JQDBBZCRIZDJIC-CQSZACIVSA-N 1 0 299.374 3.666 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1F ZINC001168981833 1129687093 /nfs/dbraw/zinc/68/70/93/1129687093.db2.gz HPJFWGDRYHXHSB-WWGRRREGSA-N 1 0 294.370 3.702 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc2ccccc2c1 ZINC001168967495 1129687895 /nfs/dbraw/zinc/68/78/95/1129687895.db2.gz QENDDRUNGZJTCV-PMUMKWKESA-N 1 0 298.386 3.936 20 5 CHBDRO Cc1cccc([C@H]([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)C(C)C)c1 ZINC001169004123 1129689078 /nfs/dbraw/zinc/68/90/78/1129689078.db2.gz PZHXUIMFJWEOSV-USXIJHARSA-N 1 0 290.407 3.727 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)c(C)c1 ZINC001169003601 1129689199 /nfs/dbraw/zinc/68/91/99/1129689199.db2.gz ONQXRXUADVYYGG-INWMFGNUSA-N 1 0 294.370 3.620 20 5 CHBDRO CC1(C)C[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC(C)(C)C1 ZINC001169004215 1129689226 /nfs/dbraw/zinc/68/92/26/1129689226.db2.gz LDEJVTMJPSRPMU-UHFFFAOYSA-N 1 0 294.370 3.992 20 5 CHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]CCCCC2CCCCC2)C1 ZINC001169004574 1129689343 /nfs/dbraw/zinc/68/93/43/1129689343.db2.gz RFPKPABPXIAIFQ-CVEARBPZSA-N 1 0 282.428 3.772 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cc(C)cc(C)c1 ZINC001169001880 1129689422 /nfs/dbraw/zinc/68/94/22/1129689422.db2.gz IHXIAIMNCGBEDG-OIISXLGYSA-N 1 0 290.407 3.790 20 5 CHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001169006252 1129689425 /nfs/dbraw/zinc/68/94/25/1129689425.db2.gz GJVDZTSIKNPVIS-XIRDDKMYSA-N 1 0 288.391 3.577 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1Cl ZINC001168988649 1129690148 /nfs/dbraw/zinc/69/01/48/1129690148.db2.gz UADYFJYDKQNEFQ-ZOWXZIJZSA-N 1 0 296.798 3.826 20 5 CHBDRO CCCC[N@H+](Cc1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169030254 1129690729 /nfs/dbraw/zinc/69/07/29/1129690729.db2.gz XJUBTDQGFYXXBO-SJORKVTESA-N 1 0 290.407 3.734 20 5 CHBDRO C[C@H](c1ccc(Cl)cc1)[N@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035132 1129690742 /nfs/dbraw/zinc/69/07/42/1129690742.db2.gz AJWRXJWHXMXWQL-XUJVJEKNSA-N 1 0 296.798 3.778 20 5 CHBDRO CC[N@H+](Cc1ccc(C)c(C)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169050093 1129691953 /nfs/dbraw/zinc/69/19/53/1129691953.db2.gz YLRCWSAUWKJNFP-SJORKVTESA-N 1 0 290.407 3.571 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCc1ccc(-c2ccccc2)cc1 ZINC001206001204 1129700533 /nfs/dbraw/zinc/70/05/33/1129700533.db2.gz WUXBTSVFKBJZDN-INIZCTEOSA-N 1 0 284.423 3.965 20 5 CHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001169382689 1129721395 /nfs/dbraw/zinc/72/13/95/1129721395.db2.gz LOTFKTWENDPUSA-GFCCVEGCSA-N 1 0 280.343 3.602 20 5 CHBDRO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC2(CCC2)CC1 ZINC000796514968 1129767610 /nfs/dbraw/zinc/76/76/10/1129767610.db2.gz VNHLXVOKWVYDIB-UHFFFAOYSA-N 1 0 278.327 3.500 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2CC(C(F)F)C2)cc1[N+](=O)[O-] ZINC000768697889 1129869339 /nfs/dbraw/zinc/86/93/39/1129869339.db2.gz QCLLZMNPNGNBSQ-GCVQQVDUSA-N 1 0 284.306 3.598 20 5 CHBDRO CSC(C)(C)C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000786814533 1130119226 /nfs/dbraw/zinc/11/92/26/1130119226.db2.gz ILVIAWRSRXRKOE-WQLSENKSSA-N 1 0 294.420 3.729 20 5 CHBDRO Cc1cncc([C@H](C)[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000903245179 1130136041 /nfs/dbraw/zinc/13/60/41/1130136041.db2.gz JRZRMCTWXKQFIV-KGLIPLIRSA-N 1 0 299.374 3.753 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1ccoc1)c1ccccc1[N+](=O)[O-] ZINC000903247096 1130136435 /nfs/dbraw/zinc/13/64/35/1130136435.db2.gz YPGMXIPHHMYRSM-NWDGAFQWSA-N 1 0 274.320 3.642 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)C1CCSCC1)c1ccc([N+](=O)[O-])cc1 ZINC000903288589 1130146868 /nfs/dbraw/zinc/14/68/68/1130146868.db2.gz ZUQHGYDNIZEHIX-NEPJUHHUSA-N 1 0 294.420 3.777 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccc([N+](=O)[O-])cc1 ZINC000903286837 1130146918 /nfs/dbraw/zinc/14/69/18/1130146918.db2.gz HYGWSOSUOXUPCS-MLGOLLRUSA-N 1 0 297.358 3.718 20 5 CHBDRO CCO[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000903286581 1130147001 /nfs/dbraw/zinc/14/70/01/1130147001.db2.gz BLSLTKNGWPRANH-IVMMDQJWSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)c2cncs2)cccc1[N+](=O)[O-] ZINC000903309376 1130150951 /nfs/dbraw/zinc/15/09/51/1130150951.db2.gz FAAZOQYIKWQUNA-QWRGUYRKSA-N 1 0 291.376 3.772 20 5 CHBDRO CC[C@@H]1CC[N@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)[C@@H]1C ZINC001462127899 1130202380 /nfs/dbraw/zinc/20/23/80/1130202380.db2.gz SYWQBVABMFILMF-ZIAGYGMSSA-N 1 0 276.380 3.832 20 5 CHBDRO CC(C)C(C)(C)C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788758910 1130206064 /nfs/dbraw/zinc/20/60/64/1130206064.db2.gz SAVJGAQXMFGGKU-NSHDSACASA-N 1 0 279.384 3.510 20 5 CHBDRO CC[C@@H](C)C[N@H+](CC)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748829457 1130249811 /nfs/dbraw/zinc/24/98/11/1130249811.db2.gz ZNJQKUONKMUAJH-LLVKDONJSA-N 1 0 268.332 3.602 20 5 CHBDRO CCC[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC001170365160 1130485766 /nfs/dbraw/zinc/48/57/66/1130485766.db2.gz LRRGQLPSKIOWHZ-HNNXBMFYSA-N 1 0 294.395 3.778 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000811472650 1130614057 /nfs/dbraw/zinc/61/40/57/1130614057.db2.gz LJHJEGNWTGEEKE-SSDOTTSWSA-N 1 0 289.162 3.790 20 5 CHBDRO C[C@H]1CC[C@@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811505766 1130617894 /nfs/dbraw/zinc/61/78/94/1130617894.db2.gz HSWYTNOMLNOHPP-CPCISQLKSA-N 1 0 289.162 3.790 20 5 CHBDRO Cc1ccc(O[C@H](C)C[N+](C)(C)C)c(Cl)c1Cl ZINC001234928806 1130692932 /nfs/dbraw/zinc/69/29/32/1130692932.db2.gz AMWRHRURWWTQJB-SNVBAGLBSA-N 1 0 277.215 3.775 20 5 CHBDRO NC[C@@H]1CCC[N@@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001235726346 1130772671 /nfs/dbraw/zinc/77/26/71/1130772671.db2.gz XEVRJOUZPPGXAT-KRWDZBQOSA-N 1 0 290.410 3.916 20 5 CHBDRO CN(Cc1cc2ccccc2[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001116235003 1131135005 /nfs/dbraw/zinc/13/50/05/1131135005.db2.gz MONMSTJAYFERDD-UHFFFAOYSA-N 1 0 295.342 3.708 20 5 CHBDRO C[C@H](C[N@@H+]1Cc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC001116823612 1131165214 /nfs/dbraw/zinc/16/52/14/1131165214.db2.gz GPSNCCRYIPTFRZ-CYBMUJFWSA-N 1 0 282.343 3.714 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C/C=C\C1CC1)CCC2 ZINC001117713142 1131194156 /nfs/dbraw/zinc/19/41/56/1131194156.db2.gz NBRPOFKWFUOUIY-RXYHWBRQSA-N 1 0 272.348 3.528 20 5 CHBDRO CC[C@@H](C)c1ccccc1O[C@@H](C)C[N+](C)(C)C ZINC001227760420 1131738774 /nfs/dbraw/zinc/73/87/74/1131738774.db2.gz RHXBZBQIHDYSMI-KGLIPLIRSA-N 1 0 250.406 3.674 20 5 CHBDRO CC(C)[NH+](CCCNc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000348174253 1131898444 /nfs/dbraw/zinc/89/84/44/1131898444.db2.gz BMNHTEBYANFRHS-UHFFFAOYSA-N 1 0 279.384 3.516 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)c2ccc[nH]2)cccc1[N+](=O)[O-] ZINC000773116277 1131949250 /nfs/dbraw/zinc/94/92/50/1131949250.db2.gz INTDZUGNLWWYEW-NEPJUHHUSA-N 1 0 273.336 3.643 20 5 CHBDRO CCC[C@@H](C)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000036790522 1131975461 /nfs/dbraw/zinc/97/54/61/1131975461.db2.gz TUFXSBLEKDLRFJ-SNVBAGLBSA-N 1 0 270.760 3.869 20 5 CHBDRO CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)C ZINC000037111563 1131996999 /nfs/dbraw/zinc/99/69/99/1131996999.db2.gz OKBYUVKUSIPEBT-UHFFFAOYSA-N 1 0 270.760 3.726 20 5 CHBDRO C[C@@H](C[NH+](C)C)Oc1nccc2c3ccccc3ccc21 ZINC001230202766 1132160114 /nfs/dbraw/zinc/16/01/14/1132160114.db2.gz CNDCIJHHYWTTHQ-ZDUSSCGKSA-N 1 0 280.371 3.717 20 5 CHBDRO CN(C)CC[N@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC001141722531 1132239978 /nfs/dbraw/zinc/23/99/78/1132239978.db2.gz BSUAMVFJPRADLM-UHFFFAOYSA-N 1 0 292.426 3.986 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH+]1CC2(CCO2)C1 ZINC001141728118 1132241924 /nfs/dbraw/zinc/24/19/24/1132241924.db2.gz MLERJBXOJAHLCU-UHFFFAOYSA-N 1 0 289.378 3.968 20 5 CHBDRO c1ccc2c(c1)cc1ccccc1c2C[N@@H+]1C[C@@H]2C[C@H]1CO2 ZINC001141727691 1132242785 /nfs/dbraw/zinc/24/27/85/1132242785.db2.gz CILWMIVBFGEDIE-IRXDYDNUSA-N 1 0 289.378 3.966 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900809 1132348476 /nfs/dbraw/zinc/34/84/76/1132348476.db2.gz FXJYSRUOBZFIJH-XJKSGUPXSA-N 1 0 290.407 3.866 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C1CCC1 ZINC001172906320 1132348712 /nfs/dbraw/zinc/34/87/12/1132348712.db2.gz NYURLPIYELSJKI-WBMJQRKESA-N 1 0 288.391 3.620 20 5 CHBDRO CC1CC([N@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172908782 1132350371 /nfs/dbraw/zinc/35/03/71/1132350371.db2.gz OEISUUWBPLMLAG-VXKCQOAXSA-N 1 0 288.391 3.573 20 5 CHBDRO C[C@@H]1CCC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909243 1132372623 /nfs/dbraw/zinc/37/26/23/1132372623.db2.gz RJXKRMMNARCDSE-CJNGLKHVSA-N 1 0 288.391 3.574 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCC1(C)C ZINC001173217755 1132411447 /nfs/dbraw/zinc/41/14/47/1132411447.db2.gz FQWMREAUXIWYOR-IUODEOHRSA-N 1 0 276.380 3.694 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)C1CCCCC1 ZINC001173220414 1132411643 /nfs/dbraw/zinc/41/16/43/1132411643.db2.gz AAFBSUBGLDGPHU-ZDUSSCGKSA-N 1 0 276.380 3.790 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC2(CCCC2)C1 ZINC001173228140 1132412619 /nfs/dbraw/zinc/41/26/19/1132412619.db2.gz UAZDLLNUAVXQSM-AWEZNQCLSA-N 1 0 288.391 3.792 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001173231819 1132414148 /nfs/dbraw/zinc/41/41/48/1132414148.db2.gz NKEMCYFJAOZGFC-MJBXVCDLSA-N 1 0 276.380 3.504 20 5 CHBDRO Cc1cccc(C)c1C[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173236233 1132416268 /nfs/dbraw/zinc/41/62/68/1132416268.db2.gz ZAGBQEFNTJUUGB-HNNXBMFYSA-N 1 0 298.386 3.932 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)s1 ZINC001173211575 1132416624 /nfs/dbraw/zinc/41/66/24/1132416624.db2.gz SWWVOEICUBQNQU-NSHDSACASA-N 1 0 290.388 3.686 20 5 CHBDRO Cc1ccccc1CC[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173210759 1132416707 /nfs/dbraw/zinc/41/67/07/1132416707.db2.gz MWOFOBMXTJBLCP-HNNXBMFYSA-N 1 0 298.386 3.667 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC001173212644 1132416732 /nfs/dbraw/zinc/41/67/32/1132416732.db2.gz CARQBPPNMDYLCO-HNNXBMFYSA-N 1 0 298.386 3.932 20 5 CHBDRO c1cnc2c(c1)ccc1ccc(C[N@@H+]3CCCC34CC4)nc12 ZINC001232219958 1132438371 /nfs/dbraw/zinc/43/83/71/1132438371.db2.gz YTWMHMCYQCFOIN-UHFFFAOYSA-N 1 0 289.382 3.911 20 5 CHBDRO CCC[N@H+](C)Cc1ccc2ccc3cccnc3c2n1 ZINC001232219006 1132439199 /nfs/dbraw/zinc/43/91/99/1132439199.db2.gz KPNDNPLYZBESCB-UHFFFAOYSA-N 1 0 265.360 3.625 20 5 CHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)CC(F)F ZINC000843418713 1132530392 /nfs/dbraw/zinc/53/03/92/1132530392.db2.gz JHXDCYAWEPRUPE-QMMMGPOBSA-N 1 0 292.713 3.629 20 5 CHBDRO Cc1n[nH]cc1Nc1ccc2cc3ccc(N)cc3[nH+]c2c1 ZINC001174476848 1132880587 /nfs/dbraw/zinc/88/05/87/1132880587.db2.gz RPUAFDVKLWVUAD-UHFFFAOYSA-N 1 0 289.342 3.745 20 5 CHBDRO Cc1ccc(Nc2ccc([C@@H]3CC[NH2+]C3)cc2)c([N+](=O)[O-])c1 ZINC001159777909 1132909558 /nfs/dbraw/zinc/90/95/58/1132909558.db2.gz NXSBTFNJZZQKGK-CQSZACIVSA-N 1 0 297.358 3.724 20 5 CHBDRO CC1(C)CCC(C)(C)[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001174726872 1132966785 /nfs/dbraw/zinc/96/67/85/1132966785.db2.gz XFJNINUWZHFBRI-UHFFFAOYSA-N 1 0 276.380 3.995 20 5 CHBDRO C[NH+](C)CCCCNc1cc2ccccc2c([N+](=O)[O-])c1 ZINC001161736710 1133022452 /nfs/dbraw/zinc/02/24/52/1133022452.db2.gz RJNDNVIEIIPSKI-UHFFFAOYSA-N 1 0 287.363 3.502 20 5 CHBDRO CC(C)C[N@H+](C)CCCNc1ccc(Cl)cc1[N+](=O)[O-] ZINC001163657453 1133164523 /nfs/dbraw/zinc/16/45/23/1133164523.db2.gz ZVQRANUTBSQTGK-UHFFFAOYSA-N 1 0 299.802 3.638 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCSCC[C@H]1C ZINC001205405596 1133574342 /nfs/dbraw/zinc/57/43/42/1133574342.db2.gz KWMOUQYOJHPBIE-GFCCVEGCSA-N 1 0 294.420 3.539 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@H]2C(C)C)cccc1[N+](=O)[O-] ZINC001205403256 1133574467 /nfs/dbraw/zinc/57/44/67/1133574467.db2.gz WKCVLGMQFAELGS-LSDHHAIUSA-N 1 0 276.380 3.818 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)C[C@@H]1CC1(C)C ZINC001206808235 1133750765 /nfs/dbraw/zinc/75/07/65/1133750765.db2.gz DUQPBWXCOUXVBQ-ZDUSSCGKSA-N 1 0 276.380 3.690 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2C[C@H]2C2CCCC2)c(F)c1 ZINC001207837870 1133850394 /nfs/dbraw/zinc/85/03/94/1133850394.db2.gz USUGBZCDBMSGBT-ZFWWWQNUSA-N 1 0 292.354 3.650 20 5 CHBDRO C[NH+](C)Cc1ccccc1Nc1ccc(F)c([N+](=O)[O-])c1 ZINC001211192020 1134387339 /nfs/dbraw/zinc/38/73/39/1134387339.db2.gz ALTDYPFLWVTJMO-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1cc[nH+]c(N2CCCC2)c1 ZINC001211287938 1134403423 /nfs/dbraw/zinc/40/34/23/1134403423.db2.gz ZBMVMXRRYQRQLS-UHFFFAOYSA-N 1 0 298.346 3.642 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1c[nH+]c2cccc(C)n12 ZINC001211288135 1134403527 /nfs/dbraw/zinc/40/35/27/1134403527.db2.gz HDFZVTKFBQJTMD-UHFFFAOYSA-N 1 0 282.303 3.603 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1Nc1ccccc1C[NH+](C)C ZINC001211290723 1134404801 /nfs/dbraw/zinc/40/48/01/1134404801.db2.gz ZVXHLWJBKABUNN-UHFFFAOYSA-N 1 0 285.347 3.708 20 5 CHBDRO Cc1ccc(Nc2cc[nH+]c(N3CCCC3)c2)cc1[N+](=O)[O-] ZINC001213663447 1134475623 /nfs/dbraw/zinc/47/56/23/1134475623.db2.gz HEKHRRIZYCIWGI-UHFFFAOYSA-N 1 0 298.346 3.642 20 5 CHBDRO Cc1ccc(Nc2ccc(C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC001213666716 1134476156 /nfs/dbraw/zinc/47/61/56/1134476156.db2.gz BJPBIDZMQUZLMK-UHFFFAOYSA-N 1 0 285.347 3.708 20 5 CHBDRO Cc1cc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)sn1 ZINC000404411116 1134944804 /nfs/dbraw/zinc/94/48/04/1134944804.db2.gz XRMJWCRYDBUYRD-LLVKDONJSA-N 1 0 291.376 3.519 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@H]3CCCC[NH2+]C3)cc2c1 ZINC001217969749 1135033792 /nfs/dbraw/zinc/03/37/92/1135033792.db2.gz CCIVSMCKXDKJGH-INIZCTEOSA-N 1 0 292.382 3.909 20 5 CHBDRO c1cnc2c(c1)ccc1cccc(O[C@H]3CCC[NH2+]CC3)c12 ZINC001217995969 1135038547 /nfs/dbraw/zinc/03/85/47/1135038547.db2.gz SHLZSWIGXJDFFQ-INIZCTEOSA-N 1 0 292.382 3.909 20 5 CHBDRO c1ccc2c(c1)nc(O[C@H]1CCC[NH2+]CC1)c1ccccc21 ZINC001217995390 1135038907 /nfs/dbraw/zinc/03/89/07/1135038907.db2.gz ORDJISQPCGQQIY-AWEZNQCLSA-N 1 0 292.382 3.909 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@H]1CCC[NH2+]CC1 ZINC001217997374 1135040021 /nfs/dbraw/zinc/04/00/21/1135040021.db2.gz UVJJDNYYQVXWCR-HNNXBMFYSA-N 1 0 292.382 3.909 20 5 CHBDRO F[C@H]1C[NH2+]C[C@H]1Oc1c2ccccc2cc2ccccc21 ZINC001217999624 1135040282 /nfs/dbraw/zinc/04/02/82/1135040282.db2.gz GWNPUTOORCYSRA-DLBZAZTESA-N 1 0 281.330 3.682 20 5 CHBDRO c1ccc2nc3c(cccc3O[C@@H]3C[C@H]4C[C@@H]3C[NH2+]4)cc2c1 ZINC001218110848 1135060200 /nfs/dbraw/zinc/06/02/00/1135060200.db2.gz IQVVQDBVTQXELR-IIDMSEBBSA-N 1 0 290.366 3.517 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@H]1CCC[NH2+]C1 ZINC001218286031 1135079089 /nfs/dbraw/zinc/07/90/89/1135079089.db2.gz QYBWOMKAOJEXSQ-AWEZNQCLSA-N 1 0 278.355 3.519 20 5 CHBDRO c1ccc2cc3cc(O[C@@H]4C[C@H]5C[NH2+]C[C@H]54)ccc3cc2c1 ZINC001218332966 1135090175 /nfs/dbraw/zinc/09/01/75/1135090175.db2.gz XOMSHUJRTYKFQK-DFQSSKMNSA-N 1 0 289.378 3.980 20 5 CHBDRO c1ccc2cc3cc(O[C@@H]4C=CC[NH2+]C4)ccc3cc2c1 ZINC001218334585 1135090182 /nfs/dbraw/zinc/09/01/82/1135090182.db2.gz PBDJSJUORLNSGB-LJQANCHMSA-N 1 0 275.351 3.900 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1cccc([N+](=O)[O-])c1 ZINC000316885949 1135170444 /nfs/dbraw/zinc/17/04/44/1135170444.db2.gz VYNDSWCDHTZGTR-MLGOLLRUSA-N 1 0 297.358 3.718 20 5 CHBDRO CC(C)[N@@H+]1CCC[C@H](O[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC001223428015 1135344685 /nfs/dbraw/zinc/34/46/85/1135344685.db2.gz YSSXLPJBVAOMDR-BBRMVZONSA-N 1 0 292.379 3.545 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)O[C@@H](C)c1ccc(Cl)cc1 ZINC001223961553 1135402481 /nfs/dbraw/zinc/40/24/81/1135402481.db2.gz BIJJGBHZVAMMOA-RYUDHWBXSA-N 1 0 256.797 3.512 20 5 CHBDRO C[C@H](OCCC[N+](C)(C)C)c1cccc(Cl)c1 ZINC001224621724 1135462630 /nfs/dbraw/zinc/46/26/30/1135462630.db2.gz CKDZXVJDUZRDIV-LBPRGKRZSA-N 1 0 256.797 3.514 20 5 CHBDRO CCCCC1CCC(OCCC[N+](C)(C)C)CC1 ZINC001224624843 1135463247 /nfs/dbraw/zinc/46/32/47/1135463247.db2.gz ZVIIQACABVIARJ-UHFFFAOYSA-N 1 0 256.454 3.848 20 5 CHBDRO COc1ccc(CCCCCO[C@@H](C)C[N+](C)(C)C)cc1 ZINC001224976231 1135498222 /nfs/dbraw/zinc/49/82/22/1135498222.db2.gz VGLDEBJDZSLPDI-INIZCTEOSA-N 1 0 294.459 3.519 20 5 CHBDRO Cc1ccc(C(C)C)cc1O[C@@H](C)C[N+](C)(C)C ZINC001225224319 1135518899 /nfs/dbraw/zinc/51/88/99/1135518899.db2.gz CMSTWYSRUWBKQS-AWEZNQCLSA-N 1 0 250.406 3.592 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1OC1CC[NH+](C(C)(C)C)CC1 ZINC001226993834 1135773145 /nfs/dbraw/zinc/77/31/45/1135773145.db2.gz YZOYYQFRENQOHV-UHFFFAOYSA-N 1 0 292.379 3.545 20 5 CHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CCC(F)(F)CC1 ZINC000347578377 529995508 /nfs/dbraw/zinc/99/55/08/529995508.db2.gz JHGJVUFDIXPPJA-UHFFFAOYSA-N 1 0 284.306 3.605 20 5 CHBDRO COc1ccc(C[N@H+](C)[C@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000519968915 260035537 /nfs/dbraw/zinc/03/55/37/260035537.db2.gz VXLRSALXGJSINS-JSGCOSHPSA-N 1 0 292.379 3.614 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCC1CC1)CCC2 ZINC000575082266 335063210 /nfs/dbraw/zinc/06/32/10/335063210.db2.gz AOYASKSMHXYGSY-INIZCTEOSA-N 1 0 274.364 3.752 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000020123925 171005512 /nfs/dbraw/zinc/00/55/12/171005512.db2.gz YBTGRIZLUOSPLI-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000020128018 171014842 /nfs/dbraw/zinc/01/48/42/171014842.db2.gz WSWYVZMKQGLVSP-OLZOCXBDSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)c2cccs2)cccc1[N+](=O)[O-] ZINC000035737038 172390652 /nfs/dbraw/zinc/39/06/52/172390652.db2.gz SKYGEMOYDDDGJF-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449183023 260283853 /nfs/dbraw/zinc/28/38/53/260283853.db2.gz CLFOXTYEZADGTC-STQMWFEESA-N 1 0 264.369 3.550 20 5 CHBDRO CC(C)(C)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000313532664 260300984 /nfs/dbraw/zinc/30/09/84/260300984.db2.gz PUEJBUXCJHGCJS-GFCCVEGCSA-N 1 0 280.343 3.602 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1CCCC(F)(F)C1 ZINC000517962637 260327451 /nfs/dbraw/zinc/32/74/51/260327451.db2.gz YZWCAZCPVXXMKS-GXFFZTMASA-N 1 0 296.317 3.750 20 5 CHBDRO CCC[C@H]([NH2+]CCc1cccnc1)c1cccc([N+](=O)[O-])c1 ZINC000126169014 260346091 /nfs/dbraw/zinc/34/60/91/260346091.db2.gz JIJOSJNLXUERHI-KRWDZBQOSA-N 1 0 299.374 3.663 20 5 CHBDRO CC[C@@H]([NH2+]C[C@H]1CC=CCC1)c1cccc([N+](=O)[O-])c1 ZINC000045628923 260652047 /nfs/dbraw/zinc/65/20/47/260652047.db2.gz QEKGOSMBTWPCKP-XJKSGUPXSA-N 1 0 274.364 3.992 20 5 CHBDRO CCOc1cc(C[N@H+](CC)CC2CCC2)ccc1[N+](=O)[O-] ZINC000361482238 261290841 /nfs/dbraw/zinc/29/08/41/261290841.db2.gz WCDLLGFOSCFWCU-UHFFFAOYSA-N 1 0 292.379 3.616 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CC[C@H]2CCCCO2)cccc1[N+](=O)[O-] ZINC000180260459 261849653 /nfs/dbraw/zinc/84/96/53/261849653.db2.gz KNSXTKUCTLYNTF-ZIAGYGMSSA-N 1 0 292.379 3.513 20 5 CHBDRO COCCC(C)(C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000183928098 261999588 /nfs/dbraw/zinc/99/95/88/261999588.db2.gz CRKBDDHCSRZLBA-CYBMUJFWSA-N 1 0 294.395 3.617 20 5 CHBDRO CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000185942860 262072911 /nfs/dbraw/zinc/07/29/11/262072911.db2.gz BUPVSYNDVZGIKP-INIZCTEOSA-N 1 0 285.347 3.621 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000019981531 262210057 /nfs/dbraw/zinc/21/00/57/262210057.db2.gz LYYPYCLMZKZCLM-XUJVJEKNSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1ccc(C[NH2+]C[C@H]2CCCCC2(F)F)cc1[N+](=O)[O-] ZINC000390550368 262215640 /nfs/dbraw/zinc/21/56/40/262215640.db2.gz JVNCNVGUHMSZCB-CYBMUJFWSA-N 1 0 298.333 3.818 20 5 CHBDRO CCC[C@@H]([NH2+]C[C@@H]1CCSC1)c1cccc([N+](=O)[O-])c1 ZINC000228554644 262341879 /nfs/dbraw/zinc/34/18/79/262341879.db2.gz NJZWDARBPLEOTB-SWLSCSKDSA-N 1 0 294.420 3.779 20 5 CHBDRO CCC[C@@H]([NH2+]C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000021013642 262373681 /nfs/dbraw/zinc/37/36/81/262373681.db2.gz GGIAQFLFHWDFPG-OAHLLOKOSA-N 1 0 262.353 3.968 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000434774856 262710493 /nfs/dbraw/zinc/71/04/93/262710493.db2.gz IOMXWKHOYRRFJN-WFASDCNBSA-N 1 0 276.380 3.552 20 5 CHBDRO CCC[C@H]([NH2+][C@H]1C[C@@H](OCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000414139270 262809534 /nfs/dbraw/zinc/80/95/34/262809534.db2.gz IDNGCLVUTGVLQW-IMJJTQAJSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1cc(NC[C@@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000071948323 264260597 /nfs/dbraw/zinc/26/05/97/264260597.db2.gz RRWMKVFFJAHGBS-KRWDZBQOSA-N 1 0 299.374 3.618 20 5 CHBDRO CCOC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C(C)C ZINC000189348576 264292248 /nfs/dbraw/zinc/29/22/48/264292248.db2.gz FPAQHVOQYPIXCI-HIFRSBDPSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1ccc(C[NH2+]CC(C)(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000314736219 266001389 /nfs/dbraw/zinc/00/13/89/266001389.db2.gz NUZDTLOIORSKFJ-UHFFFAOYSA-N 1 0 298.386 3.971 20 5 CHBDRO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000356686575 266159704 /nfs/dbraw/zinc/15/97/04/266159704.db2.gz VHDHLTLWCQTTKJ-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000483720185 267298392 /nfs/dbraw/zinc/29/83/92/267298392.db2.gz FMTDOJASACFNIR-APHBMKBZSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H]([NH2+]C1CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000020020587 327881771 /nfs/dbraw/zinc/88/17/71/327881771.db2.gz UOBIHGIFFCMJFQ-LBPRGKRZSA-N 1 0 262.353 3.968 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000020544616 327911697 /nfs/dbraw/zinc/91/16/97/327911697.db2.gz AWJMTCQNOKHAIF-SGMGOOAPSA-N 1 0 292.379 3.518 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000040675940 328015610 /nfs/dbraw/zinc/01/56/10/328015610.db2.gz JPHICFUYNIBHMZ-CQSZACIVSA-N 1 0 290.388 3.940 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC(C)(C)C1 ZINC000563443258 328066718 /nfs/dbraw/zinc/06/67/18/328066718.db2.gz RAGAYDJSILMFCK-KPKJPENVSA-N 1 0 274.364 3.776 20 5 CHBDRO Cc1cccnc1CCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296627538 328291520 /nfs/dbraw/zinc/29/15/20/328291520.db2.gz XGNCXTBTEBNYNP-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO C[C@@H](Cc1ccsc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000049156008 328350877 /nfs/dbraw/zinc/35/08/77/328350877.db2.gz BKAHGWRHTHAKNB-RYUDHWBXSA-N 1 0 290.388 3.938 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccsc1)c1ccc([N+](=O)[O-])cc1 ZINC000049156014 328350882 /nfs/dbraw/zinc/35/08/82/328350882.db2.gz BKAHGWRHTHAKNB-NWDGAFQWSA-N 1 0 290.388 3.938 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccccc2)c(Cl)c1 ZINC000049963179 328379856 /nfs/dbraw/zinc/37/98/56/328379856.db2.gz JNFJVRWTFJKFSD-UHFFFAOYSA-N 1 0 290.750 3.581 20 5 CHBDRO CC(C)[C@@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000081046890 326807704 /nfs/dbraw/zinc/80/77/04/326807704.db2.gz NQBYFYFHBLOKLB-NWDGAFQWSA-N 1 0 250.342 3.538 20 5 CHBDRO C[C@H](CCC1CC1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000398232956 326875858 /nfs/dbraw/zinc/87/58/58/326875858.db2.gz UIYDYZJXNVOUHE-NEPJUHHUSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]1CCC[C@@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000088195112 327130427 /nfs/dbraw/zinc/13/04/27/327130427.db2.gz RIUBXHRJTWCZQF-QWHCGFSZSA-N 1 0 262.353 3.511 20 5 CHBDRO COC1([C@H](C)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CCC1 ZINC000570300935 327581914 /nfs/dbraw/zinc/58/19/14/327581914.db2.gz MPOHEDZROSHLJG-OLZOCXBDSA-N 1 0 292.379 3.511 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(F)c(Cl)c2)c1 ZINC000053149519 328663635 /nfs/dbraw/zinc/66/36/35/328663635.db2.gz XGNJFXCDAQWIIZ-UHFFFAOYSA-N 1 0 294.713 3.677 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C3(C4CC4)CC3)o2)c1 ZINC000532120778 328699950 /nfs/dbraw/zinc/69/99/50/328699950.db2.gz IHSPIDALHYSRMG-UHFFFAOYSA-N 1 0 298.342 3.887 20 5 CHBDRO CC1(C)CC[C@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000507789558 332823800 /nfs/dbraw/zinc/82/38/00/332823800.db2.gz UFALBXRDVDLUMR-DYLGSBMWSA-N 1 0 274.364 3.776 20 5 CHBDRO Cc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cc2)[NH+](C)C)cc1 ZINC000301118171 328826531 /nfs/dbraw/zinc/82/65/31/328826531.db2.gz VHMHWAVVGJLUGX-QGZVFWFLSA-N 1 0 299.374 3.618 20 5 CHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC1(C)C ZINC000582550686 329106329 /nfs/dbraw/zinc/10/63/29/329106329.db2.gz WAMCNBCCYRKXOX-DOMZBBRYSA-N 1 0 276.380 3.694 20 5 CHBDRO CC1=CC[C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000582537110 329108474 /nfs/dbraw/zinc/10/84/74/329108474.db2.gz NYDWIIPVAAIQSW-TZMCWYRMSA-N 1 0 260.337 3.744 20 5 CHBDRO CC1=CC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000582537109 329108502 /nfs/dbraw/zinc/10/85/02/329108502.db2.gz NYDWIIPVAAIQSW-OCCSQVGLSA-N 1 0 260.337 3.744 20 5 CHBDRO CC1(C2CC2)CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000582635450 329120070 /nfs/dbraw/zinc/12/00/70/329120070.db2.gz RFEMMPQJRPVJGE-UHFFFAOYSA-N 1 0 274.364 3.607 20 5 CHBDRO C[C@H]1CCC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000227309583 329272011 /nfs/dbraw/zinc/27/20/11/329272011.db2.gz OOEQGYJVOSITPQ-JQWIXIFHSA-N 1 0 268.382 3.715 20 5 CHBDRO CC(C)CSCC[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000582856631 329281329 /nfs/dbraw/zinc/28/13/29/329281329.db2.gz QMTDALRINZQSQA-CQSZACIVSA-N 1 0 294.420 3.561 20 5 CHBDRO C[C@H]1CCCC[C@@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000508993745 332854504 /nfs/dbraw/zinc/85/45/04/332854504.db2.gz YKMGSKBONIBLLU-XPTSAGLGSA-N 1 0 284.306 3.541 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000070111235 329855051 /nfs/dbraw/zinc/85/50/51/329855051.db2.gz MEBCZBXRWZQKGB-FOGDFJRCSA-N 1 0 268.382 3.571 20 5 CHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC1(F)CCC1 ZINC000580480011 330146793 /nfs/dbraw/zinc/14/67/93/330146793.db2.gz NNTOHZABVADLAU-ZDUSSCGKSA-N 1 0 294.370 3.788 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000035253369 330244348 /nfs/dbraw/zinc/24/43/48/330244348.db2.gz WVVSUKIIHUTOLR-FZMZJTMJSA-N 1 0 262.353 3.572 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CC1(C)C ZINC000536865050 330253582 /nfs/dbraw/zinc/25/35/82/330253582.db2.gz UGIVAWVADJAJOT-NEPJUHHUSA-N 1 0 262.353 3.600 20 5 CHBDRO CCC1CCC([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000044317989 330327566 /nfs/dbraw/zinc/32/75/66/330327566.db2.gz SLSSDSYZDGFFOZ-UHFFFAOYSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCOCCC(C)C)cccc1[N+](=O)[O-] ZINC000119542139 330377637 /nfs/dbraw/zinc/37/76/37/330377637.db2.gz YZWQFHYXTDWPHN-CQSZACIVSA-N 1 0 294.395 3.617 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCCc2ccccc21 ZINC000315506513 330476783 /nfs/dbraw/zinc/47/67/83/330476783.db2.gz CSGATIMNYBOGAS-QGZVFWFLSA-N 1 0 296.370 3.805 20 5 CHBDRO COc1ccc(C[NH+](CC(C)C)CC(C)C)cc1[N+](=O)[O-] ZINC000515540338 330479165 /nfs/dbraw/zinc/47/91/65/330479165.db2.gz OVTVTPXPVKXPLP-UHFFFAOYSA-N 1 0 294.395 3.717 20 5 CHBDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000083640391 330481494 /nfs/dbraw/zinc/48/14/94/330481494.db2.gz PZLYJUXHSNOMTN-TZMCWYRMSA-N 1 0 262.353 3.653 20 5 CHBDRO COc1ccc(C[NH2+]C2C[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000084461641 330485937 /nfs/dbraw/zinc/48/59/37/330485937.db2.gz ZKWBSJFECVZKRK-RYUDHWBXSA-N 1 0 292.379 3.518 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000084987751 330488836 /nfs/dbraw/zinc/48/88/36/330488836.db2.gz BUMQIQGFRFJRJM-VNHYZAJKSA-N 1 0 276.380 3.552 20 5 CHBDRO CC/C=C/CC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429259040 330541352 /nfs/dbraw/zinc/54/13/52/330541352.db2.gz SNTKGESVXOIUAY-AATRIKPKSA-N 1 0 262.353 3.776 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CCC3(CC3)CC2)c(F)c1 ZINC000434771642 330644727 /nfs/dbraw/zinc/64/47/27/330644727.db2.gz AFDAAJRGTZCIIN-UHFFFAOYSA-N 1 0 278.327 3.546 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000159926875 330854413 /nfs/dbraw/zinc/85/44/13/330854413.db2.gz ZXBUVPUVBVOARA-TZMCWYRMSA-N 1 0 292.379 3.511 20 5 CHBDRO CC(C)CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447506728 330867175 /nfs/dbraw/zinc/86/71/75/330867175.db2.gz DSSXVLPCFRJAQP-HNNXBMFYSA-N 1 0 262.353 3.608 20 5 CHBDRO CC(C)CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447506729 330867208 /nfs/dbraw/zinc/86/72/08/330867208.db2.gz DSSXVLPCFRJAQP-OAHLLOKOSA-N 1 0 262.353 3.608 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1cccs1 ZINC000449065699 330896706 /nfs/dbraw/zinc/89/67/06/330896706.db2.gz VSDSEYNDHIKLIY-NEPJUHHUSA-N 1 0 290.388 3.938 20 5 CHBDRO CC(C)[C@H]1CC[C@H]1[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449350915 330917440 /nfs/dbraw/zinc/91/74/40/330917440.db2.gz YCGKMAPRKOYJQR-NILFDRSVSA-N 1 0 262.353 3.680 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000449440606 330925735 /nfs/dbraw/zinc/92/57/35/330925735.db2.gz LLSXTNBKCLJKGO-INWMFGNUSA-N 1 0 288.391 3.694 20 5 CHBDRO C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000449706634 330945269 /nfs/dbraw/zinc/94/52/69/330945269.db2.gz NXZXZQLBHLLVSW-BCRSCGJKSA-N 1 0 274.364 3.776 20 5 CHBDRO CC[C@H](F)C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543735 331033395 /nfs/dbraw/zinc/03/33/95/331033395.db2.gz CJRZNEFMMCGMPM-KGLIPLIRSA-N 1 0 280.343 3.522 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCCCCC1 ZINC000470174562 331035488 /nfs/dbraw/zinc/03/54/88/331035488.db2.gz MDUXZSJKPWLXJP-KAMYIIQDSA-N 1 0 274.364 3.874 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000453119832 331091157 /nfs/dbraw/zinc/09/11/57/331091157.db2.gz MUXJIDDPJPAFQK-AWEZNQCLSA-N 1 0 290.388 3.940 20 5 CHBDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000453419503 331130448 /nfs/dbraw/zinc/13/04/48/331130448.db2.gz VOYIYCDECDYCTB-ARFHVFGLSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1cc(NCc2ccccc2[N+](=O)[O-])ccc1C[NH+](C)C ZINC000459733684 331296783 /nfs/dbraw/zinc/29/67/83/331296783.db2.gz BGMKHEGHZSHWEK-UHFFFAOYSA-N 1 0 299.374 3.577 20 5 CHBDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463483692 331348471 /nfs/dbraw/zinc/34/84/71/331348471.db2.gz ZJSNLCGEBLJGKP-LBPRGKRZSA-N 1 0 296.342 3.507 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000464680247 331364572 /nfs/dbraw/zinc/36/45/72/331364572.db2.gz ABNNLQHRJGJLOY-UHFFFAOYSA-N 1 0 298.358 3.801 20 5 CHBDRO CCC[C@]1(C)CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000464843144 331370624 /nfs/dbraw/zinc/37/06/24/331370624.db2.gz QNCHEPQXVXSTIN-MRXNPFEDSA-N 1 0 276.380 3.997 20 5 CHBDRO Cc1ccccc1C[C@@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000468450532 331435021 /nfs/dbraw/zinc/43/50/21/331435021.db2.gz XMBWZCJTROFNMW-OAHLLOKOSA-N 1 0 298.386 3.667 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC[C@@H](C)C1 ZINC000468592631 331437436 /nfs/dbraw/zinc/43/74/36/331437436.db2.gz VIDHLQRGWQUVMV-PUWKQBKRSA-N 1 0 274.364 3.776 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@@H]2CCCF)cc1 ZINC000510731206 332913988 /nfs/dbraw/zinc/91/39/88/332913988.db2.gz HRIRZFDSTXBPGZ-GDBMZVCRSA-N 1 0 294.370 3.645 20 5 CHBDRO CCC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccccn1 ZINC000477736156 331689487 /nfs/dbraw/zinc/68/94/87/331689487.db2.gz GSNVVTBNAKJSHO-OAHLLOKOSA-N 1 0 299.374 3.929 20 5 CHBDRO CC(C)=CCC[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000479292202 331723820 /nfs/dbraw/zinc/72/38/20/331723820.db2.gz ADJRROMFGKHBBB-AWEZNQCLSA-N 1 0 276.380 3.862 20 5 CHBDRO CC(C)=CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000479294864 331723851 /nfs/dbraw/zinc/72/38/51/331723851.db2.gz UOSPPWGJKHKHAG-GOEBONIOSA-N 1 0 288.391 3.862 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C)CC1 ZINC000485769660 331923453 /nfs/dbraw/zinc/92/34/53/331923453.db2.gz HNRDOICUVXMHGE-ZDUSSCGKSA-N 1 0 262.353 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(C)CC1 ZINC000485769657 331923470 /nfs/dbraw/zinc/92/34/70/331923470.db2.gz HNRDOICUVXMHGE-CYBMUJFWSA-N 1 0 262.353 3.696 20 5 CHBDRO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CS1 ZINC000488425020 332006494 /nfs/dbraw/zinc/00/64/94/332006494.db2.gz YZOMJIVVYXIWPB-CORIIIEPSA-N 1 0 294.420 3.776 20 5 CHBDRO COc1cc(C[NH2+]C(C)(C)CC(C)(C)C)ccc1[N+](=O)[O-] ZINC000489138499 332042114 /nfs/dbraw/zinc/04/21/14/332042114.db2.gz LZDKEEGBURQIGE-UHFFFAOYSA-N 1 0 294.395 3.908 20 5 CHBDRO CC[C@H]1CC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490010398 332076518 /nfs/dbraw/zinc/07/65/18/332076518.db2.gz BCSNTBOEMISIJV-STQMWFEESA-N 1 0 262.353 3.696 20 5 CHBDRO CC(C)=CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000490831438 332118742 /nfs/dbraw/zinc/11/87/42/332118742.db2.gz YCVDTZZVYDCXQY-UHFFFAOYSA-N 1 0 260.337 3.525 20 5 CHBDRO CC(C)([NH2+]C[C@@H]1CC=CCC1)c1ccccc1[N+](=O)[O-] ZINC000492238294 332388482 /nfs/dbraw/zinc/38/84/82/332388482.db2.gz FGTRWUQMBKXZBM-CYBMUJFWSA-N 1 0 274.364 3.776 20 5 CHBDRO CCC[C@@H](C)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000492310152 332391945 /nfs/dbraw/zinc/39/19/45/332391945.db2.gz GCBLDZDKSOSIRN-GFCCVEGCSA-N 1 0 264.369 3.856 20 5 CHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](C)CC2)ccc1[N+](=O)[O-] ZINC000492416512 332396534 /nfs/dbraw/zinc/39/65/34/332396534.db2.gz KPTOHWIIQWJUAW-ZDUSSCGKSA-N 1 0 292.379 3.616 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC1(F)CCC1 ZINC000575495519 335106389 /nfs/dbraw/zinc/10/63/89/335106389.db2.gz PAICVXQKBFLPRS-JLHYYAGUSA-N 1 0 292.354 3.870 20 5 CHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C2CCC2)c2ccccc2)c1 ZINC000494054341 332462259 /nfs/dbraw/zinc/46/22/59/332462259.db2.gz BWXJCWOWCYFTIS-KRWDZBQOSA-N 1 0 282.343 3.826 20 5 CHBDRO Cc1cc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)oc1C ZINC000502453243 332660839 /nfs/dbraw/zinc/66/08/39/332660839.db2.gz OIBBCEVDNIZYTO-LBPRGKRZSA-N 1 0 288.347 3.964 20 5 CHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCCCCC1 ZINC000310906800 333062421 /nfs/dbraw/zinc/06/24/21/333062421.db2.gz GGVNEXUPXUPKAD-UHFFFAOYSA-N 1 0 268.744 3.624 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000516658794 333080114 /nfs/dbraw/zinc/08/01/14/333080114.db2.gz YCZCVCZAPHPIAZ-OAHLLOKOSA-N 1 0 276.380 3.696 20 5 CHBDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000520972371 333109236 /nfs/dbraw/zinc/10/92/36/333109236.db2.gz PHENCYMORKZICA-OAHLLOKOSA-N 1 0 298.386 3.932 20 5 CHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H]3[C@@H]4CCC[C@@H]43)o2)c1 ZINC000521069318 333110997 /nfs/dbraw/zinc/11/09/97/333110997.db2.gz GMOVKOPXBYEZMJ-QLPKVWCKSA-N 1 0 298.342 3.743 20 5 CHBDRO C[C@H]1CCC[C@H](C[NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000218940147 333138699 /nfs/dbraw/zinc/13/86/99/333138699.db2.gz BWXQPKVWGTVYCH-KBPBESRZSA-N 1 0 276.380 3.553 20 5 CHBDRO CC(C)C(C)(C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000219265975 333145896 /nfs/dbraw/zinc/14/58/96/333145896.db2.gz SMULFEFFTRQGDC-LBPRGKRZSA-N 1 0 264.369 3.928 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2CC(OC(C)C)C2)cc1[N+](=O)[O-] ZINC000186553424 333162686 /nfs/dbraw/zinc/16/26/86/333162686.db2.gz ZTIFKRMXJJGDQD-GRTSSRMGSA-N 1 0 292.379 3.510 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000222786417 333200139 /nfs/dbraw/zinc/20/01/39/333200139.db2.gz KWPODCPXBZMVME-DTWKUNHWSA-N 1 0 276.258 3.586 20 5 CHBDRO CCC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000224505221 333221275 /nfs/dbraw/zinc/22/12/75/333221275.db2.gz ZCZRWAMRMNTPLM-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO Cc1c(C[N@H+]2CCC[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000522046690 333231604 /nfs/dbraw/zinc/23/16/04/333231604.db2.gz DWXOHDHFIUCIPT-WCQYABFASA-N 1 0 262.353 3.524 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCc2ccccc2)C2CC2)cc1 ZINC000195732297 333262557 /nfs/dbraw/zinc/26/25/57/333262557.db2.gz WFSVJLGFUODOND-UHFFFAOYSA-N 1 0 296.370 3.802 20 5 CHBDRO Cc1ccc(F)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000227284201 333279547 /nfs/dbraw/zinc/27/95/47/333279547.db2.gz KDNAFKYULJEHPN-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000522299724 333280831 /nfs/dbraw/zinc/28/08/31/333280831.db2.gz SOIBNXQNXMPKGV-HNNXBMFYSA-N 1 0 276.380 3.853 20 5 CHBDRO CCCC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000230145494 333314789 /nfs/dbraw/zinc/31/47/89/333314789.db2.gz LPLVSVACXTVFOO-LBPRGKRZSA-N 1 0 262.353 3.826 20 5 CHBDRO CC[C@H](C)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000523610478 333334217 /nfs/dbraw/zinc/33/42/17/333334217.db2.gz WUIUUCUBMQNNLT-ZDUSSCGKSA-N 1 0 294.395 3.860 20 5 CHBDRO CCc1ccc(CC[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000523777985 333345281 /nfs/dbraw/zinc/34/52/81/333345281.db2.gz DDPRXFNEKFOINJ-UHFFFAOYSA-N 1 0 298.386 3.832 20 5 CHBDRO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000235537941 333370591 /nfs/dbraw/zinc/37/05/91/333370591.db2.gz ISNSWPUMMXHSKQ-FZMZJTMJSA-N 1 0 262.353 3.509 20 5 CHBDRO C[C@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000312915618 333377014 /nfs/dbraw/zinc/37/70/14/333377014.db2.gz BQXHXWKKFZFYAP-CYBMUJFWSA-N 1 0 276.380 3.901 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H](c2ccccc2)C2CC2)c1 ZINC000538117119 333575068 /nfs/dbraw/zinc/57/50/68/333575068.db2.gz RKIYLWIGNUUPGB-GOSISDBHSA-N 1 0 296.370 3.878 20 5 CHBDRO C[C@@H]([NH2+]C1CCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000540149667 333713298 /nfs/dbraw/zinc/71/32/98/333713298.db2.gz WMJZEFHXBZFURK-SNVBAGLBSA-N 1 0 284.306 3.823 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000135168105 334118763 /nfs/dbraw/zinc/11/87/63/334118763.db2.gz JIDCKAVDFALHPT-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO C[C@H]1CCCCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000547931339 334129786 /nfs/dbraw/zinc/12/97/86/334129786.db2.gz JZHYRYDFUNLXLB-YHAOYDPOSA-N 1 0 274.364 3.873 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@H]2CSC2(C)C)cc1[N+](=O)[O-] ZINC000548988920 334182030 /nfs/dbraw/zinc/18/20/30/334182030.db2.gz FHTZDRWQECDIIF-AWEZNQCLSA-N 1 0 294.420 3.702 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000245521621 334200461 /nfs/dbraw/zinc/20/04/61/334200461.db2.gz LCKGTBWBHRWFFD-IHRRRGAJSA-N 1 0 274.364 3.696 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)cc1 ZINC000081635445 334201245 /nfs/dbraw/zinc/20/12/45/334201245.db2.gz MINATVPSTSFKKV-LSDHHAIUSA-N 1 0 274.364 3.653 20 5 CHBDRO C[C@H](F)CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000550883571 334231660 /nfs/dbraw/zinc/23/16/60/334231660.db2.gz XEQLIRVKSLWDTI-GZBFAFLISA-N 1 0 294.370 3.644 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC=C(c3ccccc3)C2)cc1 ZINC000551407536 334249487 /nfs/dbraw/zinc/24/94/87/334249487.db2.gz YKPRHGDILJHURQ-UHFFFAOYSA-N 1 0 294.354 3.884 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC=C(c3ccccc3)C2)c1 ZINC000551710811 334258684 /nfs/dbraw/zinc/25/86/84/334258684.db2.gz BZDUPDKMXIMOFE-UHFFFAOYSA-N 1 0 294.354 3.884 20 5 CHBDRO CC(C)[C@H]1CC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000552283017 334313055 /nfs/dbraw/zinc/31/30/55/334313055.db2.gz VCIIHFOSOPGKMD-TZMCWYRMSA-N 1 0 282.771 3.772 20 5 CHBDRO CC[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000252710748 334385971 /nfs/dbraw/zinc/38/59/71/334385971.db2.gz HPFOQMXHAGQRLD-LALPHHSUSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@H]1C[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])c2ccccc21 ZINC000554738879 334450197 /nfs/dbraw/zinc/45/01/97/334450197.db2.gz MUXCOWQTSYXXSY-SUMWQHHRSA-N 1 0 296.370 3.975 20 5 CHBDRO CCC1([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CCCC1 ZINC000382553681 336093449 /nfs/dbraw/zinc/09/34/49/336093449.db2.gz HDOWLRGTYZKYIC-UHFFFAOYSA-N 1 0 262.353 3.716 20 5 CHBDRO CC1(C)C[C@H]1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447578505 517514072 /nfs/dbraw/zinc/51/40/72/517514072.db2.gz FWKPSFJQEFCSJP-SWLSCSKDSA-N 1 0 274.364 3.608 20 5 CHBDRO Cc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000037871774 518190465 /nfs/dbraw/zinc/19/04/65/518190465.db2.gz OPRGNOPRLHXFQW-UHFFFAOYSA-N 1 0 270.332 3.501 20 5 CHBDRO CCCC[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000050888093 521007845 /nfs/dbraw/zinc/00/78/45/521007845.db2.gz QZYDAGJZPQUNIU-SNVBAGLBSA-N 1 0 270.760 3.917 20 5 CHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H](C)c1cccnc1 ZINC000290314976 521330712 /nfs/dbraw/zinc/33/07/12/521330712.db2.gz CKRRCBGKEYPCEA-CQSZACIVSA-N 1 0 299.374 3.881 20 5 CHBDRO CCSCCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000337409719 521705195 /nfs/dbraw/zinc/70/51/95/521705195.db2.gz NCHCNDKXSQJDFN-OAHLLOKOSA-N 1 0 294.420 3.705 20 5 CHBDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000130169557 523122539 /nfs/dbraw/zinc/12/25/39/523122539.db2.gz BAFYBSJDYCFYNG-INIZCTEOSA-N 1 0 285.347 3.573 20 5 CHBDRO CO[C@@]1(C)CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000280647272 523809459 /nfs/dbraw/zinc/80/94/59/523809459.db2.gz YUNRUGJUBYLTHQ-CJNGLKHVSA-N 1 0 292.379 3.547 20 5 CHBDRO COc1ccc(C[NH2+][C@H](C)c2cccs2)cc1[N+](=O)[O-] ZINC000035737061 524090884 /nfs/dbraw/zinc/09/08/84/524090884.db2.gz KPKRNXYQXFOYMG-SNVBAGLBSA-N 1 0 292.360 3.516 20 5 CHBDRO C[C@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000040675918 524485503 /nfs/dbraw/zinc/48/55/03/524485503.db2.gz IXBDHUPSVACWAH-CQSZACIVSA-N 1 0 284.359 3.531 20 5 CHBDRO Cc1ccccc1C(C)(C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000293064955 525071223 /nfs/dbraw/zinc/07/12/23/525071223.db2.gz UYPQKNJUGXUZJV-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000280420535 525499158 /nfs/dbraw/zinc/49/91/58/525499158.db2.gz QQVJPFSLVMVRQT-MNOVXSKESA-N 1 0 284.306 3.681 20 5 CHBDRO Cc1cc2cc(C[NH2+]Cc3ccccc3[N+](=O)[O-])ccc2[nH]1 ZINC000353134589 525640883 /nfs/dbraw/zinc/64/08/83/525640883.db2.gz HNAMLWWGBLOVFA-UHFFFAOYSA-N 1 0 295.342 3.674 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000038097735 525735030 /nfs/dbraw/zinc/73/50/30/525735030.db2.gz DOWAQQBVBHTKCP-GFCCVEGCSA-N 1 0 274.320 3.655 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CCCS2)cc1[N+](=O)[O-] ZINC000122050772 525922394 /nfs/dbraw/zinc/92/23/94/525922394.db2.gz IVLVYQIXNICSDB-SWLSCSKDSA-N 1 0 294.420 3.840 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2cccnc2)C2CCC2)cc1 ZINC000281008424 527350964 /nfs/dbraw/zinc/35/09/64/527350964.db2.gz YGGIIHSUSSEXIX-QGZVFWFLSA-N 1 0 297.358 3.621 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2CCC(F)(F)CC2)cc1 ZINC000337290647 527351339 /nfs/dbraw/zinc/35/13/39/527351339.db2.gz MFEIPZCDNUUMBJ-UHFFFAOYSA-N 1 0 284.306 3.510 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCCc3ccccc32)c1 ZINC000340140054 527386927 /nfs/dbraw/zinc/38/69/27/527386927.db2.gz LPJBIZKNUOVHNL-GOSISDBHSA-N 1 0 296.370 3.805 20 5 CHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CC[C@H](F)C2)c2cc([N+](=O)[O-])ccc21 ZINC000331636483 527747717 /nfs/dbraw/zinc/74/77/17/527747717.db2.gz SJCHWJGXQIMIDY-RWSFTLGLSA-N 1 0 292.354 3.797 20 5 CHBDRO CCC(C)(CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000227983941 1121018623 /nfs/dbraw/zinc/01/86/23/1121018623.db2.gz MUHSLOINJXEZGZ-UHFFFAOYSA-N 1 0 270.760 3.917 20 5 CHBDRO CCC[C@H](C)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507020290 1122919523 /nfs/dbraw/zinc/91/95/23/1122919523.db2.gz HHMQZBAGYQPYBH-SZNGSJQDSA-N 1 0 262.353 3.728 20 5 CHBDRO C[C@@H](C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])CC(F)F ZINC000697352390 1125305962 /nfs/dbraw/zinc/30/59/62/1125305962.db2.gz SCHBNFMAZMPCKV-MRVPVSSYSA-N 1 0 292.713 3.629 20 5 CHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC1(F)CCC1)CCC2 ZINC000348318786 1125544076 /nfs/dbraw/zinc/54/40/76/1125544076.db2.gz FXSDPSAXRCETQV-OAHLLOKOSA-N 1 0 292.354 3.844 20 5 CHBDRO CN1CC[C@H]([NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000729682668 1125548345 /nfs/dbraw/zinc/54/83/45/1125548345.db2.gz YOEQDSZFBZCWBH-KRWDZBQOSA-N 1 0 290.410 3.787 20 5 CHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000885962917 1125631250 /nfs/dbraw/zinc/63/12/50/1125631250.db2.gz IPZUBCPQVJVRQM-INIZCTEOSA-N 1 0 297.358 3.635 20 5 CHBDRO CC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1cc(C)ccc1C ZINC000886300715 1125667371 /nfs/dbraw/zinc/66/73/71/1125667371.db2.gz OLJHSXIXNVOHBR-INIZCTEOSA-N 1 0 299.374 3.848 20 5 CHBDRO C[C@@H]([NH2+]C1(C2CC2)CCC1)c1ccccc1[N+](=O)[O-] ZINC000886825082 1125721467 /nfs/dbraw/zinc/72/14/67/1125721467.db2.gz LYDCJEZPOABMDC-LLVKDONJSA-N 1 0 260.337 3.578 20 5 CHBDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000121968573 1125780905 /nfs/dbraw/zinc/78/09/05/1125780905.db2.gz LZEDDBBJPIGMLZ-QWHCGFSZSA-N 1 0 294.395 3.757 20 5 CHBDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000482515262 1126762665 /nfs/dbraw/zinc/76/26/65/1126762665.db2.gz VYLAIAMRJOYIDC-MTENODCZSA-N 1 0 274.364 3.728 20 5 CHBDRO O=[N+]([O-])c1cccc(F)c1C[N@H+](CC1CC1)CC1CCC1 ZINC000483266996 1126777366 /nfs/dbraw/zinc/77/73/66/1126777366.db2.gz LBZOQJXLJDYVPN-UHFFFAOYSA-N 1 0 292.354 3.746 20 5 CHBDRO CC1=C(C)C[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000483366363 1126783223 /nfs/dbraw/zinc/78/32/23/1126783223.db2.gz IZAMHMAILJEVKE-ZDUSSCGKSA-N 1 0 260.337 3.698 20 5 CHBDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000483750007 1126800280 /nfs/dbraw/zinc/80/02/80/1126800280.db2.gz VLVAQAJOBINXLN-JGGQBBKZSA-N 1 0 292.379 3.511 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CCc1ccccn1 ZINC000182939890 1126879831 /nfs/dbraw/zinc/87/98/31/1126879831.db2.gz YMKGTUKCINQOIF-AWEZNQCLSA-N 1 0 299.374 3.534 20 5 CHBDRO CC(C)(C)CC(C)(C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000037100608 1126880236 /nfs/dbraw/zinc/88/02/36/1126880236.db2.gz XKGRLKKPTXJRRP-UHFFFAOYSA-N 1 0 264.369 3.899 20 5 CHBDRO COc1cc(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000485733614 1126948374 /nfs/dbraw/zinc/94/83/74/1126948374.db2.gz BMBCJBQFKPEEOI-GXTWGEPZSA-N 1 0 292.379 3.614 20 5 CHBDRO COc1cc(C[N@H+](CCC(C)C)C2CC2)ccc1[N+](=O)[O-] ZINC000485714672 1126945450 /nfs/dbraw/zinc/94/54/50/1126945450.db2.gz GKDLWFHYEQUWOI-UHFFFAOYSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H](C)C1 ZINC000485765822 1126950869 /nfs/dbraw/zinc/95/08/69/1126950869.db2.gz MCBOCMFUXDBOEA-WCQYABFASA-N 1 0 262.353 3.696 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H](C)C1 ZINC000485765820 1126950952 /nfs/dbraw/zinc/95/09/52/1126950952.db2.gz MCBOCMFUXDBOEA-DGCLKSJQSA-N 1 0 262.353 3.696 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCNc3ccccc32)cc1 ZINC000192972082 1126966013 /nfs/dbraw/zinc/96/60/13/1126966013.db2.gz FBDNUXARNWDKQT-KRWDZBQOSA-N 1 0 297.358 3.631 20 5 CHBDRO CCN(Cc1ccccn1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000270707222 1127060715 /nfs/dbraw/zinc/06/07/15/1127060715.db2.gz GXZHAPXIRHBGSL-ZDUSSCGKSA-N 1 0 285.347 3.573 20 5 CHBDRO Cc1ccc(C[N@@H+](Cc2cccnc2)C(C)C)cc1[N+](=O)[O-] ZINC000349288626 1127146542 /nfs/dbraw/zinc/14/65/42/1127146542.db2.gz WDXRKWPGVJSEGC-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C2CC2)CC1 ZINC000590006373 1127242693 /nfs/dbraw/zinc/24/26/93/1127242693.db2.gz BEYXUAJWCAVUJO-LBPRGKRZSA-N 1 0 274.364 3.778 20 5 CHBDRO CC(C)[C@@H]1N(Cc2ccc([N+](=O)[O-])cc2F)CC1(C)C ZINC000590372240 1127256645 /nfs/dbraw/zinc/25/66/45/1127256645.db2.gz ZITFLEWEROGMNI-AWEZNQCLSA-N 1 0 280.343 3.600 20 5 CHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C3CCCC3)C2)cc1 ZINC000590757614 1127270750 /nfs/dbraw/zinc/27/07/50/1127270750.db2.gz ILJTXMPVDCKLJO-CQSZACIVSA-N 1 0 274.364 3.717 20 5 CHBDRO CC(C)([NH2+]CC1=CCCC1)c1ccccc1[N+](=O)[O-] ZINC000592121789 1127336473 /nfs/dbraw/zinc/33/64/73/1127336473.db2.gz DHBOKAJLCVNHLE-UHFFFAOYSA-N 1 0 260.337 3.530 20 5 CHBDRO C[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)CC(F)F ZINC000592392225 1127344318 /nfs/dbraw/zinc/34/43/18/1127344318.db2.gz IUNBSYISDLBDAL-YGRLFVJLSA-N 1 0 298.333 3.853 20 5 CHBDRO Cc1c(C[NH2+]CCCC2CCCC2)cccc1[N+](=O)[O-] ZINC000225781899 1127349014 /nfs/dbraw/zinc/34/90/14/1127349014.db2.gz YFSJPNPXSJJOOW-UHFFFAOYSA-N 1 0 276.380 3.963 20 5 CHBDRO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)CC1CCC1 ZINC000355605280 1127353458 /nfs/dbraw/zinc/35/34/58/1127353458.db2.gz IZYAEVZDVNGQCL-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CC[C@@H](C)C1 ZINC000783309286 1127360703 /nfs/dbraw/zinc/36/07/03/1127360703.db2.gz JTNLPODVURDTDI-WXHSDQCUSA-N 1 0 262.353 3.742 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000226182223 1127380350 /nfs/dbraw/zinc/38/03/50/1127380350.db2.gz YJFOYVKQPGHZIF-SUNKGSAMSA-N 1 0 280.343 3.648 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1Cc2ccccc21 ZINC000594493907 1127418418 /nfs/dbraw/zinc/41/84/18/1127418418.db2.gz AMLDXSLTFDKGBA-GUYCJALGSA-N 1 0 294.354 3.512 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C1CC2(CCC2)C1 ZINC000594508690 1127419764 /nfs/dbraw/zinc/41/97/64/1127419764.db2.gz UPYXKSIKVCINGX-CQSZACIVSA-N 1 0 272.348 3.504 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C1CC2(CCC2)C1 ZINC000594508689 1127419770 /nfs/dbraw/zinc/41/97/70/1127419770.db2.gz UPYXKSIKVCINGX-AWEZNQCLSA-N 1 0 272.348 3.504 20 5 CHBDRO CC1(C)[C@H]2CCC[C@H]2[C@@H]1[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000595014087 1127441946 /nfs/dbraw/zinc/44/19/46/1127441946.db2.gz MSVLRFBPWYTQMH-IPYPFGDCSA-N 1 0 274.364 3.509 20 5 CHBDRO CC[C@@H]([NH2+]CCC1(C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000359005006 1127444092 /nfs/dbraw/zinc/44/40/92/1127444092.db2.gz QJASRGQBHZIHQA-CQSZACIVSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CCC(F)CC1 ZINC000594988705 1127444471 /nfs/dbraw/zinc/44/44/71/1127444471.db2.gz BSNVHIDDCQXZAE-LMWSTFAQSA-N 1 0 280.343 3.601 20 5 CHBDRO CSCCCCC[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000359114682 1127449719 /nfs/dbraw/zinc/44/97/19/1127449719.db2.gz FOCGTHKBDDJQJZ-CLFYSBASSA-N 1 0 294.420 3.731 20 5 CHBDRO Cc1c(C[NH2+][C@H](C)C(C)(C)C(F)F)cccc1[N+](=O)[O-] ZINC000595041416 1127450707 /nfs/dbraw/zinc/45/07/07/1127450707.db2.gz PTSXUIILBLAESA-SNVBAGLBSA-N 1 0 286.322 3.673 20 5 CHBDRO CC[C@H]([NH2+]CC1CC=CC1)c1cccc([N+](=O)[O-])c1 ZINC000595421793 1127462214 /nfs/dbraw/zinc/46/22/14/1127462214.db2.gz VDVJBUKWSOUZRN-HNNXBMFYSA-N 1 0 260.337 3.602 20 5 CHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)C1 ZINC000227398466 1127475135 /nfs/dbraw/zinc/47/51/35/1127475135.db2.gz AAJFWANJSHYBTM-UHIISALHSA-N 1 0 280.343 3.648 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119389 1127475164 /nfs/dbraw/zinc/47/51/64/1127475164.db2.gz XESNILICCWUTCK-FZMZJTMJSA-N 1 0 296.317 3.695 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](CCF)C1 ZINC000595754352 1127475208 /nfs/dbraw/zinc/47/52/08/1127475208.db2.gz ACKRLZNFXOEFEI-CHWSQXEVSA-N 1 0 280.343 3.727 20 5 CHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000596063516 1127482390 /nfs/dbraw/zinc/48/23/90/1127482390.db2.gz NAYKWEUPZMHORG-UHFFFAOYSA-N 1 0 290.285 3.663 20 5 CHBDRO C[C@@H](c1ccc(-c2ccc([N+](=O)[O-])nc2)cc1)[NH+]1CCCC1 ZINC000596637402 1127513929 /nfs/dbraw/zinc/51/39/29/1127513929.db2.gz KLEISRMYXLNKJJ-ZDUSSCGKSA-N 1 0 297.358 3.814 20 5 CHBDRO CC[C@H](C)C[C@@H](C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602559565 1127593158 /nfs/dbraw/zinc/59/31/58/1127593158.db2.gz FIUBBRQNSHKXJP-WDEREUQCSA-N 1 0 291.351 3.650 20 5 CHBDRO Cc1cc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccn1 ZINC000598587312 1127626858 /nfs/dbraw/zinc/62/68/58/1127626858.db2.gz PHIMNDYGRFDFDE-UHFFFAOYSA-N 1 0 299.374 3.709 20 5 CHBDRO CC[C@@H]([NH2+]CC[C@H]1CC1(F)F)c1cccc([N+](=O)[O-])c1 ZINC000598678927 1127631246 /nfs/dbraw/zinc/63/12/46/1127631246.db2.gz AVBIMNYIQPENKZ-WCQYABFASA-N 1 0 284.306 3.681 20 5 CHBDRO CCC[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)OCC ZINC000599057954 1127653911 /nfs/dbraw/zinc/65/39/11/1127653911.db2.gz DGHSZYKQCUJJSX-KBPBESRZSA-N 1 0 294.395 3.759 20 5 CHBDRO CC(F)(F)CCC[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000295960921 1127658712 /nfs/dbraw/zinc/65/87/12/1127658712.db2.gz HWBZUEHYUHPCNM-QPJJXVBHSA-N 1 0 284.306 3.633 20 5 CHBDRO CCOc1ccc([C@@H](C)[NH2+]C2(CC)CC2)cc1[N+](=O)[O-] ZINC000296618450 1127678791 /nfs/dbraw/zinc/67/87/91/1127678791.db2.gz WSBBMVKMNUGKPG-LLVKDONJSA-N 1 0 278.352 3.587 20 5 CHBDRO C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000229394191 1127679985 /nfs/dbraw/zinc/67/99/85/1127679985.db2.gz GIAQQCOBQCJSQC-IJLUTSLNSA-N 1 0 280.343 3.600 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2C2CCCC2)cc1 ZINC000604013221 1127689546 /nfs/dbraw/zinc/68/95/46/1127689546.db2.gz SVKDGXINSYSIRK-INIZCTEOSA-N 1 0 274.364 3.749 20 5 CHBDRO Cc1c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cccc1[N+](=O)[O-] ZINC000298787136 1127732673 /nfs/dbraw/zinc/73/26/73/1127732673.db2.gz WHBWZSJUZZLPFG-MRXNPFEDSA-N 1 0 285.347 3.568 20 5 CHBDRO CCCC[NH+](CCCC)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000062351167 1127748746 /nfs/dbraw/zinc/74/87/46/1127748746.db2.gz VMLMHOYMEUQHBJ-INIZCTEOSA-N 1 0 294.395 3.530 20 5 CHBDRO C[C@@H]1CCC[C@H]1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000230672712 1127771099 /nfs/dbraw/zinc/77/10/99/1127771099.db2.gz QEPMIIYCXQPYFS-MNOVXSKESA-N 1 0 282.771 3.774 20 5 CHBDRO Cc1c(C[N@H+](C)CC2CCCC2)cccc1[N+](=O)[O-] ZINC000064014402 1127892504 /nfs/dbraw/zinc/89/25/04/1127892504.db2.gz WNUYGNNQTVOUPK-UHFFFAOYSA-N 1 0 262.353 3.525 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000035257019 1127907147 /nfs/dbraw/zinc/90/71/47/1127907147.db2.gz YPCIHQHRDHAXFJ-HIFRSBDPSA-N 1 0 262.353 3.653 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094773823 1127927562 /nfs/dbraw/zinc/92/75/62/1127927562.db2.gz WONHCBMJUWQQHD-UHFFFAOYSA-N 1 0 268.332 3.792 20 5 CHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774664 1127963565 /nfs/dbraw/zinc/96/35/65/1127963565.db2.gz NQHNAHCIITZFIK-SMDDNHRTSA-N 1 0 280.343 3.744 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2CC2(C)C)cccc1[N+](=O)[O-] ZINC000540174589 1127965510 /nfs/dbraw/zinc/96/55/10/1127965510.db2.gz GARJQGHLKBKQML-NEPJUHHUSA-N 1 0 262.353 3.600 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cccc(F)c1 ZINC000544607451 1127978690 /nfs/dbraw/zinc/97/86/90/1127978690.db2.gz XOTQOAWNKFMHQO-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000467997649 1127986453 /nfs/dbraw/zinc/98/64/53/1127986453.db2.gz DVZZNIMNSMVOOO-VIKVFOODSA-N 1 0 276.380 3.552 20 5 CHBDRO Cc1ccsc1[C@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000468002603 1127987131 /nfs/dbraw/zinc/98/71/31/1127987131.db2.gz FBAFWGAVGIBOHA-LBPRGKRZSA-N 1 0 290.388 3.858 20 5 CHBDRO CC[C@]1(C)CC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000468136756 1127994691 /nfs/dbraw/zinc/99/46/91/1127994691.db2.gz AMWIOQOJAWDAGU-SWLSCSKDSA-N 1 0 262.353 3.778 20 5 CHBDRO COc1cc(C[N@H+](C)[C@@H](C)C(C)(C)C)c([N+](=O)[O-])cc1F ZINC000545206065 1128004885 /nfs/dbraw/zinc/00/48/85/1128004885.db2.gz IKNCFIIPABOJFX-JTQLQIEISA-N 1 0 298.358 3.609 20 5 CHBDRO CC(C)[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000468443896 1128008492 /nfs/dbraw/zinc/00/84/92/1128008492.db2.gz HIMSLCQQOAVBBW-HOTGVXAUSA-N 1 0 276.380 3.552 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC=CCC1 ZINC000468640190 1128015074 /nfs/dbraw/zinc/01/50/74/1128015074.db2.gz VRROCMNIAXJZTD-NRMKIYEFSA-N 1 0 272.348 3.696 20 5 CHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000541553685 1128027119 /nfs/dbraw/zinc/02/71/19/1128027119.db2.gz SRLLOJUMYOZPDA-XKOZXHHJSA-N 1 0 286.375 3.896 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000541772203 1128038678 /nfs/dbraw/zinc/03/86/78/1128038678.db2.gz VXNUWEYDFPACET-QGZVFWFLSA-N 1 0 282.343 3.850 20 5 CHBDRO C[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000595822173 1128040299 /nfs/dbraw/zinc/04/02/99/1128040299.db2.gz OKZVHVHXDSBNCO-ZBOXLXRLSA-N 1 0 298.333 3.740 20 5 CHBDRO C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]2CCCC[C@H]21 ZINC000542040498 1128048580 /nfs/dbraw/zinc/04/85/80/1128048580.db2.gz LCIRLVLNHXGBGD-KGYLQXTDSA-N 1 0 280.393 3.667 20 5 CHBDRO CC(C)(C)[C@@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000542320752 1128063781 /nfs/dbraw/zinc/06/37/81/1128063781.db2.gz UUEOBMUBNARSEZ-LLVKDONJSA-N 1 0 268.382 3.524 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000470182429 1128064784 /nfs/dbraw/zinc/06/47/84/1128064784.db2.gz LFLQSCROYNBAGZ-IONAJQSGSA-N 1 0 274.364 3.586 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1C[C@H](C)[C@@H](C)C1 ZINC000470182424 1128065069 /nfs/dbraw/zinc/06/50/69/1128065069.db2.gz LFLQSCROYNBAGZ-DUYRLRNSSA-N 1 0 274.364 3.586 20 5 CHBDRO CCOc1cc(C[N@H+](C)C(C)(C)CC)ccc1[N+](=O)[O-] ZINC000471026624 1128084897 /nfs/dbraw/zinc/08/48/97/1128084897.db2.gz ZUXSTIBVXYQIJO-UHFFFAOYSA-N 1 0 280.368 3.614 20 5 CHBDRO COc1ccc(C[NH2+]C[C@H]2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000388841125 1128097863 /nfs/dbraw/zinc/09/78/63/1128097863.db2.gz DPPBSTSKUVJYRD-CYBMUJFWSA-N 1 0 292.379 3.519 20 5 CHBDRO C[C@H]1CC[C@H](C)C1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000749925401 1128118160 /nfs/dbraw/zinc/11/81/60/1128118160.db2.gz VAPWJXFEMGROLI-UWVGGRQHSA-N 1 0 282.771 3.772 20 5 CHBDRO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)CC(C)C ZINC000609203427 1128173552 /nfs/dbraw/zinc/17/35/52/1128173552.db2.gz AFJNFSTZWKIKRQ-UHFFFAOYSA-N 1 0 294.395 3.860 20 5 CHBDRO CC[C@H](C[C@](C)(O)CC)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000926493333 1128175594 /nfs/dbraw/zinc/17/55/94/1128175594.db2.gz QTZPEUOMVSHDPM-JGGQBBKZSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCS[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000927029291 1128209542 /nfs/dbraw/zinc/20/95/42/1128209542.db2.gz CKFUOSZLXIVRMS-DRZSPHRISA-N 1 0 294.420 3.838 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCS[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000927029292 1128209806 /nfs/dbraw/zinc/20/98/06/1128209806.db2.gz CKFUOSZLXIVRMS-KGYLQXTDSA-N 1 0 294.420 3.838 20 5 CHBDRO CC(F)(F)CCC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000930554333 1128324923 /nfs/dbraw/zinc/32/49/23/1128324923.db2.gz IYMNQLUNPUEUFU-UHFFFAOYSA-N 1 0 286.322 3.855 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC2(C3CC3)CC2)cc1[N+](=O)[O-] ZINC000090772703 1128393977 /nfs/dbraw/zinc/39/39/77/1128393977.db2.gz HTJQAURZRTZFGR-GFCCVEGCSA-N 1 0 274.364 3.744 20 5 CHBDRO C[C@@H]([NH2+][C@H](C)c1ccc(F)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000932176681 1128398589 /nfs/dbraw/zinc/39/85/89/1128398589.db2.gz MBGVRNNUTVPHRX-GHMZBOCLSA-N 1 0 289.310 3.541 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](F)C2)cc1[N+](=O)[O-] ZINC000567269584 1128561561 /nfs/dbraw/zinc/56/15/61/1128561561.db2.gz NNEPDTRZSMIGDL-UBHSHLNASA-N 1 0 280.343 3.835 20 5 CHBDRO Cc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000568810340 1128592056 /nfs/dbraw/zinc/59/20/56/1128592056.db2.gz NNIVYCHDZDTKFN-HNNXBMFYSA-N 1 0 274.364 3.524 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC(C)(F)F ZINC000569191122 1128601615 /nfs/dbraw/zinc/60/16/15/1128601615.db2.gz ITOWHSWZIRLHBY-SNVBAGLBSA-N 1 0 272.295 3.599 20 5 CHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCc3ccccc3C2)cc1 ZINC000498921691 1128620992 /nfs/dbraw/zinc/62/09/92/1128620992.db2.gz HMBWWEFAKOAXHB-UHFFFAOYSA-N 1 0 282.343 3.543 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H](c2ccccc2)C2CC2)c1 ZINC000556882524 1128632699 /nfs/dbraw/zinc/63/26/99/1128632699.db2.gz KOEVEQPXOVTDQP-SFHVURJKSA-N 1 0 296.370 3.878 20 5 CHBDRO CCC(C)(C)[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000570917154 1128634135 /nfs/dbraw/zinc/63/41/35/1128634135.db2.gz ZHAOOLSUJVVDAS-LLVKDONJSA-N 1 0 250.342 3.509 20 5 CHBDRO CC(C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000600786952 1128681386 /nfs/dbraw/zinc/68/13/86/1128681386.db2.gz VXRUGWSAISOYAB-UHFFFAOYSA-N 1 0 270.332 3.760 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC12CC2)c1ccc([N+](=O)[O-])cc1 ZINC000601289231 1128708047 /nfs/dbraw/zinc/70/80/47/1128708047.db2.gz JYHOESUIAUWXET-BXUZGUMPSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@H]([NH2+][C@H]1CCCC12CC2)c1ccc([N+](=O)[O-])cc1 ZINC000601289233 1128708084 /nfs/dbraw/zinc/70/80/84/1128708084.db2.gz JYHOESUIAUWXET-FZMZJTMJSA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000601298375 1128708640 /nfs/dbraw/zinc/70/86/40/1128708640.db2.gz NONYPILWYBUWQD-UWVGGRQHSA-N 1 0 291.376 3.772 20 5 CHBDRO CCCC[N@@H+]1CCCC[C@@H]1CNc1ccsc1[N+](=O)[O-] ZINC000609560995 1128718164 /nfs/dbraw/zinc/71/81/64/1128718164.db2.gz QFFKXAIKXZMFFD-GFCCVEGCSA-N 1 0 297.424 3.723 20 5 CHBDRO CC1(C)CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609705139 1128722557 /nfs/dbraw/zinc/72/25/57/1128722557.db2.gz UJRHEFJZXCWKIT-UHFFFAOYSA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609846147 1128728666 /nfs/dbraw/zinc/72/86/66/1128728666.db2.gz HSTXBMTUANMIFS-LALPHHSUSA-N 1 0 292.354 3.887 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c(C)c1 ZINC000578883036 1128732032 /nfs/dbraw/zinc/73/20/32/1128732032.db2.gz WFEHKMKKBNCAHP-KRWDZBQOSA-N 1 0 296.370 3.989 20 5 CHBDRO CCC[C@H](C)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000036721077 1117745716 /nfs/dbraw/zinc/74/57/16/1117745716.db2.gz OKIZXDCZWDZXEW-FZMZJTMJSA-N 1 0 250.342 3.824 20 5 CHBDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610001966 1128734006 /nfs/dbraw/zinc/73/40/06/1128734006.db2.gz PVAFRERVEVUQMX-BBRMVZONSA-N 1 0 276.380 3.995 20 5 CHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)C[C@@H]1C ZINC000610133402 1128739632 /nfs/dbraw/zinc/73/96/32/1128739632.db2.gz MJQCNADJFPAFHX-STQMWFEESA-N 1 0 292.379 3.612 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC[C@@H](C)F)cc1[N+](=O)[O-] ZINC000339494190 1117808402 /nfs/dbraw/zinc/80/84/02/1117808402.db2.gz KSXZOMNHAHKZEZ-LLVKDONJSA-N 1 0 268.332 3.556 20 5 CHBDRO CC1(C)C[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000608836500 1117821040 /nfs/dbraw/zinc/82/10/40/1117821040.db2.gz NGEGPQUCYJFQCY-HNNXBMFYSA-N 1 0 286.331 3.743 20 5 CHBDRO CCC(CC)(CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1OC ZINC000430213165 1117879470 /nfs/dbraw/zinc/87/94/70/1117879470.db2.gz RUFITYWQNXXAHE-UHFFFAOYSA-N 1 0 280.368 3.662 20 5 CHBDRO Cc1c(C[N@@H+]2C[C@@H](C)CCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000610215380 1117882107 /nfs/dbraw/zinc/88/21/07/1117882107.db2.gz JQAJFDHREYJADX-QWHCGFSZSA-N 1 0 276.380 3.914 20 5 CHBDRO CC[NH+](CC)CCS[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000083093062 1117940662 /nfs/dbraw/zinc/94/06/62/1117940662.db2.gz RBEQBTNEAZUYCL-LBPRGKRZSA-N 1 0 282.409 3.731 20 5 CHBDRO C[C@@H]([N@H+](C)Cc1c(F)cccc1[N+](=O)[O-])C(C)(C)C ZINC000609144531 1117965351 /nfs/dbraw/zinc/96/53/51/1117965351.db2.gz BYJFFFOBQXUBCO-SNVBAGLBSA-N 1 0 268.332 3.600 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccccc3)CC2)cc1 ZINC000140160833 1118087161 /nfs/dbraw/zinc/08/71/61/1118087161.db2.gz SQPYUHJQEHITEX-UHFFFAOYSA-N 1 0 296.370 3.974 20 5 CHBDRO C[C@@H]1C[C@@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001648800232 1118125714 /nfs/dbraw/zinc/12/57/14/1118125714.db2.gz XZXLBKFKEVKLPT-DGCLKSJQSA-N 1 0 286.331 3.600 20 5 CHBDRO C[C@H](CC[NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000043534003 1118138392 /nfs/dbraw/zinc/13/83/92/1118138392.db2.gz SQMSJAFQNONKOH-CQSZACIVSA-N 1 0 284.359 3.878 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H]1C1CC1 ZINC000615835587 1128764357 /nfs/dbraw/zinc/76/43/57/1128764357.db2.gz TYWXAQDVWOAMFW-OJNOIJSXSA-N 1 0 286.375 3.873 20 5 CHBDRO CC(C)C1([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000340478362 1118286725 /nfs/dbraw/zinc/28/67/25/1118286725.db2.gz JQGKGMPXPCOTEK-HNNXBMFYSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@H]([N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])C1(C)CC1 ZINC000255331689 1118415118 /nfs/dbraw/zinc/41/51/18/1118415118.db2.gz DSNUFLJBKYPHLY-WOLRVDTOSA-N 1 0 274.364 3.728 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](C)CCC[C@H]1C ZINC000610215386 1118569981 /nfs/dbraw/zinc/56/99/81/1118569981.db2.gz KQEVFCWLXABPRH-QWHCGFSZSA-N 1 0 292.379 3.614 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000395140693 1118678747 /nfs/dbraw/zinc/67/87/47/1118678747.db2.gz FNULXZYNAVJXJG-OWTLIXCDSA-N 1 0 262.353 3.598 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000098005623 1118686518 /nfs/dbraw/zinc/68/65/18/1118686518.db2.gz LNSOHVPZSDGHHI-RYUDHWBXSA-N 1 0 264.369 3.928 20 5 CHBDRO CCn1ccc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])c1 ZINC000616737728 1128798349 /nfs/dbraw/zinc/79/83/49/1128798349.db2.gz FHAKECOFAHILEP-SOFGYWHQSA-N 1 0 299.374 3.561 20 5 CHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000071905893 1118962602 /nfs/dbraw/zinc/96/26/02/1118962602.db2.gz RAPBHFUBRFCGPI-MRXNPFEDSA-N 1 0 291.395 3.517 20 5 CHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000479582704 1119125171 /nfs/dbraw/zinc/12/51/71/1119125171.db2.gz YTTJSLMTYQTWGA-HNNXBMFYSA-N 1 0 262.353 3.605 20 5 CHBDRO CSCCCCC[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000235152685 1119325067 /nfs/dbraw/zinc/32/50/67/1119325067.db2.gz ZWLRCTCGAWPETG-UHFFFAOYSA-N 1 0 282.409 3.526 20 5 CHBDRO O=[N+]([O-])c1cc(C[NH+]2CCC(C3CC3)CC2)ccc1Cl ZINC000724812703 1119359448 /nfs/dbraw/zinc/35/94/48/1119359448.db2.gz TUBNCMVVCGHNEB-UHFFFAOYSA-N 1 0 294.782 3.870 20 5 CHBDRO CC(C)[NH+](CCCNc1ccc([N+](=O)[O-])s1)C(C)C ZINC000080606303 1128841842 /nfs/dbraw/zinc/84/18/42/1128841842.db2.gz WGPWSSDKVMSWSB-UHFFFAOYSA-N 1 0 285.413 3.577 20 5 CHBDRO CCC[C@@H]([NH2+]CC[C@H](C)F)c1cccc([N+](=O)[O-])c1 ZINC000340465758 1119418547 /nfs/dbraw/zinc/41/85/47/1119418547.db2.gz XLVCVHXXUIIMTE-SMDDNHRTSA-N 1 0 268.332 3.774 20 5 CHBDRO CCC1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000168133015 1119419451 /nfs/dbraw/zinc/41/94/51/1119419451.db2.gz QIFNDTCGBWREBI-UHFFFAOYSA-N 1 0 268.744 3.671 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCCc2occc21 ZINC000584063066 1119469504 /nfs/dbraw/zinc/46/95/04/1119469504.db2.gz GTKQWDIJGGCKEK-GJZGRUSLSA-N 1 0 298.342 3.842 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2C[C@H]2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000601306744 1119538600 /nfs/dbraw/zinc/53/86/00/1119538600.db2.gz PRIMGSDORRLRHO-FBIMIBRVSA-N 1 0 288.269 3.505 20 5 CHBDRO CC(C)[N@H+](CCC1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000480531727 1119591847 /nfs/dbraw/zinc/59/18/47/1119591847.db2.gz XZSPAKWZPVCSAD-UHFFFAOYSA-N 1 0 262.353 3.605 20 5 CHBDRO CC1CCC(C)([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000236662791 1119796873 /nfs/dbraw/zinc/79/68/73/1119796873.db2.gz SPDBLCUYUWZZMN-UHFFFAOYSA-N 1 0 268.382 3.715 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)C1(OC)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000414300576 1119971122 /nfs/dbraw/zinc/97/11/22/1119971122.db2.gz AOXTVVHVQKBWGO-DOMZBBRYSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@H]1CC[C@@]2(CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542882663 1120220470 /nfs/dbraw/zinc/22/04/70/1120220470.db2.gz CENHLVYXYMNLBE-WMLDXEAASA-N 1 0 288.391 3.649 20 5 CHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000086889892 1120223652 /nfs/dbraw/zinc/22/36/52/1120223652.db2.gz OXPCZAOMMBMHBU-OCCSQVGLSA-N 1 0 262.353 3.653 20 5 CHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC1CC1 ZINC000542930470 1120258558 /nfs/dbraw/zinc/25/85/58/1120258558.db2.gz PSQBOZIYEBUJRE-UHFFFAOYSA-N 1 0 282.771 3.869 20 5 CHBDRO CCC[C@@H]([NH2+][C@H](C)CC)c1cccc([N+](=O)[O-])c1 ZINC000020085778 1120279695 /nfs/dbraw/zinc/27/96/95/1120279695.db2.gz QUJCZGFIMWSGEE-BXUZGUMPSA-N 1 0 250.342 3.824 20 5 CHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])[C@@]12C[C@@H]1CCCC2 ZINC000709097755 1120324601 /nfs/dbraw/zinc/32/46/01/1120324601.db2.gz SACZWRUPGVNPHL-DUVNUKRYSA-N 1 0 274.364 3.653 20 5 CHBDRO Cc1ccc(CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000065431579 1120343552 /nfs/dbraw/zinc/34/35/52/1120343552.db2.gz VAXSQCLRNWEWMJ-UHFFFAOYSA-N 1 0 298.386 3.852 20 5 CHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C(C2CCC2)C2CCC2)cc1 ZINC000313929880 1120417096 /nfs/dbraw/zinc/41/70/96/1120417096.db2.gz WVPYEGDYCAAAKP-UHFFFAOYSA-N 1 0 288.391 3.696 20 5 CHBDRO CCC[C@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618561390 1128919284 /nfs/dbraw/zinc/91/92/84/1128919284.db2.gz CQQUECAQFZUKAM-XHDPSFHLSA-N 1 0 262.353 3.750 20 5 CHBDRO C[C@@H](C1CC1)[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000092009425 1120538415 /nfs/dbraw/zinc/53/84/15/1120538415.db2.gz PCIALLMDNUDLTL-BPJJOFIESA-N 1 0 286.375 3.871 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](c2ccccn2)C2CC2)cc1[N+](=O)[O-] ZINC000922586502 1120558751 /nfs/dbraw/zinc/55/87/51/1120558751.db2.gz XPKVCVXFEIYSMK-KRWDZBQOSA-N 1 0 297.358 3.539 20 5 CHBDRO CC(C)(/C=C/Cl)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000922649054 1120571718 /nfs/dbraw/zinc/57/17/18/1120571718.db2.gz RLIACMQOWDBDNT-ROBNAOGRSA-N 1 0 280.755 3.729 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000500380294 1120600233 /nfs/dbraw/zinc/60/02/33/1120600233.db2.gz XLEKNMWFILMLEL-LBPRGKRZSA-N 1 0 298.333 3.818 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCSC2(CCC2)C1 ZINC000922842888 1120609865 /nfs/dbraw/zinc/60/98/65/1120609865.db2.gz QNYXWRULNVAJMR-ZDUSSCGKSA-N 1 0 292.404 3.503 20 5 CHBDRO CCC[C@@H]([NH2+][C@H](C)CSC)c1cccc([N+](=O)[O-])c1 ZINC000131567128 1120663441 /nfs/dbraw/zinc/66/34/41/1120663441.db2.gz BGDMMKJTYVYWTJ-BXUZGUMPSA-N 1 0 282.409 3.777 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000085040739 1120715212 /nfs/dbraw/zinc/71/52/12/1120715212.db2.gz UUDWMZUXOOZARJ-NJZAAPMLSA-N 1 0 276.380 3.818 20 5 CHBDRO CC[C@H]([NH2+]CCOCCC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000045093963 1120745863 /nfs/dbraw/zinc/74/58/63/1120745863.db2.gz ODJHFDPLBWOTFJ-INIZCTEOSA-N 1 0 294.395 3.698 20 5 CHBDRO C[NH+](C)[C@@H]1CCC[C@@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432309332 1120946242 /nfs/dbraw/zinc/94/62/42/1120946242.db2.gz AVIKHZSSTKWEBS-GHMZBOCLSA-N 1 0 297.786 3.533 20 5 CHBDRO C[NH+](C)[C@H]1CCC[C@H](Nc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000432309334 1120946747 /nfs/dbraw/zinc/94/67/47/1120946747.db2.gz AVIKHZSSTKWEBS-QWRGUYRKSA-N 1 0 297.786 3.533 20 5 CHBDRO CSCC1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000295541584 1120969135 /nfs/dbraw/zinc/96/91/35/1120969135.db2.gz XMDSSFNHGRTEMX-UHFFFAOYSA-N 1 0 294.420 3.606 20 5 CHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC000585754271 1121029037 /nfs/dbraw/zinc/02/90/37/1121029037.db2.gz CRPSJMYVMCFTEL-UHFFFAOYSA-N 1 0 284.359 3.962 20 5 CHBDRO C[C@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC000344004479 1121050778 /nfs/dbraw/zinc/05/07/78/1121050778.db2.gz ZRLUDOCQKCOMER-SNVBAGLBSA-N 1 0 268.382 3.524 20 5 CHBDRO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000172018181 1121136759 /nfs/dbraw/zinc/13/67/59/1121136759.db2.gz HRVSRGYLARZUKQ-UHFFFAOYSA-N 1 0 268.744 3.623 20 5 CHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCC1 ZINC000070306164 1128966678 /nfs/dbraw/zinc/96/66/78/1128966678.db2.gz LURAPIOZMOAMSF-SNVBAGLBSA-N 1 0 282.771 3.917 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCC2(F)CCC2)c1 ZINC000702486927 1121202128 /nfs/dbraw/zinc/20/21/28/1121202128.db2.gz IASPBTHYXMWSKV-UHFFFAOYSA-N 1 0 286.734 3.620 20 5 CHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000512230857 1121212614 /nfs/dbraw/zinc/21/26/14/1121212614.db2.gz VJLNWKNJRNKMRF-QSYFUGGGSA-N 1 0 276.380 3.974 20 5 CHBDRO CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H](C)C(C)C ZINC000512224246 1121212665 /nfs/dbraw/zinc/21/26/65/1121212665.db2.gz ARUMYVDTLXJAEA-CYBMUJFWSA-N 1 0 264.369 3.770 20 5 CHBDRO Nc1c[nH+]cn1-c1c2ccccc2cc2ccccc21 ZINC001175352334 1121293391 /nfs/dbraw/zinc/29/33/91/1121293391.db2.gz IJNDGOJSMXKKTD-UHFFFAOYSA-N 1 0 259.312 3.761 20 5 CHBDRO CCC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000500617966 1121325330 /nfs/dbraw/zinc/32/53/30/1121325330.db2.gz NPLSXYVEZMQSII-OAHLLOKOSA-N 1 0 299.374 3.663 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCSC2)cc1[N+](=O)[O-] ZINC000704771535 1121368116 /nfs/dbraw/zinc/36/81/16/1121368116.db2.gz MTIVPAPWYGPPKW-CHWSQXEVSA-N 1 0 294.420 3.697 20 5 CHBDRO CC1(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCC1 ZINC000432827755 1121396179 /nfs/dbraw/zinc/39/61/79/1121396179.db2.gz GKWCXGAXIABZEM-UHFFFAOYSA-N 1 0 274.364 3.749 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H]2C2CC2)c1 ZINC000706881206 1121443224 /nfs/dbraw/zinc/44/32/24/1121443224.db2.gz BHAJKDVPGGBIFU-CQSZACIVSA-N 1 0 280.755 3.623 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000706956660 1121445965 /nfs/dbraw/zinc/44/59/65/1121445965.db2.gz MIMCLHNNHGXGKK-VXGBXAGGSA-N 1 0 262.353 3.742 20 5 CHBDRO CCC[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543632632 1121538649 /nfs/dbraw/zinc/53/86/49/1121538649.db2.gz VQJNKWRJWXBSNK-LBPRGKRZSA-N 1 0 250.342 3.524 20 5 CHBDRO COc1ccc(Nc2cc[nH+]c(C3CC3)c2)cc1[N+](=O)[O-] ZINC001176364464 1121614868 /nfs/dbraw/zinc/61/48/68/1121614868.db2.gz WLJCSLJJRUIBPI-UHFFFAOYSA-N 1 0 285.303 3.619 20 5 CHBDRO CSC[C@@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433263785 1121633116 /nfs/dbraw/zinc/63/31/16/1121633116.db2.gz WXCAFJWKTNGPRB-QMTHXVAHSA-N 1 0 294.420 3.658 20 5 CHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000611271345 1121634162 /nfs/dbraw/zinc/63/41/62/1121634162.db2.gz SNRPIEXWYVGVTP-YFCVBGDOSA-N 1 0 298.342 3.691 20 5 CHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H](OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000611337072 1121638181 /nfs/dbraw/zinc/63/81/81/1121638181.db2.gz OKQKYYOOJUFPSJ-KBMXLJTQSA-N 1 0 292.379 3.593 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@H]1CCCCO1 ZINC000611477472 1121651556 /nfs/dbraw/zinc/65/15/56/1121651556.db2.gz QGUYONXMLLYDIE-WOSRLPQWSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)[C@H]1CC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000397796412 1121696966 /nfs/dbraw/zinc/69/69/66/1121696966.db2.gz QWVBWVYPMULKLA-COPLHBTASA-N 1 0 262.353 3.680 20 5 CHBDRO Cc1c(C[NH2+][C@@H](C)CCC2CC2)cccc1[N+](=O)[O-] ZINC000398057233 1121704929 /nfs/dbraw/zinc/70/49/29/1121704929.db2.gz ZIAOEFDICNBKOJ-NSHDSACASA-N 1 0 262.353 3.572 20 5 CHBDRO CC[C@H]([NH2+][C@H]1CCC12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000619723845 1129008522 /nfs/dbraw/zinc/00/85/22/1129008522.db2.gz OWYCLERAEYBJIA-GJZGRUSLSA-N 1 0 274.364 3.968 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC23CCC3)cc1[N+](=O)[O-] ZINC000619723958 1129009226 /nfs/dbraw/zinc/00/92/26/1129009226.db2.gz GXXFUCSTSVFQNQ-WFASDCNBSA-N 1 0 274.364 3.887 20 5 CHBDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000068593332 1121840203 /nfs/dbraw/zinc/84/02/03/1121840203.db2.gz SRYQQAGPSAWVSI-GXTWGEPZSA-N 1 0 292.379 3.662 20 5 CHBDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000068593321 1121840573 /nfs/dbraw/zinc/84/05/73/1121840573.db2.gz SRYQQAGPSAWVSI-OCCSQVGLSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1ccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000619785182 1129013751 /nfs/dbraw/zinc/01/37/51/1129013751.db2.gz RWVSKVBZBSAONM-UHFFFAOYSA-N 1 0 284.359 3.578 20 5 CHBDRO CC(C)c1ccc(C[NH2+][C@@]2(C)CC2(C)C)cc1[N+](=O)[O-] ZINC001179216518 1121860408 /nfs/dbraw/zinc/86/04/08/1121860408.db2.gz MNWAXSXTWIRSDP-INIZCTEOSA-N 1 0 276.380 3.996 20 5 CHBDRO Cc1ccc(C[NH2+]CC[C@H]2CCCC2(F)F)cc1[N+](=O)[O-] ZINC001179442341 1121876782 /nfs/dbraw/zinc/87/67/82/1121876782.db2.gz CQLFXOLKZMMPGE-CYBMUJFWSA-N 1 0 298.333 3.818 20 5 CHBDRO C[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000110804346 1121992490 /nfs/dbraw/zinc/99/24/90/1121992490.db2.gz KNJZATNHRVEVLN-NSHDSACASA-N 1 0 282.771 3.870 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000501792210 1122009897 /nfs/dbraw/zinc/00/98/97/1122009897.db2.gz CWLNPQCGLYWFAN-JHJVBQTASA-N 1 0 262.353 3.634 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccs2)cc1[N+](=O)[O-] ZINC000034996388 1122136723 /nfs/dbraw/zinc/13/67/23/1122136723.db2.gz OIYRABXTESNNLE-NSHDSACASA-N 1 0 276.361 3.816 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C1(C)CC1 ZINC000774282306 1122153315 /nfs/dbraw/zinc/15/33/15/1122153315.db2.gz DBUQJLIWPULVSK-XHDPSFHLSA-N 1 0 274.364 3.750 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000035053174 1122160434 /nfs/dbraw/zinc/16/04/34/1122160434.db2.gz LKAOFDSXBNWNJF-QGZVFWFLSA-N 1 0 282.343 3.836 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCCC1 ZINC000504918717 1122310257 /nfs/dbraw/zinc/31/02/57/1122310257.db2.gz HVMODICNQIWKBQ-GFCCVEGCSA-N 1 0 294.420 3.998 20 5 CHBDRO Cc1ccc(C[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000505355197 1122361751 /nfs/dbraw/zinc/36/17/51/1122361751.db2.gz FLHFQULANOAVKQ-UHFFFAOYSA-N 1 0 262.353 3.668 20 5 CHBDRO C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000716534511 1122422576 /nfs/dbraw/zinc/42/25/76/1122422576.db2.gz WYWCWBHIRDWRIK-OJDJGZDQSA-N 1 0 294.782 3.630 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC=C(C)C1 ZINC000436274109 1122533281 /nfs/dbraw/zinc/53/32/81/1122533281.db2.gz XRKUNYYDERWWOA-ZDUSSCGKSA-N 1 0 260.337 3.616 20 5 CHBDRO C[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC001190661911 1122549192 /nfs/dbraw/zinc/54/91/92/1122549192.db2.gz VSOHEJCOYJFPQV-LLVKDONJSA-N 1 0 282.771 3.870 20 5 CHBDRO CCCC[C@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000578053299 1122552873 /nfs/dbraw/zinc/55/28/73/1122552873.db2.gz KSGMJCMQRHSIOP-LBPRGKRZSA-N 1 0 250.342 3.605 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CCCC12CC2)c1cccc([N+](=O)[O-])c1 ZINC000601289566 1122616354 /nfs/dbraw/zinc/61/63/54/1122616354.db2.gz PBIVQAXKBWZEGM-BXUZGUMPSA-N 1 0 260.337 3.578 20 5 CHBDRO C[C@@H]1CCCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001193509509 1122696365 /nfs/dbraw/zinc/69/63/65/1122696365.db2.gz ZZRDWWTWMDEWOO-LLVKDONJSA-N 1 0 282.771 3.870 20 5 CHBDRO CC[C@@H]1CCC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000509546646 1122726317 /nfs/dbraw/zinc/72/63/17/1122726317.db2.gz WOOFNUXLZWRKIF-CYBMUJFWSA-N 1 0 262.353 3.525 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCCCCCCC1 ZINC001194399913 1122771519 /nfs/dbraw/zinc/77/15/19/1122771519.db2.gz BFADYIRLASSPNT-UHFFFAOYSA-N 1 0 292.379 3.760 20 5 CHBDRO C[C@@H](c1ccccn1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183679117 1129081148 /nfs/dbraw/zinc/08/11/48/1129081148.db2.gz XOPNJWSGGUOVNY-KGXGESDWSA-N 1 0 297.358 3.696 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CC1(C)C ZINC001195269472 1122858779 /nfs/dbraw/zinc/85/87/79/1122858779.db2.gz MGCUIUSSHILYCZ-OLZOCXBDSA-N 1 0 280.343 3.648 20 5 CHBDRO C[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC001195359730 1122865600 /nfs/dbraw/zinc/86/56/00/1122865600.db2.gz XTUDSEBEXDPVES-CYBMUJFWSA-N 1 0 292.379 3.532 20 5 CHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC(C)C ZINC000507116752 1122924860 /nfs/dbraw/zinc/92/48/60/1122924860.db2.gz RIUPPIWQHCWICQ-VQHVLOKHSA-N 1 0 262.353 3.586 20 5 CHBDRO Cc1cc(F)ccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000507135082 1122930818 /nfs/dbraw/zinc/93/08/18/1122930818.db2.gz PRXNNRVMZAXRPU-UHFFFAOYSA-N 1 0 288.322 3.674 20 5 CHBDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000507194401 1122937964 /nfs/dbraw/zinc/93/79/64/1122937964.db2.gz FZGCYJJZWYBYCD-INIZCTEOSA-N 1 0 296.370 3.893 20 5 CHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000507673609 1122983819 /nfs/dbraw/zinc/98/38/19/1122983819.db2.gz OZPUWMCMZSKUSQ-QGZVFWFLSA-N 1 0 296.370 3.659 20 5 CHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2ccc(C3CC3)cc2)c1 ZINC001201821829 1123153163 /nfs/dbraw/zinc/15/31/63/1123153163.db2.gz AQVGSZKXYLIAIC-UHFFFAOYSA-N 1 0 296.370 3.805 20 5 CHBDRO C[C@@H]1CCC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)CC1 ZINC001201823229 1123153442 /nfs/dbraw/zinc/15/34/42/1123153442.db2.gz XJWRVPUSVISHLX-UKRRQHHQSA-N 1 0 276.380 3.696 20 5 CHBDRO C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000696566162 1123195066 /nfs/dbraw/zinc/19/50/66/1123195066.db2.gz BQRXEZDKKBUUKC-SNVBAGLBSA-N 1 0 286.322 3.927 20 5 CHBDRO C[C@H]([NH2+]CC(C)(C)C(C)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000696568953 1123195281 /nfs/dbraw/zinc/19/52/81/1123195281.db2.gz QWJXTWXLKGULLF-JTQLQIEISA-N 1 0 286.322 3.927 20 5 CHBDRO Cc1ccc(C[N@@H+]([C@@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000508010814 1123254843 /nfs/dbraw/zinc/25/48/43/1123254843.db2.gz ZOSMCHYKQXBWMS-LBPRGKRZSA-N 1 0 274.364 3.666 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1C=CCC1 ZINC000850506422 1123275925 /nfs/dbraw/zinc/27/59/25/1123275925.db2.gz APYGBMQFXDEAJL-OLZOCXBDSA-N 1 0 292.404 3.774 20 5 CHBDRO C[N@H+](CCCF)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000895898451 1123527770 /nfs/dbraw/zinc/52/77/70/1123527770.db2.gz SOHWZRYAUFKZIA-UHFFFAOYSA-N 1 0 292.310 3.646 20 5 CHBDRO CC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccncc1 ZINC000173441066 1123787136 /nfs/dbraw/zinc/78/71/36/1123787136.db2.gz HCTCFVKZDHBPDJ-MLGOLLRUSA-N 1 0 285.347 3.792 20 5 CHBDRO C[C@H](CCc1cccnc1)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000866316122 1124051695 /nfs/dbraw/zinc/05/16/95/1124051695.db2.gz WTXWCATTYGVNIF-ZIAGYGMSSA-N 1 0 299.374 3.662 20 5 CHBDRO CC[C@@H](F)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000440699692 1124078042 /nfs/dbraw/zinc/07/80/42/1124078042.db2.gz UKZBUYFDHYBMRA-CYBMUJFWSA-N 1 0 268.332 3.553 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2ccccc2C1 ZINC000144085764 1124095681 /nfs/dbraw/zinc/09/56/81/1124095681.db2.gz YXZHQEQJPNYHOV-CYBMUJFWSA-N 1 0 282.343 3.714 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000034995985 1124110595 /nfs/dbraw/zinc/11/05/95/1124110595.db2.gz LOZPXKQAHMTCPJ-GFCCVEGCSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccco1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020400 1124657613 /nfs/dbraw/zinc/65/76/13/1124657613.db2.gz HANNUTNKGBXZPU-WDEREUQCSA-N 1 0 292.310 3.609 20 5 CHBDRO CSC(C)(C)C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042210 1124664721 /nfs/dbraw/zinc/66/47/21/1124664721.db2.gz ZNCUYOVTAAVRGX-VIFPVBQESA-N 1 0 286.372 3.526 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(F)(F)CC1 ZINC000449214308 1124670311 /nfs/dbraw/zinc/67/03/11/1124670311.db2.gz YCZAWLHGUBWJOF-LLVKDONJSA-N 1 0 298.333 3.693 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])CC(F)F ZINC000872081066 1124676994 /nfs/dbraw/zinc/67/69/94/1124676994.db2.gz FOBHAUZXTCCGPL-BDAKNGLRSA-N 1 0 290.285 3.676 20 5 CHBDRO C[C@@H]([NH2+]CCCOC(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872084715 1124679831 /nfs/dbraw/zinc/67/98/31/1124679831.db2.gz HTENMNHDMAUPPR-LLVKDONJSA-N 1 0 298.358 3.590 20 5 CHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000872129507 1124690225 /nfs/dbraw/zinc/69/02/25/1124690225.db2.gz FTAKRJOYBMSPTR-QJPTWQEYSA-N 1 0 280.393 3.530 20 5 CHBDRO CS[C@@H]1CC[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000449446812 1124741379 /nfs/dbraw/zinc/74/13/79/1124741379.db2.gz UJXZGWGHKKGQNG-CYBMUJFWSA-N 1 0 294.420 3.656 20 5 CHBDRO CC[C@H]([NH2+]C[C@@H](C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000129918896 1124912481 /nfs/dbraw/zinc/91/24/81/1124912481.db2.gz UGXYSEHFPVBYIX-ABAIWWIYSA-N 1 0 262.353 3.682 20 5 CHBDRO CC[N@H+](Cc1ccncc1)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000877522954 1125039377 /nfs/dbraw/zinc/03/93/77/1125039377.db2.gz GBZMILBNMOPSIJ-UHFFFAOYSA-N 1 0 299.374 3.629 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CC12CCCC2 ZINC000428535135 1125290172 /nfs/dbraw/zinc/29/01/72/1125290172.db2.gz KVWSXTMYIUGYJM-LRFDDAOPSA-N 1 0 286.375 3.920 20 5 CHBDRO C[C@@H](C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])CC(F)F ZINC000697353681 1125306686 /nfs/dbraw/zinc/30/66/86/1125306686.db2.gz ZZNXPLPRIIRNMP-MRVPVSSYSA-N 1 0 292.713 3.629 20 5 CHBDRO C[C@H](C[NH2+][C@@H]1CCCC12CC2)c1ccccc1[N+](=O)[O-] ZINC000897461109 1125424050 /nfs/dbraw/zinc/42/40/50/1125424050.db2.gz LKIQYQLBBLZMBN-IUODEOHRSA-N 1 0 274.364 3.621 20 5 CHBDRO C[C@H](C[NH2+][C@H]1CC[C@@H](C)SC1)c1ccccc1[N+](=O)[O-] ZINC000897461636 1125424184 /nfs/dbraw/zinc/42/41/84/1125424184.db2.gz UIMWOWFRCIIEHO-UPJWGTAASA-N 1 0 294.420 3.572 20 5 CHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774661 1129452082 /nfs/dbraw/zinc/45/20/82/1129452082.db2.gz NQHNAHCIITZFIK-RISCZKNCSA-N 1 0 280.343 3.744 20 5 CHBDRO CC1(C)CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774906 1129452101 /nfs/dbraw/zinc/45/21/01/1129452101.db2.gz AOHLFFIQVFHOPT-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO CC1(C)CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000741804219 1129454974 /nfs/dbraw/zinc/45/49/74/1129454974.db2.gz DJWSMWAANMYGPY-UHFFFAOYSA-N 1 0 280.343 3.746 20 5 CHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000743272039 1129519093 /nfs/dbraw/zinc/51/90/93/1129519093.db2.gz LZWGSLXSQSFTPX-LLVKDONJSA-N 1 0 268.332 3.600 20 5 CHBDRO C[C@H]1CC[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000252894351 1129600606 /nfs/dbraw/zinc/60/06/06/1129600606.db2.gz VBYOTQUHKOSSAV-MJHDQNEOSA-N 1 0 282.771 3.917 20 5 CHBDRO CSC1CCC(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000720566762 1129663018 /nfs/dbraw/zinc/66/30/18/1129663018.db2.gz KLXSCFXVERGRLH-UHFFFAOYSA-N 1 0 294.420 3.606 20 5 CHBDRO CC[N+](C)(C)Cc1ccccc1NCCC1CCC1 ZINC001168889766 1129680464 /nfs/dbraw/zinc/68/04/64/1129680464.db2.gz UVHNPPNELOHDCR-UHFFFAOYSA-N 1 0 261.433 3.885 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc2ccccc2c1 ZINC001168967496 1129687478 /nfs/dbraw/zinc/68/74/78/1129687478.db2.gz QENDDRUNGZJTCV-SUNYJGFJSA-N 1 0 298.386 3.936 20 5 CHBDRO CC(C)(C)[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001168975220 1129688389 /nfs/dbraw/zinc/68/83/89/1129688389.db2.gz UWLXBSWVEUEXDM-FVQBIDKESA-N 1 0 290.407 3.809 20 5 CHBDRO CCC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1 ZINC001169001267 1129688520 /nfs/dbraw/zinc/68/85/20/1129688520.db2.gz FBEDHCMVGMYSBR-VNQPRFMTSA-N 1 0 276.380 3.563 20 5 CHBDRO CC(C)(C)[N@H+](Cc1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169005752 1129689329 /nfs/dbraw/zinc/68/93/29/1129689329.db2.gz CSMCRMXTEJMECB-CVEARBPZSA-N 1 0 290.407 3.733 20 5 CHBDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169012544 1129690117 /nfs/dbraw/zinc/69/01/17/1129690117.db2.gz QXBXTIXSMMUYRF-ZOBUZTSGSA-N 1 0 288.391 3.577 20 5 CHBDRO C[N@H+](Cc1ccc2ccccc2c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046788 1129691165 /nfs/dbraw/zinc/69/11/65/1129691165.db2.gz NANWOJCGYNPXLE-YJBOKZPZSA-N 1 0 298.386 3.717 20 5 CHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001169553391 1129736231 /nfs/dbraw/zinc/73/62/31/1129736231.db2.gz CQVPCFFTDRLEDU-CQSZACIVSA-N 1 0 298.333 3.931 20 5 CHBDRO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC000796524674 1129772649 /nfs/dbraw/zinc/77/26/49/1129772649.db2.gz DFLCBMBAQYFGHD-CYBMUJFWSA-N 1 0 280.343 3.744 20 5 CHBDRO CC[C@@]1(C)CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743860676 1129877927 /nfs/dbraw/zinc/87/79/27/1129877927.db2.gz POPJFUNYLOFZIV-HNNXBMFYSA-N 1 0 280.343 3.746 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)c1 ZINC000800973742 1129901388 /nfs/dbraw/zinc/90/13/88/1129901388.db2.gz SSNIJOGUQFHXSG-UKRRQHHQSA-N 1 0 294.782 3.917 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000769402599 1129906194 /nfs/dbraw/zinc/90/61/94/1129906194.db2.gz MSPOIJXEPIGJLK-UHFFFAOYSA-N 1 0 274.364 3.669 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC12CCC2 ZINC000771464618 1129982996 /nfs/dbraw/zinc/98/29/96/1129982996.db2.gz POZUKPNCCJLQAR-GFCCVEGCSA-N 1 0 292.354 3.746 20 5 CHBDRO CCNc1ccccc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000902634831 1130032898 /nfs/dbraw/zinc/03/28/98/1130032898.db2.gz SRKXYDKQSWKNBK-UHFFFAOYSA-N 1 0 299.374 3.625 20 5 CHBDRO CNc1ccccc1C[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000902672464 1130036486 /nfs/dbraw/zinc/03/64/86/1130036486.db2.gz XKTWRZJYYHMPFR-CYBMUJFWSA-N 1 0 299.374 3.530 20 5 CHBDRO CCO[C@H]1CCC[C@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000903086281 1130110327 /nfs/dbraw/zinc/11/03/27/1130110327.db2.gz FRPXFOOLEKAFMI-RDBSUJKOSA-N 1 0 292.379 3.593 20 5 CHBDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000786930453 1130123971 /nfs/dbraw/zinc/12/39/71/1130123971.db2.gz IZVYEOKXKXIDIR-PELKAZGASA-N 1 0 288.269 3.502 20 5 CHBDRO C[C@@H](C[NH2+][C@H](C)c1nccs1)c1ccccc1[N+](=O)[O-] ZINC000903244935 1130135916 /nfs/dbraw/zinc/13/59/16/1130135916.db2.gz GQAMQUXKKHZNRK-WDEREUQCSA-N 1 0 291.376 3.506 20 5 CHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccoc1)c1ccccc1[N+](=O)[O-] ZINC000903247097 1130136426 /nfs/dbraw/zinc/13/64/26/1130136426.db2.gz YPGMXIPHHMYRSM-RYUDHWBXSA-N 1 0 274.320 3.642 20 5 CHBDRO C[C@H](C[NH2+][C@@H](C)c1ccoc1)c1ccccc1[N+](=O)[O-] ZINC000903247095 1130136491 /nfs/dbraw/zinc/13/64/91/1130136491.db2.gz YPGMXIPHHMYRSM-NEPJUHHUSA-N 1 0 274.320 3.642 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCCc2ncccc21)c1ccc([N+](=O)[O-])cc1 ZINC000903286934 1130146763 /nfs/dbraw/zinc/14/67/63/1130146763.db2.gz JQNYPPLNLDOWKN-PXAZEXFGSA-N 1 0 297.358 3.718 20 5 CHBDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903341523 1130163423 /nfs/dbraw/zinc/16/34/23/1130163423.db2.gz ZFFDDZIKSDPZTA-SJCJKPOMSA-N 1 0 297.358 3.792 20 5 CHBDRO CC(C)=CCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000792185023 1130438339 /nfs/dbraw/zinc/43/83/39/1130438339.db2.gz ZAYWHWDIRCQDLO-UHFFFAOYSA-N 1 0 268.744 3.694 20 5 CHBDRO C[Si](C)(C)C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001170409714 1130491829 /nfs/dbraw/zinc/49/18/29/1130491829.db2.gz BCNYMJWYKNJJIS-AWEZNQCLSA-N 1 0 292.455 3.652 20 5 CHBDRO Cc1cc2ccccc2cc1O[C@@H](C)C[N+](C)(C)C ZINC001234106073 1130609084 /nfs/dbraw/zinc/60/90/84/1130609084.db2.gz NKLTYFGXCIGEPU-AWEZNQCLSA-N 1 0 258.385 3.622 20 5 CHBDRO C[C@H]1C[C@H](C(C)(C)C)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001170785340 1130989973 /nfs/dbraw/zinc/98/99/73/1130989973.db2.gz ZVTRRTXLPCCJTE-GXTWGEPZSA-N 1 0 291.395 3.636 20 5 CHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000799196890 1131075782 /nfs/dbraw/zinc/07/57/82/1131075782.db2.gz ZDHHDDIRPLAPKS-ZFWWWQNUSA-N 1 0 297.358 3.540 20 5 CHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437068 1131563750 /nfs/dbraw/zinc/56/37/50/1131563750.db2.gz SCJROEOKMWIUEV-RISCZKNCSA-N 1 0 296.317 3.777 20 5 CHBDRO Cc1ccc(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)cc1[N+](=O)[O-] ZINC000846108804 1131686722 /nfs/dbraw/zinc/68/67/22/1131686722.db2.gz QUFXBFPRAKQOJD-CQSZACIVSA-N 1 0 296.317 3.524 20 5 CHBDRO Cc1cc(C(C)(C)C)ccc1O[C@H](C)C[N+](C)(C)C ZINC001227674059 1131722730 /nfs/dbraw/zinc/72/27/30/1131722730.db2.gz TUIRFLHFKNOTRS-CQSZACIVSA-N 1 0 264.433 3.766 20 5 CHBDRO CC[C@H](C)c1ccccc1O[C@H](C)C[N+](C)(C)C ZINC001227760425 1131739050 /nfs/dbraw/zinc/73/90/50/1131739050.db2.gz RHXBZBQIHDYSMI-UONOGXRCSA-N 1 0 250.406 3.674 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)Oc1cccc2cc3ccccc3nc21 ZINC001228176994 1131823722 /nfs/dbraw/zinc/82/37/22/1131823722.db2.gz VXCJGPYJGCVKPW-AWEZNQCLSA-N 1 0 295.406 3.862 20 5 CHBDRO Cc1cc(O[C@@H](C)C[N+](C)(C)C)ccc1C(C)C ZINC001228200702 1131828330 /nfs/dbraw/zinc/82/83/30/1131828330.db2.gz IQBVPTKZEWGTJK-AWEZNQCLSA-N 1 0 250.406 3.592 20 5 CHBDRO CC(C)[NH+](CCCNc1ccc([N+](=O)[O-])cc1F)C(C)C ZINC000348166580 1131891511 /nfs/dbraw/zinc/89/15/11/1131891511.db2.gz HAXDNWPHKKZISB-UHFFFAOYSA-N 1 0 297.374 3.655 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC1CCC1)C1CC1 ZINC000773037295 1131925404 /nfs/dbraw/zinc/92/54/04/1131925404.db2.gz SJRSMKQMHKYHIU-INIZCTEOSA-N 1 0 288.391 3.696 20 5 CHBDRO Cc1ccc2cc(O[C@H](C)C[N+](C)(C)C)ccc2c1 ZINC001228738948 1131946222 /nfs/dbraw/zinc/94/62/22/1131946222.db2.gz UJURALRKSNMSGK-CQSZACIVSA-N 1 0 258.385 3.622 20 5 CHBDRO CC(C)[C@@H](C)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000036787257 1131975259 /nfs/dbraw/zinc/97/52/59/1131975259.db2.gz TUBALWQZXQFDBF-SNVBAGLBSA-N 1 0 270.760 3.725 20 5 CHBDRO Cc1c(C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC001171532892 1132043529 /nfs/dbraw/zinc/04/35/29/1132043529.db2.gz MJAWJMTYNUQVMN-BBRMVZONSA-N 1 0 274.364 3.668 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1cc(F)c(C(C)(C)C)c(F)c1 ZINC001231014346 1132242116 /nfs/dbraw/zinc/24/21/16/1132242116.db2.gz DSXCWSLZWPUCGI-LLVKDONJSA-N 1 0 286.386 3.736 20 5 CHBDRO CCCCCC(=O)c1ccc(O[C@@H](C)C[N+](C)(C)C)cc1 ZINC001231259042 1132277214 /nfs/dbraw/zinc/27/72/14/1132277214.db2.gz DNPBMQCUKINSJF-HNNXBMFYSA-N 1 0 292.443 3.923 20 5 CHBDRO CCCC[N@H+](CC)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908017 1132350697 /nfs/dbraw/zinc/35/06/97/1132350697.db2.gz KGCSSXQIYFUTGY-INIZCTEOSA-N 1 0 290.407 3.964 20 5 CHBDRO CC[C@H]1CCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914559 1132360242 /nfs/dbraw/zinc/36/02/42/1132360242.db2.gz HSOCFMNMDUJHPA-HOTGVXAUSA-N 1 0 288.391 3.717 20 5 CHBDRO CC[C@H](C)C[C@@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173218573 1132411413 /nfs/dbraw/zinc/41/14/13/1132411413.db2.gz QQFZUYPQJRSTRN-MJBXVCDLSA-N 1 0 278.396 3.940 20 5 CHBDRO C=Cc1ccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173219053 1132411730 /nfs/dbraw/zinc/41/17/30/1132411730.db2.gz WCUXNDHVBHERFF-AWEZNQCLSA-N 1 0 296.370 3.959 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC12CCCCC2 ZINC001173220605 1132411808 /nfs/dbraw/zinc/41/18/08/1132411808.db2.gz BCTDDWYNAGCUOL-AWEZNQCLSA-N 1 0 288.391 3.934 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC001173226216 1132412380 /nfs/dbraw/zinc/41/23/80/1132412380.db2.gz LJFSCTQPGJUUNC-NWDGAFQWSA-N 1 0 298.333 3.503 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC001173226218 1132412602 /nfs/dbraw/zinc/41/26/02/1132412602.db2.gz LJFSCTQPGJUUNC-RYUDHWBXSA-N 1 0 298.333 3.503 20 5 CHBDRO Cc1cccc2c1C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173224393 1132412878 /nfs/dbraw/zinc/41/28/78/1132412878.db2.gz FHZPESFTUUNTKV-CQSZACIVSA-N 1 0 296.370 3.850 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CCC2)CC1 ZINC001173223071 1132412886 /nfs/dbraw/zinc/41/28/86/1132412886.db2.gz XBWBVFRHSHNNTH-AWEZNQCLSA-N 1 0 288.391 3.792 20 5 CHBDRO CC(C)[C@H]1CCC[N@@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230997 1132413561 /nfs/dbraw/zinc/41/35/61/1132413561.db2.gz IBGJWAJHBUDISM-XJKSGUPXSA-N 1 0 276.380 3.646 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)nc1 ZINC001173235267 1132413805 /nfs/dbraw/zinc/41/38/05/1132413805.db2.gz RYSQDDUREJVSHP-KGLIPLIRSA-N 1 0 299.374 3.580 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1CC(C)(C)C1 ZINC001173230667 1132413848 /nfs/dbraw/zinc/41/38/48/1132413848.db2.gz TXNQTTSOZOVBOW-LBPRGKRZSA-N 1 0 276.380 3.552 20 5 CHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C)[C@@H](C)C1 ZINC001173230491 1132413930 /nfs/dbraw/zinc/41/39/30/1132413930.db2.gz YJKMVHSBWKVOHC-QLFBSQMISA-N 1 0 290.407 3.894 20 5 CHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccn1 ZINC001173229649 1132414080 /nfs/dbraw/zinc/41/40/80/1132414080.db2.gz OPGCNEBKICAMRM-CJNGLKHVSA-N 1 0 299.374 3.662 20 5 CHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@H]1CC1(C)C ZINC001173231262 1132414370 /nfs/dbraw/zinc/41/43/70/1132414370.db2.gz AGJJWIOABFKCSH-GXTWGEPZSA-N 1 0 276.380 3.504 20 5 CHBDRO CCC(CC)C[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173209459 1132416003 /nfs/dbraw/zinc/41/60/03/1132416003.db2.gz CCOASWIKONQGEG-GFCCVEGCSA-N 1 0 264.369 3.552 20 5 CHBDRO Cc1ccnc([C@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173212890 1132416894 /nfs/dbraw/zinc/41/68/94/1132416894.db2.gz CIXKCIOAPSPAHI-KBPBESRZSA-N 1 0 299.374 3.580 20 5 CHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H]2CCC=CCCC2)c1 ZINC001203992888 1133395231 /nfs/dbraw/zinc/39/52/31/1133395231.db2.gz CEJPLEBLMFIYPS-CQSZACIVSA-N 1 0 274.364 3.821 20 5 CHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC001204602153 1133466850 /nfs/dbraw/zinc/46/68/50/1133466850.db2.gz SAGWJKRNRGSHQS-KRWDZBQOSA-N 1 0 288.391 3.976 20 5 CHBDRO O=[N+]([O-])c1ccccc1Nc1c[nH+]ccc1N1CCCCC1 ZINC001206158230 1133665186 /nfs/dbraw/zinc/66/51/86/1133665186.db2.gz SNUYLQNYDYOIRG-UHFFFAOYSA-N 1 0 298.346 3.724 20 5 CHBDRO CC(C)(C)[C@H]1CCC[C@H]1[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC001206248157 1133675968 /nfs/dbraw/zinc/67/59/68/1133675968.db2.gz RTONEEKDSLYHOS-JKSUJKDBSA-N 1 0 290.407 3.942 20 5 CHBDRO C[NH+](C)Cc1cccc(Nc2ccc(F)c([N+](=O)[O-])c2)c1 ZINC001211192663 1134387929 /nfs/dbraw/zinc/38/79/29/1134387929.db2.gz HASIDRBRBCNZCS-UHFFFAOYSA-N 1 0 289.310 3.539 20 5 CHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)c1 ZINC000403451406 1134782157 /nfs/dbraw/zinc/78/21/57/1134782157.db2.gz YHTPOCMDMGVLAS-CKYFFXLPSA-N 1 0 280.755 3.526 20 5 CHBDRO C[NH2+][C@H]1C[C@H](OCc2c3ccccc3nc3ccccc32)C1 ZINC001217762773 1134995130 /nfs/dbraw/zinc/99/51/30/1134995130.db2.gz AKBIFZHBFDHRRT-HDJSIYSDSA-N 1 0 292.382 3.655 20 5 CHBDRO C[C@@H]1C[C@H](Oc2nc3ccccc3c3ccccc32)CC[NH2+]1 ZINC001218056858 1135050917 /nfs/dbraw/zinc/05/09/17/1135050917.db2.gz PQSYBPAKQVGDQX-ZIAGYGMSSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H]1C[C@@H](Oc2nc3ccccc3c3ccccc32)CC[NH2+]1 ZINC001218056842 1135051462 /nfs/dbraw/zinc/05/14/62/1135051462.db2.gz PQSYBPAKQVGDQX-KBPBESRZSA-N 1 0 292.382 3.907 20 5 CHBDRO C[C@H](Oc1c2ccccc2c(O)c2ccccc21)C1C[NH2+]C1 ZINC001218196070 1135067139 /nfs/dbraw/zinc/06/71/39/1135067139.db2.gz TUWJFUZDLNRVRO-LBPRGKRZSA-N 1 0 293.366 3.685 20 5 CHBDRO c1ccc2c(c1)ccc1c2ccnc1O[C@@H]1CCC12C[NH2+]C2 ZINC001218242962 1135072809 /nfs/dbraw/zinc/07/28/09/1135072809.db2.gz VNXCCTKPDSJIGZ-QGZVFWFLSA-N 1 0 290.366 3.519 20 5 CHBDRO C[C@@H]1[NH2+]C[C@H]1Oc1c2ccccc2cc2ccccc21 ZINC001218385563 1135097213 /nfs/dbraw/zinc/09/72/13/1135097213.db2.gz HPTUBWQMTCPCLC-YVEFUNNKSA-N 1 0 263.340 3.732 20 5 CHBDRO Cc1cc(C)c2ccc3cccc(O[C@@H]4C[NH2+][C@H]4C)c3c2n1 ZINC001218388160 1135097627 /nfs/dbraw/zinc/09/76/27/1135097627.db2.gz RQZBPUIRBJXLDR-SUMWQHHRSA-N 1 0 292.382 3.744 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1cccc([N+](=O)[O-])c1 ZINC000316885945 1135170340 /nfs/dbraw/zinc/17/03/40/1135170340.db2.gz VYNDSWCDHTZGTR-BLLLJJGKSA-N 1 0 297.358 3.718 20 5 CHBDRO Cc1cc(C)c(C)c(CO[C@H](C)C[N+](C)(C)C)c1C ZINC001223597749 1135364724 /nfs/dbraw/zinc/36/47/24/1135364724.db2.gz WHOKYDYRCBQROV-CQSZACIVSA-N 1 0 264.433 3.532 20 5 CHBDRO CC(C)=CCC[C@H](C)CCO[C@@H](C)C[N+](C)(C)C ZINC001224709451 1135473314 /nfs/dbraw/zinc/47/33/14/1135473314.db2.gz GKWLFVPAAHQCSI-HOTGVXAUSA-N 1 0 256.454 3.870 20 5 CHBDRO C[C@H](OCC[N+](C)(C)C)c1ccc(Cl)cc1Cl ZINC001224775708 1135481467 /nfs/dbraw/zinc/48/14/67/1135481467.db2.gz NESMHYOHXFGXHG-JTQLQIEISA-N 1 0 277.215 3.777 20 5 CHBDRO C[C@H](C[N+](C)(C)C)OCCCCCc1ccccc1 ZINC001224809455 1135485300 /nfs/dbraw/zinc/48/53/00/1135485300.db2.gz JERBLTDCRSEJNQ-MRXNPFEDSA-N 1 0 264.433 3.511 20 5 CHBDRO C[C@@H](C[N+](C)(C)C)OCCCCCCOc1ccccc1 ZINC001224938154 1135495005 /nfs/dbraw/zinc/49/50/05/1135495005.db2.gz FMIQWSGXJAQUEX-KRWDZBQOSA-N 1 0 294.459 3.737 20 5 CHBDRO C[N@@H+]1CCC[C@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001226992499 1135771877 /nfs/dbraw/zinc/77/18/77/1135771877.db2.gz KVHBWRZRWNGRBS-AWEZNQCLSA-N 1 0 292.382 3.861 20 5 CHBDRO C[C@H](C[N+](C)(C)C)Oc1ccc2ccccc2c1N=O ZINC001227469119 1135837958 /nfs/dbraw/zinc/83/79/58/1135837958.db2.gz RFVWRIDKNFVHAC-GFCCVEGCSA-N 1 0 273.356 3.711 20 5 CHBDRO C[C@@H]1CC[C@@H](C)[NH+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000342071542 130235028 /nfs/dbraw/zinc/23/50/28/130235028.db2.gz NFJYRFYTBYVULO-NXEZZACHSA-N 1 0 268.744 3.621 20 5 CHBDRO Cc1ccc(C[NH2+]Cc2cccc3cc[nH]c32)cc1[N+](=O)[O-] ZINC000342293367 130422297 /nfs/dbraw/zinc/42/22/97/130422297.db2.gz ANTPWCKDOPNZHE-UHFFFAOYSA-N 1 0 295.342 3.674 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccnc2)cc1[N+](=O)[O-] ZINC000020128017 171014506 /nfs/dbraw/zinc/01/45/06/171014506.db2.gz WSWYVZMKQGLVSP-CHWSQXEVSA-N 1 0 285.347 3.710 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C2CCCCC2)cc1[N+](=O)[O-] ZINC000021018606 171290211 /nfs/dbraw/zinc/29/02/11/171290211.db2.gz OOHUIHOWDAFRPP-LBPRGKRZSA-N 1 0 262.353 3.887 20 5 CHBDRO C[C@@H]([NH2+]CCc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000035140920 172007854 /nfs/dbraw/zinc/00/78/54/172007854.db2.gz YACGOKBLETVZNN-GFCCVEGCSA-N 1 0 288.322 3.627 20 5 CHBDRO CSc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000037668342 260115698 /nfs/dbraw/zinc/11/56/98/260115698.db2.gz XZBWNIJGUPTZQH-UHFFFAOYSA-N 1 0 288.372 3.607 20 5 CHBDRO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccs1 ZINC000037562641 260161694 /nfs/dbraw/zinc/16/16/94/260161694.db2.gz JQMIDYONXHVECM-MRVPVSSYSA-N 1 0 268.363 3.569 20 5 CHBDRO C[C@@H]1CCC[C@@H](C[NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000089609122 260189673 /nfs/dbraw/zinc/18/96/73/260189673.db2.gz LNLBKOAWOWCMEC-UKRRQHHQSA-N 1 0 276.380 3.553 20 5 CHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000449096897 260212622 /nfs/dbraw/zinc/21/26/22/260212622.db2.gz KHDUGZGYHPUOKJ-GXTWGEPZSA-N 1 0 264.369 3.550 20 5 CHBDRO CCC[C@@H]([NH2+]CCC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000088454662 260232894 /nfs/dbraw/zinc/23/28/94/260232894.db2.gz OPXVRNVWXSPNGL-OAHLLOKOSA-N 1 0 262.353 3.826 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000449155700 260260797 /nfs/dbraw/zinc/26/07/97/260260797.db2.gz QDQGCYFLJJEXAZ-QWHCGFSZSA-N 1 0 276.380 3.694 20 5 CHBDRO Cc1cc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC000040675948 260349666 /nfs/dbraw/zinc/34/96/66/260349666.db2.gz DZAWLAZWPLVMJQ-GFCCVEGCSA-N 1 0 288.347 3.698 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)c2ccccn2)cccc1[N+](=O)[O-] ZINC000152367370 261063569 /nfs/dbraw/zinc/06/35/69/261063569.db2.gz ISVZQQVBVYSFPF-STQMWFEESA-N 1 0 285.347 3.710 20 5 CHBDRO CC(C)[C@@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000221382783 261825229 /nfs/dbraw/zinc/82/52/29/261825229.db2.gz NBCYCFLCZFZCBI-CABCVRRESA-N 1 0 276.380 3.899 20 5 CHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525784841 262235005 /nfs/dbraw/zinc/23/50/05/262235005.db2.gz XOLCVEQWIZTOIR-AWEZNQCLSA-N 1 0 262.353 3.605 20 5 CHBDRO CC[NH+](CC)CCC[C@H](C)Nc1ccc([N+](=O)[O-])cc1F ZINC000020474761 262239929 /nfs/dbraw/zinc/23/99/29/262239929.db2.gz LUBOLJQRGGFNLN-LBPRGKRZSA-N 1 0 297.374 3.656 20 5 CHBDRO CCC[C@H]([NH2+]C[C@@]1(C)CCCO1)c1cccc([N+](=O)[O-])c1 ZINC000094797514 262468442 /nfs/dbraw/zinc/46/84/42/262468442.db2.gz YECDNJZWJQUDMG-JKSUJKDBSA-N 1 0 292.379 3.595 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H](C)CC(F)(F)F ZINC000414513655 262976719 /nfs/dbraw/zinc/97/67/19/262976719.db2.gz KPUDQJHNOHDYSE-SECBINFHSA-N 1 0 290.285 3.581 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000155811111 263016442 /nfs/dbraw/zinc/01/64/42/263016442.db2.gz WONKOLAWUZWOQD-QWRGUYRKSA-N 1 0 289.310 3.541 20 5 CHBDRO C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1cccc([N+](=O)[O-])c1 ZINC000280756438 263064059 /nfs/dbraw/zinc/06/40/59/263064059.db2.gz CEUCLJYDCWKKHB-WDEREUQCSA-N 1 0 284.306 3.681 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000284047755 263085562 /nfs/dbraw/zinc/08/55/62/263085562.db2.gz KCGOVUWJIZJVNM-NWDGAFQWSA-N 1 0 285.347 3.589 20 5 CHBDRO C[NH+](C)CCSc1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000126809627 264226561 /nfs/dbraw/zinc/22/65/61/264226561.db2.gz UGQBRNZZESCWEN-UHFFFAOYSA-N 1 0 295.191 3.555 20 5 CHBDRO CCC(C)(C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000189992517 264344939 /nfs/dbraw/zinc/34/49/39/264344939.db2.gz SWYCUCHWEKFRMA-NSHDSACASA-N 1 0 250.342 3.682 20 5 CHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000094278233 265232432 /nfs/dbraw/zinc/23/24/32/265232432.db2.gz KFCLJZPRVFVEDQ-AWEZNQCLSA-N 1 0 262.353 3.653 20 5 CHBDRO Cc1ccc(C[NH2+][C@H]2CCCC2(C)C)cc1[N+](=O)[O-] ZINC000094266089 265233903 /nfs/dbraw/zinc/23/39/03/265233903.db2.gz OVQZXOOBPOELRH-AWEZNQCLSA-N 1 0 262.353 3.572 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)CC12CCC2 ZINC000357019727 266233831 /nfs/dbraw/zinc/23/38/31/266233831.db2.gz CSRAAEKVVPFBLV-LLVKDONJSA-N 1 0 280.393 3.668 20 5 CHBDRO C[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000357034049 266236361 /nfs/dbraw/zinc/23/63/61/266236361.db2.gz GYSJCHNXDJFLRX-CYBMUJFWSA-N 1 0 274.364 3.607 20 5 CHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cccnc1 ZINC000358194115 266436904 /nfs/dbraw/zinc/43/69/04/266436904.db2.gz BDXHNNZFVBTSFR-AWEZNQCLSA-N 1 0 299.374 3.663 20 5 CHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)C1 ZINC000359302886 266561796 /nfs/dbraw/zinc/56/17/96/266561796.db2.gz PDALCEXQNIQGRG-CJNGLKHVSA-N 1 0 274.364 3.607 20 5 CHBDRO CC[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C[C@@H](C)OC ZINC000361025654 266771255 /nfs/dbraw/zinc/77/12/55/266771255.db2.gz NWQPSNOVCAYITH-CYBMUJFWSA-N 1 0 294.395 3.575 20 5 CHBDRO Cc1c(C[NH2+][C@@H]2CCCC23CCC3)cccc1[N+](=O)[O-] ZINC000394811390 328011204 /nfs/dbraw/zinc/01/12/04/328011204.db2.gz KPMONIPADYBAAE-OAHLLOKOSA-N 1 0 274.364 3.716 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1c(C)cccc1[N+](=O)[O-] ZINC000100724880 328028533 /nfs/dbraw/zinc/02/85/33/328028533.db2.gz NLJLYULINOFBLZ-CQSZACIVSA-N 1 0 293.411 3.826 20 5 CHBDRO CC1CCC(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000063145597 328034540 /nfs/dbraw/zinc/03/45/40/328034540.db2.gz MXFBKWGTVIMFFF-UHFFFAOYSA-N 1 0 276.380 3.553 20 5 CHBDRO CC(C)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000303586662 328354275 /nfs/dbraw/zinc/35/42/75/328354275.db2.gz GLASITINEIHMBB-HNNXBMFYSA-N 1 0 276.380 3.853 20 5 CHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303681243 328357676 /nfs/dbraw/zinc/35/76/76/328357676.db2.gz JCMLRCIOENVNIA-UNEWFSDZSA-N 1 0 288.391 3.790 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCOC2CCCC2)cc1[N+](=O)[O-] ZINC000111634451 328369792 /nfs/dbraw/zinc/36/97/92/328369792.db2.gz ZCGXNLSCNFNMBV-CYBMUJFWSA-N 1 0 292.379 3.513 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2cccs2)c(Cl)c1 ZINC000049963207 328380104 /nfs/dbraw/zinc/38/01/04/328380104.db2.gz KFAKWFCVFPHNFE-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO CC1(C)CC[C@H]1[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000348304011 328578410 /nfs/dbraw/zinc/57/84/10/328578410.db2.gz NOZZOBZPQRLWFU-LSDHHAIUSA-N 1 0 274.364 3.750 20 5 CHBDRO C[C@@H]([NH2+][C@@H](C)CCC1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000398213972 326875087 /nfs/dbraw/zinc/87/50/87/326875087.db2.gz LACRMCQASZLKJE-NWDGAFQWSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000557462427 327006739 /nfs/dbraw/zinc/00/67/39/327006739.db2.gz AFUYPZCFELLJNN-JKEYDSJLSA-N 1 0 282.343 3.959 20 5 CHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000255758475 327012976 /nfs/dbraw/zinc/01/29/76/327012976.db2.gz YQIOBWYYWZDVJY-PODYEWJSSA-N 1 0 282.343 3.959 20 5 CHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CC[C@@H]2C2CC2)cc1 ZINC000558268928 327084209 /nfs/dbraw/zinc/08/42/09/327084209.db2.gz MYHYJWUYLFSWID-IAGOWNOFSA-N 1 0 288.391 3.696 20 5 CHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1=CCCCC1 ZINC000449377151 327181159 /nfs/dbraw/zinc/18/11/59/327181159.db2.gz RILPZJSWIGZNQO-CYBMUJFWSA-N 1 0 274.364 3.616 20 5 CHBDRO CCC(CC)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000151293188 327548192 /nfs/dbraw/zinc/54/81/92/327548192.db2.gz JLVHEYXMFUKAQY-NSHDSACASA-N 1 0 250.342 3.742 20 5 CHBDRO COc1ccc(C[NH2+][C@H](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000052338186 328641379 /nfs/dbraw/zinc/64/13/79/328641379.db2.gz DSAYZOHUTPYJME-GFCCVEGCSA-N 1 0 292.379 3.662 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCCCC1 ZINC000532442611 328778458 /nfs/dbraw/zinc/77/84/58/328778458.db2.gz VDYHROFHSLFYAQ-LBPRGKRZSA-N 1 0 262.353 3.887 20 5 CHBDRO Cc1cccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1C ZINC000043314291 328787975 /nfs/dbraw/zinc/78/79/75/328787975.db2.gz WXDJXSHYWQSRDQ-UHFFFAOYSA-N 1 0 284.359 3.544 20 5 CHBDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000174352865 329157626 /nfs/dbraw/zinc/15/76/26/329157626.db2.gz KSQKMLOTRUSIDM-KBPBESRZSA-N 1 0 294.420 3.701 20 5 CHBDRO CCO[C@@H](CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000178661209 329201965 /nfs/dbraw/zinc/20/19/65/329201965.db2.gz VVFXMRQNTKLIRX-CJNGLKHVSA-N 1 0 294.395 3.697 20 5 CHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCC1(C)C ZINC000583106309 329312511 /nfs/dbraw/zinc/31/25/11/329312511.db2.gz HWBPDZSHIUKCSP-RZXPCSSPSA-N 1 0 274.364 3.776 20 5 CHBDRO CCCC[C@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000572401872 330061217 /nfs/dbraw/zinc/06/12/17/330061217.db2.gz LUKYOTJGURAYTD-LBPRGKRZSA-N 1 0 289.379 3.787 20 5 CHBDRO CC(C)[C@H]1CC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000445428458 330216128 /nfs/dbraw/zinc/21/61/28/330216128.db2.gz WJGOQIDUDYUYKD-OCCSQVGLSA-N 1 0 262.353 3.634 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(C2CC2)CC1 ZINC000536833819 330229720 /nfs/dbraw/zinc/22/97/20/330229720.db2.gz PBAHNACFAAGQGQ-GFCCVEGCSA-N 1 0 274.364 3.744 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@H](C)CC(C)C)cccc1[N+](=O)[O-] ZINC000536838633 330231867 /nfs/dbraw/zinc/23/18/67/330231867.db2.gz LYYVCLLLRLJPFC-YPMHNXCESA-N 1 0 264.369 3.988 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000424316807 330339532 /nfs/dbraw/zinc/33/95/32/330339532.db2.gz BLCUNNZZGWDKOC-TUKIKUTGSA-N 1 0 274.364 3.742 20 5 CHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC23CCCC3)cccc1[N+](=O)[O-] ZINC000429433674 330546449 /nfs/dbraw/zinc/54/64/49/330546449.db2.gz WEJWWUDXRYSRGR-SWLSCSKDSA-N 1 0 274.364 3.887 20 5 CHBDRO C[C@H]([NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C1CC1 ZINC000433145187 330618093 /nfs/dbraw/zinc/61/80/93/330618093.db2.gz FVJWLCMYYWPASW-ZUZCIYMTSA-N 1 0 274.364 3.705 20 5 CHBDRO CC(C)C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000441431893 330768347 /nfs/dbraw/zinc/76/83/47/330768347.db2.gz CQZDSZFXDLOCFI-UHFFFAOYSA-N 1 0 280.343 3.602 20 5 CHBDRO CC[C@@H]([NH2+][C@@H]1CCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000336812843 330840737 /nfs/dbraw/zinc/84/07/37/330840737.db2.gz SILHQICNXJTRQQ-ZIAGYGMSSA-N 1 0 262.353 3.824 20 5 CHBDRO Cc1cscc1C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449288659 330912098 /nfs/dbraw/zinc/91/20/98/330912098.db2.gz NRPQDGYPVLRSIQ-GFCCVEGCSA-N 1 0 290.388 3.686 20 5 CHBDRO CC[C@@H]1CCC[N@@H+]1C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470173824 331034346 /nfs/dbraw/zinc/03/43/46/331034346.db2.gz GCONPAXSKGHBMN-VSKPTYQZSA-N 1 0 274.364 3.873 20 5 CHBDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000452037511 331051421 /nfs/dbraw/zinc/05/14/21/331051421.db2.gz VBARJEALLIPJNU-APHBMKBZSA-N 1 0 292.379 3.593 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+]C2CC(C)(F)C2)cc1[N+](=O)[O-] ZINC000453242729 331106361 /nfs/dbraw/zinc/10/63/61/331106361.db2.gz WMSOFTSPANPKCE-VLRKGOCCSA-N 1 0 296.342 3.535 20 5 CHBDRO CC/C=C/C[NH2+][C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000453316817 331115713 /nfs/dbraw/zinc/11/57/13/331115713.db2.gz JZWZHORPMMYCAL-NNNHXZLVSA-N 1 0 278.352 3.610 20 5 CHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000453368789 331123634 /nfs/dbraw/zinc/12/36/34/331123634.db2.gz PIQDTMBIKAOUFC-CQDKDKBSSA-N 1 0 274.364 3.600 20 5 CHBDRO CC[C@H]([NH2+]CCc1ccc(C)cn1)c1cccc([N+](=O)[O-])c1 ZINC000453427153 331131143 /nfs/dbraw/zinc/13/11/43/331131143.db2.gz OOVDQEHQVJAOSI-KRWDZBQOSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1CCC(C(F)F)CC1 ZINC000459713986 331295407 /nfs/dbraw/zinc/29/54/07/331295407.db2.gz OSKJNMQBESEWEN-UHFFFAOYSA-N 1 0 298.333 3.817 20 5 CHBDRO C[C@H]([NH2+]C1(C2CCC2)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000459779863 331300627 /nfs/dbraw/zinc/30/06/27/331300627.db2.gz VBNZXTJBTNTYNV-LBPRGKRZSA-N 1 0 274.364 3.968 20 5 CHBDRO COc1cc(C[N@@H+]2CCCCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000464676494 331364611 /nfs/dbraw/zinc/36/46/11/331364611.db2.gz HQTTYMWQFSYHGG-NSHDSACASA-N 1 0 296.342 3.507 20 5 CHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1cc(Cl)cs1 ZINC000467999263 331426468 /nfs/dbraw/zinc/42/64/68/331426468.db2.gz YXRDZDKXOAROHA-UHFFFAOYSA-N 1 0 296.779 3.642 20 5 CHBDRO CCC(CC)(CC)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000471238940 331504537 /nfs/dbraw/zinc/50/45/37/331504537.db2.gz XZFIKFXYFAMTGS-UHFFFAOYSA-N 1 0 280.368 3.532 20 5 CHBDRO Cc1c(C[NH2+][C@H]2CCC[C@@H]2CCCF)cccc1[N+](=O)[O-] ZINC000510995239 332923383 /nfs/dbraw/zinc/92/33/83/332923383.db2.gz QXICSXNQKYPVIO-HIFRSBDPSA-N 1 0 294.370 3.911 20 5 CHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000481185837 331800461 /nfs/dbraw/zinc/80/04/61/331800461.db2.gz FLQIULXFETZTBM-KGLIPLIRSA-N 1 0 292.379 3.662 20 5 CHBDRO CC(C)C1CC([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000488493280 332013590 /nfs/dbraw/zinc/01/35/90/332013590.db2.gz UHOILXSHOPGGLW-UHFFFAOYSA-N 1 0 296.798 3.815 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@H]1C ZINC000501902429 332642647 /nfs/dbraw/zinc/64/26/47/332642647.db2.gz WHRGCKHGWHRXEZ-TYNCELHUSA-N 1 0 262.353 3.742 20 5 CHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000503938127 332699876 /nfs/dbraw/zinc/69/98/76/332699876.db2.gz RDOOSGAUKGQOOP-OBJOEFQTSA-N 1 0 292.379 3.833 20 5 CHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000178655871 333076584 /nfs/dbraw/zinc/07/65/84/333076584.db2.gz YQIOBWYYWZDVJY-GPAKFWEMSA-N 1 0 282.343 3.959 20 5 CHBDRO CC(C)CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000312259310 333079122 /nfs/dbraw/zinc/07/91/22/333079122.db2.gz DQLFOKWWESVAON-OAHLLOKOSA-N 1 0 276.380 3.899 20 5 CHBDRO CCC(CC)[N@H+](CC)Cc1cc([N+](=O)[O-])ccc1OC ZINC000516891022 333085542 /nfs/dbraw/zinc/08/55/42/333085542.db2.gz ZWLBGILTFUFJDK-UHFFFAOYSA-N 1 0 280.368 3.614 20 5 CHBDRO CCC(CC)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000517122590 333093000 /nfs/dbraw/zinc/09/30/00/333093000.db2.gz VNRJLQZOVZDUPQ-UHFFFAOYSA-N 1 0 262.353 3.748 20 5 CHBDRO CCC[C@H]([NH2+][C@@H]1CCOC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000336894095 335122792 /nfs/dbraw/zinc/12/27/92/335122792.db2.gz LMKXCVYACRWSHX-LSDHHAIUSA-N 1 0 292.379 3.593 20 5 CHBDRO CCC[C@@H]([NH2+]CCCCCOC)c1cccc([N+](=O)[O-])c1 ZINC000222978835 333202958 /nfs/dbraw/zinc/20/29/58/333202958.db2.gz JVRJTMHMLBQACC-MRXNPFEDSA-N 1 0 294.395 3.842 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCSC[C@H](C)C1 ZINC000190425442 333206917 /nfs/dbraw/zinc/20/69/17/333206917.db2.gz AEEIOIUADBJOLX-YPMHNXCESA-N 1 0 294.420 3.649 20 5 CHBDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000226183096 333253372 /nfs/dbraw/zinc/25/33/72/333253372.db2.gz CRBNQPYOPZOHTD-MBNYWOFBSA-N 1 0 292.379 3.518 20 5 CHBDRO Cc1ccc(F)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000227284193 333279520 /nfs/dbraw/zinc/27/95/20/333279520.db2.gz KDNAFKYULJEHPN-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000522418963 333286711 /nfs/dbraw/zinc/28/67/11/333286711.db2.gz VZDSXMYEIIKKTH-WMLDXEAASA-N 1 0 296.370 3.973 20 5 CHBDRO CCC1(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CCC1 ZINC000227762803 333288333 /nfs/dbraw/zinc/28/83/33/333288333.db2.gz UWHQBKIOWFUOQY-UHFFFAOYSA-N 1 0 262.353 3.573 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCC2=CCCC2)c(Cl)c1 ZINC000230146560 333314785 /nfs/dbraw/zinc/31/47/85/333314785.db2.gz RKKAVRQICGROBN-UHFFFAOYSA-N 1 0 280.755 3.838 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CC[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000230407425 333317433 /nfs/dbraw/zinc/31/74/33/333317433.db2.gz PPAJKYDFROFXBF-UPJWGTAASA-N 1 0 262.353 3.682 20 5 CHBDRO C[C@@H]([NH2+]C[C@H]1CC[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000230409366 333317975 /nfs/dbraw/zinc/31/79/75/333317975.db2.gz YYWXVBBEJXWATM-UPJWGTAASA-N 1 0 262.353 3.682 20 5 CHBDRO Cc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1C ZINC000231884450 333331236 /nfs/dbraw/zinc/33/12/36/333331236.db2.gz FFTNXUNMWIFSTA-UHFFFAOYSA-N 1 0 284.359 3.810 20 5 CHBDRO Cc1c(C[NH2+]C/C=C/c2ccccc2)cccc1[N+](=O)[O-] ZINC000231885819 333331334 /nfs/dbraw/zinc/33/13/34/333331334.db2.gz JFFJSXNVJZQBFV-RMKNXTFCSA-N 1 0 282.343 3.706 20 5 CHBDRO CC(C)(C)CC(C)(C)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000524435514 333362391 /nfs/dbraw/zinc/36/23/91/333362391.db2.gz ZLLJSCNVQPEHNV-UHFFFAOYSA-N 1 0 294.395 3.778 20 5 CHBDRO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000235299607 333367420 /nfs/dbraw/zinc/36/74/20/333367420.db2.gz ISNSWPUMMXHSKQ-RISCZKNCSA-N 1 0 262.353 3.509 20 5 CHBDRO CC(C)[C@H]1N(Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000576010857 335141345 /nfs/dbraw/zinc/14/13/45/335141345.db2.gz RBPQDXWWHXSIHN-GFCCVEGCSA-N 1 0 268.382 3.523 20 5 CHBDRO CCc1ccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)o1 ZINC000123323240 333455903 /nfs/dbraw/zinc/45/59/03/333455903.db2.gz LPOFRTNGOFBURL-GFCCVEGCSA-N 1 0 288.347 3.644 20 5 CHBDRO C[C@H]([NH2+]CCc1ccccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000037176907 333507746 /nfs/dbraw/zinc/50/77/46/333507746.db2.gz HACKUDKWBFROIA-LBPRGKRZSA-N 1 0 288.322 3.627 20 5 CHBDRO CC(C)C[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000037260425 333525948 /nfs/dbraw/zinc/52/59/48/333525948.db2.gz DOLRANKKZGZLRZ-NWDGAFQWSA-N 1 0 250.342 3.680 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000540156521 333714594 /nfs/dbraw/zinc/71/45/94/333714594.db2.gz RQTUBYYFLSNIFF-CQSZACIVSA-N 1 0 284.359 3.797 20 5 CHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCC1 ZINC000540168263 333716889 /nfs/dbraw/zinc/71/68/89/333716889.db2.gz HDPWBMOQMBAQMT-LLVKDONJSA-N 1 0 280.393 3.608 20 5 CHBDRO Cc1c([C@@H](C)[NH2+]CCC(C)(C)C)cccc1[N+](=O)[O-] ZINC000540194195 333720251 /nfs/dbraw/zinc/72/02/51/333720251.db2.gz FGHHPCWPXMXRLG-GFCCVEGCSA-N 1 0 264.369 3.990 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(C)(C)C)cc1[N+](=O)[O-] ZINC000129612185 333782148 /nfs/dbraw/zinc/78/21/48/333782148.db2.gz BMZNZQLAUAHPKW-GFCCVEGCSA-N 1 0 264.369 3.990 20 5 CHBDRO Cc1cccc(C(C)(C)[NH2+]Cc2cccc([N+](=O)[O-])c2)c1 ZINC000130447753 333842882 /nfs/dbraw/zinc/84/28/82/333842882.db2.gz VMBVFDIXJPCWSV-UHFFFAOYSA-N 1 0 284.359 3.928 20 5 CHBDRO CSCCCC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000131497418 333944310 /nfs/dbraw/zinc/94/43/10/333944310.db2.gz QFZTZVGLVGFYDW-LBPRGKRZSA-N 1 0 282.409 3.697 20 5 CHBDRO CC[C@@H]([NH2+]CCCCSC)c1cccc([N+](=O)[O-])c1 ZINC000131514593 333945520 /nfs/dbraw/zinc/94/55/20/333945520.db2.gz XNBILHQSTXDRFN-CQSZACIVSA-N 1 0 282.409 3.779 20 5 CHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccccc3)CCC2)cc1 ZINC000073260123 333969848 /nfs/dbraw/zinc/96/98/48/333969848.db2.gz BIWDGKHAHCBYJE-UHFFFAOYSA-N 1 0 282.343 3.764 20 5 CHBDRO CC(C)[C@H](C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000081045316 334177312 /nfs/dbraw/zinc/17/73/12/334177312.db2.gz HJAGBRYJAQUXJA-VXGBXAGGSA-N 1 0 250.342 3.538 20 5 CHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1CC(C(C)(C)C)C1 ZINC000549861062 334207198 /nfs/dbraw/zinc/20/71/98/334207198.db2.gz OTIGQEWRVXXNPY-UHFFFAOYSA-N 1 0 276.380 3.818 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H](c1ccccc1)C1CC1 ZINC000552060443 334282967 /nfs/dbraw/zinc/28/29/67/334282967.db2.gz VRVQNHGZZCQCCD-KRWDZBQOSA-N 1 0 296.370 3.878 20 5 CHBDRO C[C@@H]1CC[C@H]1[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000552323678 334317019 /nfs/dbraw/zinc/31/70/19/334317019.db2.gz OQOPALRJXUZZDF-VCTAVGKDSA-N 1 0 274.364 3.705 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCS[C@H](C)CC1 ZINC000249014160 334324555 /nfs/dbraw/zinc/32/45/55/334324555.db2.gz JXUUGIIWKZZXEB-OLZOCXBDSA-N 1 0 294.420 3.792 20 5 CHBDRO Cc1c([C@H](C)[NH2+]C2C[C@@H](C)O[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000090965658 334370336 /nfs/dbraw/zinc/37/03/36/334370336.db2.gz NEMQKOXEYWOOIC-WZRBSPASSA-N 1 0 292.379 3.510 20 5 CHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000251922466 334372068 /nfs/dbraw/zinc/37/20/68/334372068.db2.gz USLCYRYVAJCDAL-BZPMIXESSA-N 1 0 262.353 3.509 20 5 CHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC[C@@H]1C(C)(C)C ZINC000565060750 334537106 /nfs/dbraw/zinc/53/71/06/334537106.db2.gz MAKADKVYVZSSLO-KBPBESRZSA-N 1 0 292.379 3.518 20 5 CHBDRO CO[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C(C)(C)C ZINC000154944966 334708604 /nfs/dbraw/zinc/70/86/04/334708604.db2.gz ZWLPXJIVNAJMJZ-DOMZBBRYSA-N 1 0 294.395 3.615 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]CCCC2CC2)cc1[N+](=O)[O-] ZINC000163346816 334867070 /nfs/dbraw/zinc/86/70/70/334867070.db2.gz UJGLCFRIWQKTDG-GFCCVEGCSA-N 1 0 262.353 3.744 20 5 CHBDRO CC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000382081955 336081458 /nfs/dbraw/zinc/08/14/58/336081458.db2.gz FOKGVJRRMCTOIM-OAHLLOKOSA-N 1 0 290.388 3.940 20 5 CHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H](C1CC1)C1CCC1 ZINC000581677111 336127229 /nfs/dbraw/zinc/12/72/29/336127229.db2.gz QUHWKCHOIKWAHG-NVXWUHKLSA-N 1 0 286.375 3.750 20 5 CHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1c(F)cccc1[N+](=O)[O-] ZINC000385104348 336138455 /nfs/dbraw/zinc/13/84/55/336138455.db2.gz QICMGGLPNSYABP-GFCCVEGCSA-N 1 0 297.374 3.656 20 5 CHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCC1CC[NH2+]CC1 ZINC000581820442 336147252 /nfs/dbraw/zinc/14/72/52/336147252.db2.gz GKYMKTBJRXILCD-GFCCVEGCSA-N 1 0 294.420 3.697 20 5 CHBDRO CC(C)(C)CC[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000581852296 336151704 /nfs/dbraw/zinc/15/17/04/336151704.db2.gz ZYMNSDRMRVBFEZ-UHFFFAOYSA-N 1 0 289.379 3.644 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000385653638 336153505 /nfs/dbraw/zinc/15/35/05/336153505.db2.gz CYYAUZAJCVKPEG-INIZCTEOSA-N 1 0 288.322 3.975 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CC23CCCC3)cc1[N+](=O)[O-] ZINC000387101041 336185160 /nfs/dbraw/zinc/18/51/60/336185160.db2.gz HGQPYUPNLFIQKP-DOMZBBRYSA-N 1 0 274.364 3.887 20 5 CHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353878476 533733433 /nfs/dbraw/zinc/73/34/33/533733433.db2.gz DEXKCVKVDVTXOY-GHMZBOCLSA-N 1 0 268.382 3.667 20 5 CHBDRO CCO[C@H](CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000155684367 520512485 /nfs/dbraw/zinc/51/24/85/520512485.db2.gz SCJNNRDUZSLQHO-CZUORRHYSA-N 1 0 294.395 3.697 20 5 CHBDRO CC1(C)C[C@H]([NH2+]C2CC(F)(F)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279173500 520553115 /nfs/dbraw/zinc/55/31/15/520553115.db2.gz UYFVQOZBBOYQOW-ZDUSSCGKSA-N 1 0 296.317 3.705 20 5 CHBDRO CCC[C@@H](C)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000337258565 520648703 /nfs/dbraw/zinc/64/87/03/520648703.db2.gz VBOODONNESFOSH-CYBMUJFWSA-N 1 0 292.379 3.627 20 5 CHBDRO CCC[N@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000127520480 521502216 /nfs/dbraw/zinc/50/22/16/521502216.db2.gz VWBNCUFVZAWVHL-UHFFFAOYSA-N 1 0 291.376 3.560 20 5 CHBDRO CC[C@H]([NH2+]Cc1ccsc1)c1cccc([N+](=O)[O-])c1 ZINC000063152252 522658407 /nfs/dbraw/zinc/65/84/07/522658407.db2.gz XGBHPVYIXNAOCS-AWEZNQCLSA-N 1 0 276.361 3.897 20 5 CHBDRO CC[C@@H]([NH2+]C1(C(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000340480442 522807574 /nfs/dbraw/zinc/80/75/74/522807574.db2.gz ZGHFHKSZRRDQIZ-CQSZACIVSA-N 1 0 262.353 3.824 20 5 CHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000037668299 522877232 /nfs/dbraw/zinc/87/72/32/522877232.db2.gz WUDNVGOJONRIHZ-MRXNPFEDSA-N 1 0 288.322 3.975 20 5 CHBDRO CC[C@H](c1ccncc1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000130244995 522966489 /nfs/dbraw/zinc/96/64/89/522966489.db2.gz PATVBNBOSAEXMD-QGZVFWFLSA-N 1 0 299.374 3.615 20 5 CHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000339919921 524390078 /nfs/dbraw/zinc/39/00/78/524390078.db2.gz DSCAZKPFLONZNO-PWSUYJOCSA-N 1 0 268.382 3.667 20 5 CHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000070160260 524595229 /nfs/dbraw/zinc/59/52/29/524595229.db2.gz HPQJDSZWESAIMP-LBPRGKRZSA-N 1 0 288.322 3.893 20 5 CHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000037775713 524604018 /nfs/dbraw/zinc/60/40/18/524604018.db2.gz SRNAIXXSMMPJSW-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1cccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000037668422 524875921 /nfs/dbraw/zinc/87/59/21/524875921.db2.gz YKYQEJONNWCDKQ-ZDUSSCGKSA-N 1 0 270.332 3.754 20 5 CHBDRO C[C@H]([NH2+]CCCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000098005691 525331191 /nfs/dbraw/zinc/33/11/91/525331191.db2.gz XFSCMRSVTOFFQL-VIFPVBQESA-N 1 0 276.258 3.588 20 5 CHBDRO C[C@H]([NH2+][C@@H](C)C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000054080629 525522939 /nfs/dbraw/zinc/52/29/39/525522939.db2.gz QVLCLRNKQWUJDU-RYUDHWBXSA-N 1 0 262.353 3.824 20 5 CHBDRO C[C@@H]([NH2+][C@H]1CCC12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000282212291 525674089 /nfs/dbraw/zinc/67/40/89/525674089.db2.gz OMBMHJCGDZMTEQ-RISCZKNCSA-N 1 0 260.337 3.578 20 5 CHBDRO Cc1ccncc1CCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000289266957 525733720 /nfs/dbraw/zinc/73/37/20/525733720.db2.gz NCLROSALROWLPI-AWEZNQCLSA-N 1 0 299.374 3.582 20 5 CHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccsc2)cc1[N+](=O)[O-] ZINC000063152313 525737461 /nfs/dbraw/zinc/73/74/61/525737461.db2.gz HCAKBUZIOWPVJY-LLVKDONJSA-N 1 0 276.361 3.816 20 5 CHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)C[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000156754377 525902767 /nfs/dbraw/zinc/90/27/67/525902767.db2.gz LCHOYVUTLIICGA-BNOWGMLFSA-N 1 0 292.379 3.511 20 5 CHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289647976 526118303 /nfs/dbraw/zinc/11/83/03/526118303.db2.gz DPNWYLLAMMMXHU-WDEREUQCSA-N 1 0 284.306 3.633 20 5 CHBDRO Cc1nc(C)c([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])s1 ZINC000042273863 526755149 /nfs/dbraw/zinc/75/51/49/526755149.db2.gz LLTIBAKWZMSMCX-VIFPVBQESA-N 1 0 291.376 3.519 20 5 CHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C1CC(c2ccccc2)C1 ZINC000050015577 527400331 /nfs/dbraw/zinc/40/03/31/527400331.db2.gz JBYMQVZAFYJKTL-UHFFFAOYSA-N 1 0 282.343 3.631 20 5 CHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccccn1 ZINC000347382319 527500276 /nfs/dbraw/zinc/50/02/76/527500276.db2.gz UYVHGUYXPAFLBP-UVTDQMKNSA-N 1 0 297.358 3.525 20 5 CHBDRO CC(C)c1ccc(C[NH2+]CC2(C)CC2)cc1[N+](=O)[O-] ZINC000344688140 528100666 /nfs/dbraw/zinc/10/06/66/528100666.db2.gz DHZSNDITJBGVBM-UHFFFAOYSA-N 1 0 262.353 3.608 20 5 CHBDRO CCS[C@H]1CCCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000353584112 529225491 /nfs/dbraw/zinc/22/54/91/529225491.db2.gz FACQWLHKDUCVDV-HNNXBMFYSA-N 1 0 294.420 3.702 20 5 CHBDRO