smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542003454 1121012009 /nfs/dbraw/zinc/01/20/09/1121012009.db2.gz YDWBENZPLTZNPU-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO CC1CCC([N@@H+](Cc2cccnc2[N+](=O)[O-])C2CC2)CC1 ZINC000885958685 1125630541 /nfs/dbraw/zinc/63/05/41/1125630541.db2.gz JOHGEPCLSINQSA-UHFFFAOYSA-N 1 1 289.379 3.533 20 5 CHBDMO Cc1coc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000886010603 1125636852 /nfs/dbraw/zinc/63/68/52/1125636852.db2.gz LURBIRKIFZHUBG-LBPRGKRZSA-N 1 1 274.320 3.655 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCc3c2cccc3F)cs1 ZINC000886364319 1125672463 /nfs/dbraw/zinc/67/24/63/1125672463.db2.gz WDULWDKNUFOBDN-CYBMUJFWSA-N 1 1 292.335 3.573 20 5 CHBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000159723563 1126751531 /nfs/dbraw/zinc/75/15/31/1126751531.db2.gz PGVCRDFOLJPGKR-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1cncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000189805435 1126935365 /nfs/dbraw/zinc/93/53/65/1126935365.db2.gz NYTBPRBPWMIEFD-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000487967777 1127051253 /nfs/dbraw/zinc/05/12/53/1127051253.db2.gz DETYEFKYJSLLEO-FRRDWIJNSA-N 1 1 262.353 3.634 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccnc1 ZINC000270552635 1127057707 /nfs/dbraw/zinc/05/77/07/1127057707.db2.gz BRIKLTGVUIJAFR-ZDUSSCGKSA-N 1 1 285.347 3.573 20 5 CHBDMO C[C@@H]([NH2+]Cc1cnc(Cl)s1)c1ccccc1[N+](=O)[O-] ZINC000271694518 1127096810 /nfs/dbraw/zinc/09/68/10/1127096810.db2.gz FWTCHFZVFBXFKB-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2ccsc2C1 ZINC000349963819 1127168876 /nfs/dbraw/zinc/16/88/76/1127168876.db2.gz JRRWIXABVJDOOJ-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@H]1C1CC1 ZINC000589517711 1127225838 /nfs/dbraw/zinc/22/58/38/1127225838.db2.gz ZQBRREGNYKMNIJ-AWEZNQCLSA-N 1 1 294.782 3.869 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@H]1C1CC1 ZINC000589517711 1127225839 /nfs/dbraw/zinc/22/58/39/1127225839.db2.gz ZQBRREGNYKMNIJ-AWEZNQCLSA-N 1 1 294.782 3.869 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC1(C)CCCC1 ZINC001308712700 1127434702 /nfs/dbraw/zinc/43/47/02/1127434702.db2.gz QVWDZLXFMNTTEW-UHFFFAOYSA-N 1 1 276.380 3.649 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC2CC=CC2)C2CC2)cc1 ZINC000595405218 1127461851 /nfs/dbraw/zinc/46/18/51/1127461851.db2.gz VUDUKQIABFDACA-UHFFFAOYSA-N 1 1 272.348 3.525 20 5 CHBDMO Cc1noc(C[N@H+]2CCC(C)(C)CC(C)(C)C2)c1[N+](=O)[O-] ZINC000595747684 1127475309 /nfs/dbraw/zinc/47/53/09/1127475309.db2.gz BWKRTOBTHCCZJX-UHFFFAOYSA-N 1 1 295.383 3.539 20 5 CHBDMO Cc1c(C[N@H+](CC(C)C)C(C)C)cccc1[N+](=O)[O-] ZINC000060857082 1127607692 /nfs/dbraw/zinc/60/76/92/1127607692.db2.gz IITRVNMYFBVHOS-UHFFFAOYSA-N 1 1 264.369 3.770 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC12CCCC2 ZINC000593646402 1127647437 /nfs/dbraw/zinc/64/74/37/1127647437.db2.gz WGZRJSAFSJMHFK-ALCCZGGFSA-N 1 1 272.348 3.627 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1cccs1 ZINC000603847835 1127676085 /nfs/dbraw/zinc/67/60/85/1127676085.db2.gz ZOGBHRQRDWWURN-UHFFFAOYSA-N 1 1 290.388 3.721 20 5 CHBDMO CC1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000061799065 1127718384 /nfs/dbraw/zinc/71/83/84/1127718384.db2.gz ADHVQKJQSYNGSZ-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2CCC2(C)C)cc1[N+](=O)[O-] ZINC000539835791 1127946520 /nfs/dbraw/zinc/94/65/20/1127946520.db2.gz VUESTZQSZSIENC-UHFFFAOYSA-N 1 1 262.353 3.703 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C1Cc2ccccc2C1 ZINC000544609135 1127978520 /nfs/dbraw/zinc/97/85/20/1127978520.db2.gz FRLCZECJWDPJTH-UHFFFAOYSA-N 1 1 296.370 3.502 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)CC1 ZINC000468148320 1127994454 /nfs/dbraw/zinc/99/44/54/1127994454.db2.gz VJCCREBXFCUBJF-STQMWFEESA-N 1 1 262.353 3.778 20 5 CHBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000468409055 1128007892 /nfs/dbraw/zinc/00/78/92/1128007892.db2.gz RGYCBMFHTNKNCU-CYBMUJFWSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](C)CC1(C)C ZINC000541771856 1128038563 /nfs/dbraw/zinc/03/85/63/1128038563.db2.gz RWMASAPNIZTRPO-LLVKDONJSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@H]1c2ccccc2OCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000609145517 1128050891 /nfs/dbraw/zinc/05/08/91/1128050891.db2.gz HFVWQHUMQLBODE-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000609145517 1128050896 /nfs/dbraw/zinc/05/08/96/1128050896.db2.gz HFVWQHUMQLBODE-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H](C)C(C)C ZINC000470169059 1128064302 /nfs/dbraw/zinc/06/43/02/1128064302.db2.gz BCJHJOKMTWWYTF-KADHNRKRSA-N 1 1 276.380 3.974 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H](C)C1CC1 ZINC000470176946 1128064833 /nfs/dbraw/zinc/06/48/33/1128064833.db2.gz ZFZILGASWFLYQI-KIWPFMIBSA-N 1 1 274.364 3.728 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](C)C1 ZINC000470175902 1128065499 /nfs/dbraw/zinc/06/54/99/1128065499.db2.gz TUGRBAIGFWBRIG-GFAPJHNFSA-N 1 1 274.364 3.730 20 5 CHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000471022908 1128085228 /nfs/dbraw/zinc/08/52/28/1128085228.db2.gz QRSIAWROHQMFIE-KDOFPFPSSA-N 1 1 296.370 3.830 20 5 CHBDMO CCOc1cc(C[N@H+]2[C@@H](C)CC[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492603723 1128105978 /nfs/dbraw/zinc/10/59/78/1128105978.db2.gz CGQNTPDDSIPKTK-JSGCOSHPSA-N 1 1 292.379 3.756 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1Cl ZINC000761510150 1128132318 /nfs/dbraw/zinc/13/23/18/1128132318.db2.gz DSFLXQNLKFODEV-BETUJISGSA-N 1 1 294.782 3.870 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CCC1 ZINC000761510113 1128132455 /nfs/dbraw/zinc/13/24/55/1128132455.db2.gz CVOXXRDWOMCBBR-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493333130 1128138428 /nfs/dbraw/zinc/13/84/28/1128138428.db2.gz FDFYXFKACJATAB-CYBMUJFWSA-N 1 1 282.771 3.869 20 5 CHBDMO CCCC[C@@H](C)[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000562059281 1128375062 /nfs/dbraw/zinc/37/50/62/1128375062.db2.gz YDQBFHJXEDPYEM-SNVBAGLBSA-N 1 1 286.322 3.884 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000562059281 1128375065 /nfs/dbraw/zinc/37/50/65/1128375065.db2.gz YDQBFHJXEDPYEM-SNVBAGLBSA-N 1 1 286.322 3.884 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCCc2occc2C1 ZINC000568564686 1128587930 /nfs/dbraw/zinc/58/79/30/1128587930.db2.gz HCUSFBNTPPPFOX-UTCJRWHESA-N 1 1 298.342 3.649 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCc2occc2C1 ZINC000568564686 1128587934 /nfs/dbraw/zinc/58/79/34/1128587934.db2.gz HCUSFBNTPPPFOX-UTCJRWHESA-N 1 1 298.342 3.649 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCCc2sccc2C1 ZINC000609323470 1128701721 /nfs/dbraw/zinc/70/17/21/1128701721.db2.gz QCIJJPAKTPINSR-UHFFFAOYSA-N 1 1 288.372 3.605 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705056 1128722883 /nfs/dbraw/zinc/72/28/83/1128722883.db2.gz LPPYOOYNJYTCGX-JTQLQIEISA-N 1 1 270.760 3.726 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000072555222 1117762507 /nfs/dbraw/zinc/76/25/07/1117762507.db2.gz RVBHUEBHNYAHFJ-CYBMUJFWSA-N 1 1 270.332 3.788 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1cncs1 ZINC000934194506 1118961308 /nfs/dbraw/zinc/96/13/08/1118961308.db2.gz GDJOPQYTADSBKO-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccoc1)c1ccccc1[N+](=O)[O-] ZINC000539297342 1118991438 /nfs/dbraw/zinc/99/14/38/1118991438.db2.gz RFRRTENBJIGJHJ-WDEREUQCSA-N 1 1 260.293 3.600 20 5 CHBDMO C[N@H+](C/C=C\c1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511135432 1119094082 /nfs/dbraw/zinc/09/40/82/1119094082.db2.gz GIRHJMWCPTYRNY-YFHOEESVSA-N 1 1 296.370 3.783 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000435772599 1119485479 /nfs/dbraw/zinc/48/54/79/1119485479.db2.gz QGIHJHPYHGGXNZ-DANOYGIBSA-N 1 1 297.358 3.773 20 5 CHBDMO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000169130235 1119495734 /nfs/dbraw/zinc/49/57/34/1119495734.db2.gz GLNDZFNKWHEGNZ-OAHLLOKOSA-N 1 1 288.322 3.975 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cccs1 ZINC000066562545 1119913154 /nfs/dbraw/zinc/91/31/54/1119913154.db2.gz PWRDPMZXGYGBEN-LLVKDONJSA-N 1 1 276.361 3.849 20 5 CHBDMO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1CC1 ZINC000122924686 1120054142 /nfs/dbraw/zinc/05/41/42/1120054142.db2.gz GBOCEABAXDLVQQ-UHFFFAOYSA-N 1 1 286.331 3.697 20 5 CHBDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000091437163 1120172033 /nfs/dbraw/zinc/17/20/33/1120172033.db2.gz DAAHKBFQOMWELW-NXEZZACHSA-N 1 1 289.335 3.611 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000103466175 1120252664 /nfs/dbraw/zinc/25/26/64/1120252664.db2.gz BRIVNSHUEUSSNC-UHFFFAOYSA-N 1 1 274.364 3.544 20 5 CHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]21 ZINC000542974917 1120305296 /nfs/dbraw/zinc/30/52/96/1120305296.db2.gz FWFFUPCSSBJMNE-XOKHGSTOSA-N 1 1 288.391 3.648 20 5 CHBDMO CSCC[C@@H](C)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255173092 1120340423 /nfs/dbraw/zinc/34/04/23/1120340423.db2.gz JBKZEONLYGMVAS-FWPCIQOSSA-N 1 1 294.420 3.681 20 5 CHBDMO Cc1nsc(C)c1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000566415380 1120401928 /nfs/dbraw/zinc/40/19/28/1120401928.db2.gz DAFSZDWUOIJPPZ-VIFPVBQESA-N 1 1 291.376 3.519 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000154469778 1120547085 /nfs/dbraw/zinc/54/70/85/1120547085.db2.gz CZPLQEQOLDUBIJ-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO COc1ccc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000111158782 1120747519 /nfs/dbraw/zinc/74/75/19/1120747519.db2.gz RDWGSHXXUINQER-JTQLQIEISA-N 1 1 292.360 3.516 20 5 CHBDMO C[N@H+]1CCCC[C@@H]1CCSc1ccc([N+](=O)[O-])cc1F ZINC000585732540 1121022231 /nfs/dbraw/zinc/02/22/31/1121022231.db2.gz SSMPMHUHPNPPHS-LLVKDONJSA-N 1 1 298.383 3.700 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@@H]1CC1(C)C ZINC001174908301 1121086917 /nfs/dbraw/zinc/08/69/17/1121086917.db2.gz ZAACLRWAYGBKJU-STQMWFEESA-N 1 1 276.380 3.942 20 5 CHBDMO C/C=C\C[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001175043989 1121157166 /nfs/dbraw/zinc/15/71/66/1121157166.db2.gz AYAJJOMMZZCGOK-RXYHWBRQSA-N 1 1 288.391 3.816 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)cs1 ZINC000246168628 1121281752 /nfs/dbraw/zinc/28/17/52/1121281752.db2.gz RLCOAYAAQJYDRG-VXGBXAGGSA-N 1 1 298.433 3.516 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCS[C@@H]3CCCC[C@H]32)cs1 ZINC000246168628 1121281754 /nfs/dbraw/zinc/28/17/54/1121281754.db2.gz RLCOAYAAQJYDRG-VXGBXAGGSA-N 1 1 298.433 3.516 20 5 CHBDMO CC[C@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000509535927 1121388047 /nfs/dbraw/zinc/38/80/47/1121388047.db2.gz AEDVNCQHEJFENM-PIZKADEWSA-N 1 1 274.364 3.730 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2C2CC2)ccc1Cl ZINC000706685039 1121434568 /nfs/dbraw/zinc/43/45/68/1121434568.db2.gz PBMMDCXTXADJEV-ZDUSSCGKSA-N 1 1 280.755 3.623 20 5 CHBDMO C[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@H]1C ZINC000512647833 1121507339 /nfs/dbraw/zinc/50/73/39/1121507339.db2.gz HTGBOAZWEOWWIW-CHOOUNKSSA-N 1 1 274.364 3.728 20 5 CHBDMO C[C@@H]1CC2(CCC2)C[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000433020745 1121520401 /nfs/dbraw/zinc/52/04/01/1121520401.db2.gz DIVYSIPSQKBRST-BTKRWWFXSA-N 1 1 286.375 3.873 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000509377978 1121559444 /nfs/dbraw/zinc/55/94/44/1121559444.db2.gz GZKWOTGRBCCWCN-FNOHHLHBSA-N 1 1 262.353 3.586 20 5 CHBDMO COc1ccc(C[N@@H+](C)C[C@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000619843971 1129015092 /nfs/dbraw/zinc/01/50/92/1129015092.db2.gz JUPIXWYWVKOXTE-LBPRGKRZSA-N 1 1 294.395 3.717 20 5 CHBDMO COc1ccc(C[N@@H+](C)C[C@@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000619843970 1129015111 /nfs/dbraw/zinc/01/51/11/1129015111.db2.gz JUPIXWYWVKOXTE-GFCCVEGCSA-N 1 1 294.395 3.717 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CC[C@H](C)C1 ZINC000429591128 1122143059 /nfs/dbraw/zinc/14/30/59/1122143059.db2.gz QQQSEONJPUQIDO-JSGCOSHPSA-N 1 1 292.379 3.614 20 5 CHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000505605134 1122434945 /nfs/dbraw/zinc/43/49/45/1122434945.db2.gz GDCZOMLDKNLAKD-QPJJXVBHSA-N 1 1 288.372 3.802 20 5 CHBDMO Cc1ccc(C[N@H+]2CC3(CCC3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000515260953 1122487277 /nfs/dbraw/zinc/48/72/77/1122487277.db2.gz YPPQNCCWVACLPJ-MRXNPFEDSA-N 1 1 286.375 3.668 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)CCC[C@@H]1C ZINC001191070299 1122568500 /nfs/dbraw/zinc/56/85/00/1122568500.db2.gz KCQGVHJGDCZCOV-OLZOCXBDSA-N 1 1 292.379 3.614 20 5 CHBDMO CCCCOCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000516296714 1122585170 /nfs/dbraw/zinc/58/51/70/1122585170.db2.gz ZMYWBDIFVRZVLP-UHFFFAOYSA-N 1 1 294.395 3.622 20 5 CHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1cc(F)cc(F)c1 ZINC000507115710 1122622090 /nfs/dbraw/zinc/62/20/90/1122622090.db2.gz LDLIURUMLTWVPS-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1cc(F)cc(F)c1 ZINC000507115710 1122622091 /nfs/dbraw/zinc/62/20/91/1122622091.db2.gz LDLIURUMLTWVPS-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC=C(C)C1 ZINC000437351112 1122629607 /nfs/dbraw/zinc/62/96/07/1122629607.db2.gz YQOJDGUGSWURLR-ZROIWOOFSA-N 1 1 272.348 3.650 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@H]1C ZINC001193413272 1122690540 /nfs/dbraw/zinc/69/05/40/1122690540.db2.gz MJIUBKZDGMADSN-CJNGLKHVSA-N 1 1 276.380 3.995 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CCCC3)C2)cc1 ZINC000438362714 1122694441 /nfs/dbraw/zinc/69/44/41/1122694441.db2.gz IGBVJMNEKJBWNJ-UHFFFAOYSA-N 1 1 274.364 3.751 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC1CC(C)(C)C1 ZINC001193743756 1122712125 /nfs/dbraw/zinc/71/21/25/1122712125.db2.gz TWWGOSPIICQNEA-UHFFFAOYSA-N 1 1 276.380 3.505 20 5 CHBDMO CC[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(C)C ZINC000506356364 1122724622 /nfs/dbraw/zinc/72/46/22/1122724622.db2.gz OEHFJTQSLGUDIN-UHFFFAOYSA-N 1 1 264.369 3.949 20 5 CHBDMO CSCCC[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000439472200 1122782585 /nfs/dbraw/zinc/78/25/85/1122782585.db2.gz RMZCURCGQVIUHM-GFCCVEGCSA-N 1 1 282.409 3.649 20 5 CHBDMO Cc1cccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)c1C ZINC001194615102 1122788500 /nfs/dbraw/zinc/78/85/00/1122788500.db2.gz BHISWZYZQUQOKD-UHFFFAOYSA-N 1 1 298.386 3.886 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001195808817 1122890964 /nfs/dbraw/zinc/89/09/64/1122890964.db2.gz CTNOQHCNJUICHA-AWEZNQCLSA-N 1 1 296.370 3.757 20 5 CHBDMO Cc1ccc(F)c(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000507158427 1122930533 /nfs/dbraw/zinc/93/05/33/1122930533.db2.gz DXNWTWRXXQRTCN-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccc(F)c(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000507158427 1122930535 /nfs/dbraw/zinc/93/05/35/1122930535.db2.gz DXNWTWRXXQRTCN-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1cccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1C ZINC000507152241 1122934030 /nfs/dbraw/zinc/93/40/30/1122934030.db2.gz QRSLGGAJXUYWEE-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO CCCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000507189807 1122937799 /nfs/dbraw/zinc/93/77/99/1122937799.db2.gz CAALWRIXAYRCST-SOFGYWHQSA-N 1 1 274.364 3.873 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507227184 1122941756 /nfs/dbraw/zinc/94/17/56/1122941756.db2.gz DNXCDEOHKKKZBO-XOVSCCBYSA-N 1 1 262.353 3.584 20 5 CHBDMO Cc1sccc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507242512 1122942539 /nfs/dbraw/zinc/94/25/39/1122942539.db2.gz GKLBBPVJZRDGKY-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO Cc1sccc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507242512 1122942541 /nfs/dbraw/zinc/94/25/41/1122942541.db2.gz GKLBBPVJZRDGKY-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO C[C@H](c1ccncc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183715039 1129089863 /nfs/dbraw/zinc/08/98/63/1129089863.db2.gz OZYXHTYTCBKHLD-HZRUHFOJSA-N 1 1 297.358 3.696 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](C3CCCC3)C2)c1 ZINC001198706124 1123008953 /nfs/dbraw/zinc/00/89/53/1123008953.db2.gz OJTBEGGSPXFGHV-INIZCTEOSA-N 1 1 288.391 3.997 20 5 CHBDMO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351754501 1123278914 /nfs/dbraw/zinc/27/89/14/1123278914.db2.gz FRXQLPMBGAREBR-ZJUUUORDSA-N 1 1 284.306 3.636 20 5 CHBDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351754501 1123278917 /nfs/dbraw/zinc/27/89/17/1123278917.db2.gz FRXQLPMBGAREBR-ZJUUUORDSA-N 1 1 284.306 3.636 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000544611784 1123377945 /nfs/dbraw/zinc/37/79/45/1123377945.db2.gz JQWMETQZWWHCJH-KRWDZBQOSA-N 1 1 296.370 3.893 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000522713141 1123719486 /nfs/dbraw/zinc/71/94/86/1123719486.db2.gz SFZLONBKFORBTH-CYBMUJFWSA-N 1 1 292.379 3.616 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCC2(CCC2)C1 ZINC000475269056 1123832890 /nfs/dbraw/zinc/83/28/90/1123832890.db2.gz JYBVTSWXMWRCSL-CLTKARDFSA-N 1 1 286.375 3.874 20 5 CHBDMO CC(C)(C)c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000865814299 1124016084 /nfs/dbraw/zinc/01/60/84/1124016084.db2.gz IIGSNAAFHCUBEC-UHFFFAOYSA-N 1 1 288.347 3.775 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC1(C)C ZINC000525124836 1124115701 /nfs/dbraw/zinc/11/57/01/1124115701.db2.gz IHLOQNHLSCDOQU-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000446737377 1124121273 /nfs/dbraw/zinc/12/12/73/1124121273.db2.gz VCQVMJXFHTURLP-LLVKDONJSA-N 1 1 282.771 3.726 20 5 CHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000525637137 1124451527 /nfs/dbraw/zinc/45/15/27/1124451527.db2.gz ZVKMQFGYLFLHPB-STQMWFEESA-N 1 1 262.353 3.605 20 5 CHBDMO CC1(C)CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000525639696 1124452768 /nfs/dbraw/zinc/45/27/68/1124452768.db2.gz WKVCLICHQWKZTH-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC(C)(C)C1 ZINC000525973328 1124482692 /nfs/dbraw/zinc/48/26/92/1124482692.db2.gz LOVRVVPOJMBMMR-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000525996632 1124488426 /nfs/dbraw/zinc/48/84/26/1124488426.db2.gz QGZSUOFPXURLRH-TXEJJXNPSA-N 1 1 286.331 3.838 20 5 CHBDMO Cc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])s1 ZINC000872025402 1124659007 /nfs/dbraw/zinc/65/90/07/1124659007.db2.gz MCKWFQVOFFJLDX-SNVBAGLBSA-N 1 1 294.351 3.955 20 5 CHBDMO CC[C@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C(F)F ZINC000449360120 1124712647 /nfs/dbraw/zinc/71/26/47/1124712647.db2.gz IWCQPUCDLBNTIZ-JQWIXIFHSA-N 1 1 286.322 3.549 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC(C)(CC(F)F)C1 ZINC000877605765 1125052015 /nfs/dbraw/zinc/05/20/15/1125052015.db2.gz HXKDGNRIUSLOBY-UHFFFAOYSA-N 1 1 298.333 3.689 20 5 CHBDMO Cc1ccsc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000051233388 1125351309 /nfs/dbraw/zinc/35/13/09/1125351309.db2.gz OKYCJQHBAHNDMD-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000212970180 1125357237 /nfs/dbraw/zinc/35/72/37/1125357237.db2.gz IRYMPEBZKSADFE-CYBMUJFWSA-N 1 1 280.343 3.889 20 5 CHBDMO CC[N@@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774521 1129451977 /nfs/dbraw/zinc/45/19/77/1129451977.db2.gz KKYSSBGPCWLGBI-UHFFFAOYSA-N 1 1 294.351 3.818 20 5 CHBDMO Cc1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(C)o1 ZINC000743477610 1129527064 /nfs/dbraw/zinc/52/70/64/1129527064.db2.gz SUIKBJKKBYHZAF-LLVKDONJSA-N 1 1 274.320 3.655 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(CCCC2)C1 ZINC000743864082 1129541694 /nfs/dbraw/zinc/54/16/94/1129541694.db2.gz UUNZZWYYAHSVCW-ZDUSSCGKSA-N 1 1 274.364 3.922 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC2(CCCC2)C1 ZINC000743864069 1129542024 /nfs/dbraw/zinc/54/20/24/1129542024.db2.gz IBHKRVIDJLXQBF-CYBMUJFWSA-N 1 1 274.364 3.922 20 5 CHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCC[C@H]2c2ccccc2)C1 ZINC001169006019 1129689417 /nfs/dbraw/zinc/68/94/17/1129689417.db2.gz FIPBYULVNOJYAP-OIISXLGYSA-N 1 1 288.391 3.659 20 5 CHBDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001461846991 1130060088 /nfs/dbraw/zinc/06/00/88/1130060088.db2.gz CXLYGYBDLRBHCU-WDEREUQCSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746666078 1130142751 /nfs/dbraw/zinc/14/27/51/1130142751.db2.gz IJMUDUJTCZQUBZ-GFCCVEGCSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437070 1131563716 /nfs/dbraw/zinc/56/37/16/1131563716.db2.gz SCJROEOKMWIUEV-SMDDNHRTSA-N 1 1 296.317 3.777 20 5 CHBDMO CC[N@H+]1CC[C@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001227764357 1131739567 /nfs/dbraw/zinc/73/95/67/1131739567.db2.gz NSQOLWSGTUIROC-INIZCTEOSA-N 1 1 292.382 3.861 20 5 CHBDMO CC[N@H+]1CC[C@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001228176773 1131823400 /nfs/dbraw/zinc/82/34/00/1131823400.db2.gz RMBHEBNKBPEYAQ-INIZCTEOSA-N 1 1 292.382 3.861 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC2(CCC2)C1 ZINC000348177023 1131901048 /nfs/dbraw/zinc/90/10/48/1131901048.db2.gz GUIPKYRGGFSZFD-ZDUSSCGKSA-N 1 1 274.364 3.922 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036790524 1131974833 /nfs/dbraw/zinc/97/48/33/1131974833.db2.gz KVOCMIHSZWOMDX-SNVBAGLBSA-N 1 1 270.760 3.869 20 5 CHBDMO CC[N@@H+](C(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907668 1132349891 /nfs/dbraw/zinc/34/98/91/1132349891.db2.gz HJYJRKQRVLEAOK-OAHLLOKOSA-N 1 1 276.380 3.573 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H](C)C1 ZINC001173226058 1132412204 /nfs/dbraw/zinc/41/22/04/1132412204.db2.gz KXAXSWUDWPDTLK-ZIAGYGMSSA-N 1 1 276.380 3.648 20 5 CHBDMO CCCC[N@@H+](CC)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225420 1132412924 /nfs/dbraw/zinc/41/29/24/1132412924.db2.gz JWHFLLGLFPQPJW-ZDUSSCGKSA-N 1 1 264.369 3.648 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccs1 ZINC001173225914 1132412995 /nfs/dbraw/zinc/41/29/95/1132412995.db2.gz GRHPBRPBTCKDCS-LBPRGKRZSA-N 1 1 290.388 3.719 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccccc1 ZINC001173229890 1132413687 /nfs/dbraw/zinc/41/36/87/1132413687.db2.gz WBCABZYIBKESJG-OAHLLOKOSA-N 1 1 298.386 3.700 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)[C@@H](C)C1 ZINC001173230482 1132413760 /nfs/dbraw/zinc/41/37/60/1132413760.db2.gz YJKMVHSBWKVOHC-ILXRZTDVSA-N 1 1 290.407 3.894 20 5 CHBDMO c1cnc2c(c1)ccc1ccc(C[N@H+]3CCC[C@@H]4C[C@@H]43)nc12 ZINC001232222342 1132438951 /nfs/dbraw/zinc/43/89/51/1132438951.db2.gz AYBYNTOJBQWMLG-WBVHZDCISA-N 1 1 289.382 3.767 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCSCC[C@@H]1C ZINC001205405597 1133574117 /nfs/dbraw/zinc/57/41/17/1133574117.db2.gz KWMOUQYOJHPBIE-LBPRGKRZSA-N 1 1 294.420 3.539 20 5 CHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001205489670 1133582627 /nfs/dbraw/zinc/58/26/27/1133582627.db2.gz WVLZQHRUDVDPMW-DOMZBBRYSA-N 1 1 276.380 3.832 20 5 CHBDMO Cc1c(C[N@H+]2C[C@H](C3CC3)[C@@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001205875832 1133625107 /nfs/dbraw/zinc/62/51/07/1133625107.db2.gz PNHOAPBNFIKFGD-WBVHZDCISA-N 1 1 286.375 3.524 20 5 CHBDMO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000035010708 171928395 /nfs/dbraw/zinc/92/83/95/171928395.db2.gz HYWZBHMIDYGULB-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccco2)cc1[N+](=O)[O-] ZINC000035738642 172392487 /nfs/dbraw/zinc/39/24/87/172392487.db2.gz ZCEOUOYASHCEBI-NEPJUHHUSA-N 1 1 274.320 3.908 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000080266572 260179192 /nfs/dbraw/zinc/17/91/92/260179192.db2.gz LVOGURVSNGLRHA-QWRGUYRKSA-N 1 1 291.376 3.772 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000357022467 266233005 /nfs/dbraw/zinc/23/30/05/266233005.db2.gz JUVWEABDGAAESX-ZDUSSCGKSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@H](c1ccco1)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119175662 267305274 /nfs/dbraw/zinc/30/52/74/267305274.db2.gz SXCVLETWJLWMNR-GFCCVEGCSA-N 1 1 286.331 3.913 20 5 CHBDMO C[C@H](c1ccco1)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119175662 267305276 /nfs/dbraw/zinc/30/52/76/267305276.db2.gz SXCVLETWJLWMNR-GFCCVEGCSA-N 1 1 286.331 3.913 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000531562284 328017941 /nfs/dbraw/zinc/01/79/41/328017941.db2.gz KNYUGZYLZAECHD-ZDUSSCGKSA-N 1 1 262.353 3.607 20 5 CHBDMO CCC1CCC([N@@H+](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000514094489 328302957 /nfs/dbraw/zinc/30/29/57/328302957.db2.gz NKSYFPPRIPIYDI-UHFFFAOYSA-N 1 1 276.380 3.995 20 5 CHBDMO CC(C)c1ccc(C[NH2+]Cc2ccco2)cc1[N+](=O)[O-] ZINC000061002473 328515628 /nfs/dbraw/zinc/51/56/28/328515628.db2.gz ZXUOGDUKIJRKMD-UHFFFAOYSA-N 1 1 274.320 3.601 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000558738967 327118205 /nfs/dbraw/zinc/11/82/05/327118205.db2.gz AJXFZPDKGUKBPA-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO CCC(CC)C[N@@H+](CC)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000559066833 327139518 /nfs/dbraw/zinc/13/95/18/327139518.db2.gz BROKACYVLRAZBB-UHFFFAOYSA-N 1 1 294.395 3.862 20 5 CHBDMO CC(C)[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000163317357 327171216 /nfs/dbraw/zinc/17/12/16/327171216.db2.gz RRRMVVZKDRTZNL-UHFFFAOYSA-N 1 1 268.744 3.621 20 5 CHBDMO CC(C)[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000163317357 327171218 /nfs/dbraw/zinc/17/12/18/327171218.db2.gz RRRMVVZKDRTZNL-UHFFFAOYSA-N 1 1 268.744 3.621 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000559418268 327244506 /nfs/dbraw/zinc/24/45/06/327244506.db2.gz PQXHUHAVCRLIRI-OCCSQVGLSA-N 1 1 274.364 3.778 20 5 CHBDMO CC(C)[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC1CC1 ZINC000533358635 330359408 /nfs/dbraw/zinc/35/94/08/330359408.db2.gz HVKACGLPIUFBOA-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO CSCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451542893 331033167 /nfs/dbraw/zinc/03/31/67/331033167.db2.gz AQJKKBSAYBWYKK-CQSZACIVSA-N 1 1 294.420 3.527 20 5 CHBDMO CCC[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000464743415 331365751 /nfs/dbraw/zinc/36/57/51/331365751.db2.gz YJGBKONLDFYXLW-DZGCQCFKSA-N 1 1 276.380 3.995 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000489138707 332042460 /nfs/dbraw/zinc/04/24/60/332042460.db2.gz ULBISHZYXHPDNF-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000489138707 332042461 /nfs/dbraw/zinc/04/24/61/332042461.db2.gz ULBISHZYXHPDNF-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C)[C@@H]1C ZINC000490067357 332079920 /nfs/dbraw/zinc/07/99/20/332079920.db2.gz MGHMCNSXHMFOMY-WXHSDQCUSA-N 1 1 262.353 3.695 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490087506 332080952 /nfs/dbraw/zinc/08/09/52/332080952.db2.gz JETSUOFGPUVACL-ZDUSSCGKSA-N 1 1 292.379 3.616 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000521222495 333115637 /nfs/dbraw/zinc/11/56/37/333115637.db2.gz CJSUMKLDHKBXPV-UHFFFAOYSA-N 1 1 284.359 3.925 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCS[C@@H](C)CC1 ZINC000192181663 333231793 /nfs/dbraw/zinc/23/17/93/333231793.db2.gz JXUUGIIWKZZXEB-QWHCGFSZSA-N 1 1 294.420 3.792 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCS[C@@H](C)CC1 ZINC000192181670 333231949 /nfs/dbraw/zinc/23/19/49/333231949.db2.gz JXUUGIIWKZZXEB-STQMWFEESA-N 1 1 294.420 3.792 20 5 CHBDMO C[N@@H+](Cc1cc2ccccc2o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000195676236 333260523 /nfs/dbraw/zinc/26/05/23/333260523.db2.gz NGVOLMOMWCXACW-UHFFFAOYSA-N 1 1 296.326 3.973 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522554081 333289776 /nfs/dbraw/zinc/28/97/76/333289776.db2.gz GLTNRTHBGSJTEJ-GFCCVEGCSA-N 1 1 268.744 3.623 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000523552901 333332809 /nfs/dbraw/zinc/33/28/09/333332809.db2.gz BVIWSGFJBOYOAU-CQSZACIVSA-N 1 1 262.353 3.749 20 5 CHBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000576021258 335142375 /nfs/dbraw/zinc/14/23/75/335142375.db2.gz WSYYFIBKHHIYAU-VEXXYJEVSA-N 1 1 274.364 3.871 20 5 CHBDMO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000037775676 333539354 /nfs/dbraw/zinc/53/93/54/333539354.db2.gz NYQZEJGEHWCCPV-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO CC(C)=CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135237472 334120679 /nfs/dbraw/zinc/12/06/79/334120679.db2.gz BPOKPPYVZWMQQQ-UHFFFAOYSA-N 1 1 260.337 3.525 20 5 CHBDMO CC(C)=CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135237472 334120680 /nfs/dbraw/zinc/12/06/80/334120680.db2.gz BPOKPPYVZWMQQQ-UHFFFAOYSA-N 1 1 260.337 3.525 20 5 CHBDMO CC(C)[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC1CC1 ZINC000548623251 334164133 /nfs/dbraw/zinc/16/41/33/334164133.db2.gz LDHHLJRCDRTKSB-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)s1 ZINC000549407662 334193021 /nfs/dbraw/zinc/19/30/21/334193021.db2.gz HTYWQBHQDZJRPM-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000550442916 334222523 /nfs/dbraw/zinc/22/25/23/334222523.db2.gz BTUXODZBHCEPIJ-HZPDHXFCSA-N 1 1 288.391 3.648 20 5 CHBDMO C[C@@H]([N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000552081123 334286900 /nfs/dbraw/zinc/28/69/00/334286900.db2.gz DXNPLIMMCGYUEM-SECBINFHSA-N 1 1 286.322 3.739 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000552081123 334286901 /nfs/dbraw/zinc/28/69/01/334286901.db2.gz DXNPLIMMCGYUEM-SECBINFHSA-N 1 1 286.322 3.739 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1ccoc1 ZINC000351978738 534347094 /nfs/dbraw/zinc/34/70/94/534347094.db2.gz YZHKFIWIIHFIIZ-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1ccoc1 ZINC000351978738 534347099 /nfs/dbraw/zinc/34/70/99/534347099.db2.gz YZHKFIWIIHFIIZ-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289687888 526078871 /nfs/dbraw/zinc/07/88/71/526078871.db2.gz GUMNJFRGMQRDEA-MNOVXSKESA-N 1 1 284.306 3.633 20 5 CHBDMO Cc1csc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)n1 ZINC000126242467 526360831 /nfs/dbraw/zinc/36/08/31/526360831.db2.gz KWOOTJUWTKZGSS-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccncc1 ZINC000347376667 527500017 /nfs/dbraw/zinc/50/00/17/527500017.db2.gz OKFPIONJGQNEHD-UVTDQMKNSA-N 1 1 297.358 3.525 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCC(F)(F)F ZINC000072981264 1121129599 /nfs/dbraw/zinc/12/95/99/1121129599.db2.gz YJPMEPMXJBVMOH-SECBINFHSA-N 1 1 276.258 3.540 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCC(F)(F)F ZINC000072981264 1121129600 /nfs/dbraw/zinc/12/96/00/1121129600.db2.gz YJPMEPMXJBVMOH-SECBINFHSA-N 1 1 276.258 3.540 20 5 CHBDMO C[C@]1(c2ccccc2)CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886318077 1125668144 /nfs/dbraw/zinc/66/81/44/1125668144.db2.gz IXJYHLAWUQDRQY-QGZVFWFLSA-N 1 1 297.358 3.501 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(N)c1 ZINC000261649899 1125735279 /nfs/dbraw/zinc/73/52/79/1125735279.db2.gz HMNALDKEKSYYTH-UHFFFAOYSA-N 1 1 299.374 3.588 20 5 CHBDMO CC1=C(c2ccco2)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000338338163 1126735047 /nfs/dbraw/zinc/73/50/47/1126735047.db2.gz AVXLJQLSLXZMOX-UHFFFAOYSA-N 1 1 298.342 3.867 20 5 CHBDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000159889577 1126756450 /nfs/dbraw/zinc/75/64/50/1126756450.db2.gz GKFPWTPTGJZANX-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000159889577 1126756451 /nfs/dbraw/zinc/75/64/51/1126756451.db2.gz GKFPWTPTGJZANX-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO CC[N@@H+](CC1CCC1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000483131825 1126769551 /nfs/dbraw/zinc/76/95/51/1126769551.db2.gz RZXQNUSINSFEIT-GFCCVEGCSA-N 1 1 262.353 3.778 20 5 CHBDMO CCCC[N@@H+](CC)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000485143557 1126889988 /nfs/dbraw/zinc/88/99/88/1126889988.db2.gz JKDDKSCGSQYZIE-GFCCVEGCSA-N 1 1 250.342 3.778 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](C)c1cccnc1 ZINC000270623883 1127058737 /nfs/dbraw/zinc/05/87/37/1127058737.db2.gz DVDUEKRRFSXHGT-CYBMUJFWSA-N 1 1 285.347 3.573 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000054993497 1127146909 /nfs/dbraw/zinc/14/69/09/1127146909.db2.gz SBRFAEADJJJXDL-INIZCTEOSA-N 1 1 282.343 3.932 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000571807023 1127178616 /nfs/dbraw/zinc/17/86/16/1127178616.db2.gz VPGAROZHPYLZQZ-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000588978209 1127209463 /nfs/dbraw/zinc/20/94/63/1127209463.db2.gz PWHWELTWPIZTBN-GFCCVEGCSA-N 1 1 294.782 3.870 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000589209373 1127216311 /nfs/dbraw/zinc/21/63/11/1127216311.db2.gz IZSDTPAKBZIXLF-HNNXBMFYSA-N 1 1 274.364 3.525 20 5 CHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353896223 1127276715 /nfs/dbraw/zinc/27/67/15/1127276715.db2.gz HBRMQERBLZRUJP-LBPRGKRZSA-N 1 1 268.382 3.667 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC2(CCC2)C1 ZINC000355207102 1127325108 /nfs/dbraw/zinc/32/51/08/1127325108.db2.gz XKLDGAAQFHYDBY-UHFFFAOYSA-N 1 1 274.364 3.669 20 5 CHBDMO CC(C)O[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000593056119 1127369971 /nfs/dbraw/zinc/36/99/71/1127369971.db2.gz YHKSOAUMOWQJOS-UONOGXRCSA-N 1 1 292.379 3.545 20 5 CHBDMO CCC[C@@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000595406753 1127461964 /nfs/dbraw/zinc/46/19/64/1127461964.db2.gz BRYMMJICWKMZJG-CYBMUJFWSA-N 1 1 289.335 3.522 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595565278 1127465470 /nfs/dbraw/zinc/46/54/70/1127465470.db2.gz DRMAXKZQSZXAHX-OBJOEFQTSA-N 1 1 260.337 3.530 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595562815 1127465643 /nfs/dbraw/zinc/46/56/43/1127465643.db2.gz RCDXIWCSHGBELC-ZLDLUXBVSA-N 1 1 260.337 3.530 20 5 CHBDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000362187306 1127617838 /nfs/dbraw/zinc/61/78/38/1127617838.db2.gz DBZJOXICYSYMHD-PWSUYJOCSA-N 1 1 296.342 3.505 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]12 ZINC000603662030 1127664896 /nfs/dbraw/zinc/66/48/96/1127664896.db2.gz BDADJFSWWDQPBG-XYPHTWIQSA-N 1 1 288.391 3.995 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC2CC(F)(F)C2)C2CC2)cc1 ZINC000296370071 1127670026 /nfs/dbraw/zinc/67/00/26/1127670026.db2.gz SQRZDSFZKXJFQP-UHFFFAOYSA-N 1 1 296.317 3.605 20 5 CHBDMO Cc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000603859877 1127677538 /nfs/dbraw/zinc/67/75/38/1127677538.db2.gz GTJGIAFROMKBGI-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC2(CC2)CC1 ZINC000599672170 1127685904 /nfs/dbraw/zinc/68/59/04/1127685904.db2.gz BUFYLUINZBTKNP-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000604013355 1127689681 /nfs/dbraw/zinc/68/96/81/1127689681.db2.gz DAQSCNJYDDESTC-UHFFFAOYSA-N 1 1 292.379 3.628 20 5 CHBDMO CC[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543857692 1127950307 /nfs/dbraw/zinc/95/03/07/1127950307.db2.gz HXIJQJCWCAQNGI-NSHDSACASA-N 1 1 268.744 3.623 20 5 CHBDMO C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000595425139 1127994688 /nfs/dbraw/zinc/99/46/88/1127994688.db2.gz JYSAOMNXDQXOOK-LBPRGKRZSA-N 1 1 278.327 3.522 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC(C)(C)C1 ZINC000468392201 1128005496 /nfs/dbraw/zinc/00/54/96/1128005496.db2.gz JVDDAVFURBTCHA-CQSZACIVSA-N 1 1 262.353 3.605 20 5 CHBDMO CCc1cccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000468855900 1128025134 /nfs/dbraw/zinc/02/51/34/1128025134.db2.gz GFHKEZBEGSTLBD-UHFFFAOYSA-N 1 1 284.359 3.789 20 5 CHBDMO CCc1cccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000468855900 1128025128 /nfs/dbraw/zinc/02/51/28/1128025128.db2.gz GFHKEZBEGSTLBD-UHFFFAOYSA-N 1 1 284.359 3.789 20 5 CHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000541553684 1128027062 /nfs/dbraw/zinc/02/70/62/1128027062.db2.gz SRLLOJUMYOZPDA-USYSOWRXSA-N 1 1 286.375 3.896 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccccn1 ZINC000541772602 1128039067 /nfs/dbraw/zinc/03/90/67/1128039067.db2.gz BNUUGQBKQSXYNM-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO CC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000470170768 1128063636 /nfs/dbraw/zinc/06/36/36/1128063636.db2.gz ADDAQDMDIZXACR-UKTHLTGXSA-N 1 1 274.364 3.730 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000470207394 1128065872 /nfs/dbraw/zinc/06/58/72/1128065872.db2.gz VPJYJULEFUBZRM-BPTWVKRQSA-N 1 1 286.375 3.873 20 5 CHBDMO CCOc1cc(C[N@H+]2CC[C@H](C)[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492816885 1128113603 /nfs/dbraw/zinc/11/36/03/1128113603.db2.gz JKZRDAPAURMGMC-JSGCOSHPSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@H](C)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492788327 1128113038 /nfs/dbraw/zinc/11/30/38/1128113038.db2.gz IFNVYXNOICICCG-OLZOCXBDSA-N 1 1 292.379 3.614 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1C(C)(C)C ZINC000609195397 1128170722 /nfs/dbraw/zinc/17/07/22/1128170722.db2.gz DTSZDPVPVXXFFH-HNNXBMFYSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1c(C[N@H+]([C@@H](C)C(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000915684847 1128334160 /nfs/dbraw/zinc/33/41/60/1128334160.db2.gz HIHYDSGGBIKEGS-ZDUSSCGKSA-N 1 1 276.380 3.912 20 5 CHBDMO CCCCC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000153734491 1128338911 /nfs/dbraw/zinc/33/89/11/1128338911.db2.gz CANMCKGFEJAUKW-INIZCTEOSA-N 1 1 294.395 3.529 20 5 CHBDMO CC1(C)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000565984239 1128536490 /nfs/dbraw/zinc/53/64/90/1128536490.db2.gz SPRWGVDLRFMWLV-GMNBZTITSA-N 1 1 286.375 3.728 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000569782433 1128609115 /nfs/dbraw/zinc/60/91/15/1128609115.db2.gz SDUWZLMAYNZEKP-UHFFFAOYSA-N 1 1 280.368 3.614 20 5 CHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609705338 1128722830 /nfs/dbraw/zinc/72/28/30/1128722830.db2.gz VMOVKRNBFQNPBA-LLVKDONJSA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@H]1CCCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609625626 1128720008 /nfs/dbraw/zinc/72/00/08/1128720008.db2.gz DTWMCPDSYRKRAB-AWEZNQCLSA-N 1 1 292.379 3.628 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609846134 1128728240 /nfs/dbraw/zinc/72/82/40/1128728240.db2.gz DTSJJXCUAUPRRI-IVMMDQJWSA-N 1 1 274.364 3.748 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610080164 1128737657 /nfs/dbraw/zinc/73/76/57/1128737657.db2.gz KKNUKHAMTTWGGS-CQSZACIVSA-N 1 1 262.353 3.749 20 5 CHBDMO CC[C@@H]1CC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000430203218 1117859813 /nfs/dbraw/zinc/85/98/13/1117859813.db2.gz IVZPDLMUOLOYIN-CYBMUJFWSA-N 1 1 286.331 3.839 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC(C)(C)CC1 ZINC000610216265 1117884170 /nfs/dbraw/zinc/88/41/70/1117884170.db2.gz BEQPOJJTNOWVPQ-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccoc1 ZINC000765287534 1118142404 /nfs/dbraw/zinc/14/24/04/1118142404.db2.gz VBPVIUSZEOEWMR-SECBINFHSA-N 1 1 280.711 3.692 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]1C1CC1 ZINC000615835588 1128764585 /nfs/dbraw/zinc/76/45/85/1128764585.db2.gz TYWXAQDVWOAMFW-QFSNBGPKSA-N 1 1 286.375 3.873 20 5 CHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610001968 1118279360 /nfs/dbraw/zinc/27/93/60/1118279360.db2.gz PVAFRERVEVUQMX-CZUORRHYSA-N 1 1 276.380 3.995 20 5 CHBDMO C[N@@H+](CCC(F)(F)F)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000088420016 1118398791 /nfs/dbraw/zinc/39/87/91/1118398791.db2.gz XALBSQNBUHPWEN-UHFFFAOYSA-N 1 1 296.676 3.632 20 5 CHBDMO C[N@H+](CCC(F)(F)F)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000088420016 1118398787 /nfs/dbraw/zinc/39/87/87/1118398787.db2.gz XALBSQNBUHPWEN-UHFFFAOYSA-N 1 1 296.676 3.632 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479577610 1119124736 /nfs/dbraw/zinc/12/47/36/1119124736.db2.gz JFUHQOMBNNBILO-GFCCVEGCSA-N 1 1 262.353 3.604 20 5 CHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000479582705 1119124909 /nfs/dbraw/zinc/12/49/09/1119124909.db2.gz YTTJSLMTYQTWGA-OAHLLOKOSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000153744962 1119283277 /nfs/dbraw/zinc/28/32/77/1119283277.db2.gz IMVMBGFXGRPBBT-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC23CCCCC3)cc1 ZINC000536179941 1119447579 /nfs/dbraw/zinc/44/75/79/1119447579.db2.gz LQUTXEOJMDMUCN-UHFFFAOYSA-N 1 1 274.364 3.894 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCCC[C@@H]1C ZINC000219699245 1119511337 /nfs/dbraw/zinc/51/13/37/1119511337.db2.gz SZAPHYCDVLUGDT-WFASDCNBSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccsc1)C1CC1 ZINC000065684129 1119579327 /nfs/dbraw/zinc/57/93/27/1119579327.db2.gz DEIHOBGWYRDACI-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccsc1)C1CC1 ZINC000065684129 1119579330 /nfs/dbraw/zinc/57/93/30/1119579330.db2.gz DEIHOBGWYRDACI-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO CCC(C)(C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000069432966 1128872389 /nfs/dbraw/zinc/87/23/89/1128872389.db2.gz WVXJTUWPBRXLKY-UHFFFAOYSA-N 1 1 270.760 3.869 20 5 CHBDMO C[C@H]([NH2+]CC=C(Cl)Cl)c1ccc([N+](=O)[O-])cc1 ZINC000407058766 1120033654 /nfs/dbraw/zinc/03/36/54/1120033654.db2.gz MZCFBJSKEQFMIY-QMMMGPOBSA-N 1 1 275.135 3.564 20 5 CHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000092703982 1120545691 /nfs/dbraw/zinc/54/56/91/1120545691.db2.gz OIFHKGFXDZASNC-GQCTYLIASA-N 1 1 286.375 3.728 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(C)c1 ZINC000500417706 1120617859 /nfs/dbraw/zinc/61/78/59/1120617859.db2.gz AOENRYUULWNZMX-OAHLLOKOSA-N 1 1 291.395 3.580 20 5 CHBDMO COc1ccc(C[N@@H+]([C@@H](C)C(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000078535771 1128944560 /nfs/dbraw/zinc/94/45/60/1128944560.db2.gz MVVYBQDSYSCADD-LBPRGKRZSA-N 1 1 292.379 3.612 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000511954968 1120865167 /nfs/dbraw/zinc/86/51/67/1120865167.db2.gz DBDKHASBCWYXGF-LBPRGKRZSA-N 1 1 262.353 3.560 20 5 CHBDMO CC1(C)CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542003026 1121015938 /nfs/dbraw/zinc/01/59/38/1121015938.db2.gz HICMICSMKMYGQV-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CC(C)C[C@@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001167897128 1121256368 /nfs/dbraw/zinc/25/63/68/1121256368.db2.gz DRCDFFUTNMRCKV-HNNXBMFYSA-N 1 1 276.380 3.995 20 5 CHBDMO CC(C)(C)C(=[NH2+])Nc1ccc2cnccc2c1[N+](=O)[O-] ZINC001162664961 1121329207 /nfs/dbraw/zinc/32/92/07/1121329207.db2.gz YUDFQAVHUSNSDV-UHFFFAOYSA-N 1 1 272.308 3.578 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000708505703 1121468821 /nfs/dbraw/zinc/46/88/21/1121468821.db2.gz ZVLURCZGZOHWCV-LBPRGKRZSA-N 1 1 280.343 3.746 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000512653366 1121510639 /nfs/dbraw/zinc/51/06/39/1121510639.db2.gz WNNFKPHLMQHFSS-VCIFKONDSA-N 1 1 286.375 3.873 20 5 CHBDMO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000611395309 1121643459 /nfs/dbraw/zinc/64/34/59/1121643459.db2.gz MWXSGBWEDPQCHA-NXEZZACHSA-N 1 1 291.376 3.772 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611516945 1121653489 /nfs/dbraw/zinc/65/34/89/1121653489.db2.gz QAEBHUAKZBSNKK-GHMZBOCLSA-N 1 1 284.306 3.551 20 5 CHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000619843866 1129015154 /nfs/dbraw/zinc/01/51/54/1129015154.db2.gz YIRDIEXYRFSBIW-GFCCVEGCSA-N 1 1 264.369 3.709 20 5 CHBDMO C[C@H]1CC(C)(C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001182396494 1122150787 /nfs/dbraw/zinc/15/07/87/1122150787.db2.gz IDACLUPCMJUWPA-JTQLQIEISA-N 1 1 282.771 3.869 20 5 CHBDMO CC(C)[C@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000430101276 1122404232 /nfs/dbraw/zinc/40/42/32/1122404232.db2.gz NHMRFANLSXVVCP-OAHLLOKOSA-N 1 1 274.364 3.605 20 5 CHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000505617439 1122438333 /nfs/dbraw/zinc/43/83/33/1122438333.db2.gz YWQYBDOJSVCPDH-NEPJUHHUSA-N 1 1 280.343 3.744 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)CC1(c2ccccc2)CC1 ZINC000438284631 1122689857 /nfs/dbraw/zinc/68/98/57/1122689857.db2.gz QDVLNNVYKNDEMB-UHFFFAOYSA-N 1 1 296.370 3.758 20 5 CHBDMO Cc1ccc(CC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000438514717 1122705373 /nfs/dbraw/zinc/70/53/73/1122705373.db2.gz FXPHFTWWVOXKII-UHFFFAOYSA-N 1 1 296.370 3.504 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+](C2CC2)C2CCCCC2)cs1 ZINC000054174802 1122766700 /nfs/dbraw/zinc/76/67/00/1122766700.db2.gz FTDGGGCXUVCYRV-UHFFFAOYSA-N 1 1 280.393 3.953 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@H](C)[C@@H]1C ZINC001195277907 1122860782 /nfs/dbraw/zinc/86/07/82/1122860782.db2.gz HDJRJOXALBBZSU-MROQNXINSA-N 1 1 262.353 3.632 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543857691 1123027255 /nfs/dbraw/zinc/02/72/55/1123027255.db2.gz HXIJQJCWCAQNGI-LLVKDONJSA-N 1 1 268.744 3.623 20 5 CHBDMO COc1ccc(C[N@H+]2CCCC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000522711714 1123719474 /nfs/dbraw/zinc/71/94/74/1123719474.db2.gz MICZHKZAOCTDLL-CQSZACIVSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1cc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])oc1C ZINC000281974116 1123764380 /nfs/dbraw/zinc/76/43/80/1123764380.db2.gz BQEGULYUPNEWPW-NSHDSACASA-N 1 1 274.320 3.655 20 5 CHBDMO COCCCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000171500022 1123855905 /nfs/dbraw/zinc/85/59/05/1123855905.db2.gz TYZMONWILFWTMF-UHFFFAOYSA-N 1 1 294.395 3.622 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000485541318 1123874052 /nfs/dbraw/zinc/87/40/52/1123874052.db2.gz HYIIMIXZEAYUHO-CYBMUJFWSA-N 1 1 292.379 3.616 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC23CCC3)c(Cl)c1 ZINC000444772811 1124063256 /nfs/dbraw/zinc/06/32/56/1124063256.db2.gz BKTPYDYDFBVICR-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000525309045 1124121946 /nfs/dbraw/zinc/12/19/46/1124121946.db2.gz RJFBFJQDVGUKMK-LLVKDONJSA-N 1 1 268.382 3.524 20 5 CHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccoc1 ZINC000872025018 1124658892 /nfs/dbraw/zinc/65/88/92/1124658892.db2.gz YFQAVKGVDBJFJZ-SNVBAGLBSA-N 1 1 292.360 3.761 20 5 CHBDMO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1c(F)cccc1[N+](=O)[O-] ZINC000872090665 1124680435 /nfs/dbraw/zinc/68/04/35/1124680435.db2.gz DQYPEPJHZICXPV-JFGNBEQYSA-N 1 1 284.306 3.665 20 5 CHBDMO CCC(C)(C)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000530278979 1125138277 /nfs/dbraw/zinc/13/82/77/1125138277.db2.gz VCGYQVQPSCYYHL-NTMALXAHSA-N 1 1 262.353 3.728 20 5 CHBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000531441450 1125218988 /nfs/dbraw/zinc/21/89/88/1125218988.db2.gz GBYIDNQVIQDRSZ-YOEHRIQHSA-N 1 1 296.370 3.973 20 5 CHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000531441470 1125219883 /nfs/dbraw/zinc/21/98/83/1125219883.db2.gz NOXYHJJFFXODIL-RDTXWAMCSA-N 1 1 296.370 3.973 20 5 CHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000531441447 1125220007 /nfs/dbraw/zinc/22/00/07/1125220007.db2.gz GBYIDNQVIQDRSZ-PBHICJAKSA-N 1 1 296.370 3.973 20 5 CHBDMO CSc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000883131406 1125373175 /nfs/dbraw/zinc/37/31/75/1125373175.db2.gz ASMAMQTZEDZFPY-JTQLQIEISA-N 1 1 292.360 3.761 20 5 CHBDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035127 1129690891 /nfs/dbraw/zinc/69/08/91/1129690891.db2.gz AJWRXJWHXMXWQL-JMSVASOKSA-N 1 1 296.798 3.778 20 5 CHBDMO Cc1ccccc1[C@H]1CCC[N@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169055868 1129693284 /nfs/dbraw/zinc/69/32/84/1129693284.db2.gz QXBXTIXSMMUYRF-HLLBOEOZSA-N 1 1 288.391 3.577 20 5 CHBDMO Cc1ccc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000768137328 1129834992 /nfs/dbraw/zinc/83/49/92/1129834992.db2.gz MAFCKASKHHMHPV-BETUJISGSA-N 1 1 262.353 3.666 20 5 CHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801517198 1129923448 /nfs/dbraw/zinc/92/34/48/1129923448.db2.gz BHFVYVKSCQFPDI-NWDGAFQWSA-N 1 1 280.343 3.744 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746654672 1130135313 /nfs/dbraw/zinc/13/53/13/1130135313.db2.gz JYYZSNPPWJZJAW-SNVBAGLBSA-N 1 1 270.760 3.725 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788480513 1130190450 /nfs/dbraw/zinc/19/04/50/1130190450.db2.gz KXKCNHWOGPDNFW-UXIGCNINSA-N 1 1 292.354 3.887 20 5 CHBDMO Cc1ccoc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000814175684 1130835379 /nfs/dbraw/zinc/83/53/79/1130835379.db2.gz YJQLFKPNGSPQPZ-UHFFFAOYSA-N 1 1 294.738 3.782 20 5 CHBDMO Cc1ccoc1C[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000814175684 1130835385 /nfs/dbraw/zinc/83/53/85/1130835385.db2.gz YJQLFKPNGSPQPZ-UHFFFAOYSA-N 1 1 294.738 3.782 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2C[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000816646775 1131119545 /nfs/dbraw/zinc/11/95/45/1131119545.db2.gz IYCGQDQGAPHAPP-NEPJUHHUSA-N 1 1 262.353 3.558 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H]2CCCC[C@H]2C1 ZINC001115984282 1131124287 /nfs/dbraw/zinc/12/42/87/1131124287.db2.gz NGIGNZUCSHERGD-STQMWFEESA-N 1 1 292.354 3.746 20 5 CHBDMO C[N@H+]1CCC[C@@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001227764103 1131739685 /nfs/dbraw/zinc/73/96/85/1131739685.db2.gz KMXWEIWDHVGXDM-MRXNPFEDSA-N 1 1 292.382 3.861 20 5 CHBDMO Cc1ccc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)cc1[N+](=O)[O-] ZINC001171380953 1131943523 /nfs/dbraw/zinc/94/35/23/1131943523.db2.gz HBVSESXXGCVIIK-DGCLKSJQSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccns1 ZINC000716015614 1132008059 /nfs/dbraw/zinc/00/80/59/1132008059.db2.gz QZGJEGSJRRHEHJ-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO CC[N@H+]1CC[C@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001230203741 1132160260 /nfs/dbraw/zinc/16/02/60/1132160260.db2.gz WWYSSETVBQUVHY-HNNXBMFYSA-N 1 1 292.382 3.861 20 5 CHBDMO C[C@@H]1C[C@@H](O)C[N@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001141722786 1132239804 /nfs/dbraw/zinc/23/98/04/1132239804.db2.gz JDAZJQMXIJBSJY-RHSMWYFYSA-N 1 1 291.394 3.948 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909939 1132371348 /nfs/dbraw/zinc/37/13/48/1132371348.db2.gz VWLBNXCXZGKCPF-CJNGLKHVSA-N 1 1 288.391 3.717 20 5 CHBDMO C[C@@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909382 1132372338 /nfs/dbraw/zinc/37/23/38/1132372338.db2.gz RJXKRMMNARCDSE-CZUORRHYSA-N 1 1 288.391 3.574 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)CC1 ZINC001173221564 1132411242 /nfs/dbraw/zinc/41/12/42/1132411242.db2.gz KHHGTMAHLPDEOL-ZIAGYGMSSA-N 1 1 276.380 3.648 20 5 CHBDMO CC(C)[N@@H+](CC1CC1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173228474 1132412831 /nfs/dbraw/zinc/41/28/31/1132412831.db2.gz XIQKDAIRTKLURD-ZDUSSCGKSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232218811 1132439149 /nfs/dbraw/zinc/43/91/49/1132439149.db2.gz LLGHYPLDXQCKLB-DOMZBBRYSA-N 1 1 295.361 3.715 20 5 CHBDMO C[C@@H]1C[C@H](F)C[N@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232218811 1132439153 /nfs/dbraw/zinc/43/91/53/1132439153.db2.gz LLGHYPLDXQCKLB-DOMZBBRYSA-N 1 1 295.361 3.715 20 5 CHBDMO Cc1ccc(Nc2ccc3nc[nH]c3c2)c([N+](=O)[O-])c1 ZINC001160223015 1132948833 /nfs/dbraw/zinc/94/88/33/1132948833.db2.gz DOGOGCLDIQIUKG-UHFFFAOYSA-N 1 1 268.276 3.523 20 5 CHBDMO Cc1ccc(Nc2ccc3[nH]c[nH+]c3c2)c([N+](=O)[O-])c1 ZINC001160223015 1132948837 /nfs/dbraw/zinc/94/88/37/1132948837.db2.gz DOGOGCLDIQIUKG-UHFFFAOYSA-N 1 1 268.276 3.523 20 5 CHBDMO Cc1c(C[N@H+]2C[C@@H](C3CC3)[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001205875829 1133625720 /nfs/dbraw/zinc/62/57/20/1133625720.db2.gz PNHOAPBNFIKFGD-DOTOQJQBSA-N 1 1 286.375 3.524 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1Nc1[nH+]c2ccccc2n1C ZINC001211283508 1134402514 /nfs/dbraw/zinc/40/25/14/1134402514.db2.gz BRECRHJJIVWWOH-UHFFFAOYSA-N 1 1 282.303 3.534 20 5 CHBDMO Cc1[nH+]c2ccccn2c1Nc1cc([N+](=O)[O-])ccc1C ZINC001211286002 1134402750 /nfs/dbraw/zinc/40/27/50/1134402750.db2.gz OEDCMFKUEVSTEN-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000309861900 1135118802 /nfs/dbraw/zinc/11/88/02/1135118802.db2.gz DMCCYKBOIWOJOW-CQSZACIVSA-N 1 1 299.374 3.527 20 5 CHBDMO CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000080263526 260178868 /nfs/dbraw/zinc/17/88/68/260178868.db2.gz PNJIGQGDUFZUGW-GWCFXTLKSA-N 1 1 291.376 3.853 20 5 CHBDMO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1nccs1 ZINC000080277427 260179607 /nfs/dbraw/zinc/17/96/07/260179607.db2.gz KYSHZHAUUDXFLV-LBPRGKRZSA-N 1 1 291.376 3.601 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccc(F)cc3)CC2)cs1 ZINC000356878556 266202911 /nfs/dbraw/zinc/20/29/11/266202911.db2.gz PYKKUNLTIYWHSH-UHFFFAOYSA-N 1 1 292.335 3.574 20 5 CHBDMO CC[C@@H]([NH2+][C@@H](C)c1nccs1)c1cccc([N+](=O)[O-])c1 ZINC000080268462 326928305 /nfs/dbraw/zinc/92/83/05/326928305.db2.gz PMWMZRKVSVFBIH-GXFFZTMASA-N 1 1 291.376 3.853 20 5 CHBDMO C[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000561411330 327393221 /nfs/dbraw/zinc/39/32/21/327393221.db2.gz GMCMBCZWTSJDFW-TXNVCOODSA-N 1 1 296.317 3.585 20 5 CHBDMO C[C@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000561411329 327393229 /nfs/dbraw/zinc/39/32/29/327393229.db2.gz GMCMBCZWTSJDFW-RNZFLTOJSA-N 1 1 296.317 3.585 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000036921794 330313842 /nfs/dbraw/zinc/31/38/42/330313842.db2.gz FLWPDSGXGROHIA-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@H](c1ccco1)[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000086233286 330369152 /nfs/dbraw/zinc/36/91/52/330369152.db2.gz CQRNPPNMKOPFCO-GFCCVEGCSA-N 1 1 286.331 3.913 20 5 CHBDMO C[C@H](c1ccco1)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000086233286 330369153 /nfs/dbraw/zinc/36/91/53/330369153.db2.gz CQRNPPNMKOPFCO-GFCCVEGCSA-N 1 1 286.331 3.913 20 5 CHBDMO CC[C@@H](F)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543737 331033615 /nfs/dbraw/zinc/03/36/15/331033615.db2.gz CJRZNEFMMCGMPM-ZIAGYGMSSA-N 1 1 280.343 3.522 20 5 CHBDMO CC/C=C/CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000466218652 331391017 /nfs/dbraw/zinc/39/10/17/331391017.db2.gz OGHCKEBNBCYYGX-ONEGZZNKSA-N 1 1 274.364 3.916 20 5 CHBDMO CC/C=C\CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000466218651 331391029 /nfs/dbraw/zinc/39/10/29/331391029.db2.gz OGHCKEBNBCYYGX-ARJAWSKDSA-N 1 1 274.364 3.916 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1cccc(C)[nH+]1 ZINC000468628691 331437686 /nfs/dbraw/zinc/43/76/86/331437686.db2.gz BLPNYXFEZULOSR-XFXZXTDPSA-N 1 1 283.331 3.814 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1Cc2ccccc2C1 ZINC000489096898 332041183 /nfs/dbraw/zinc/04/11/83/332041183.db2.gz MBXFPQYHSDWZHH-ZDUSSCGKSA-N 1 1 282.343 3.980 20 5 CHBDMO CC[C@@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490010396 332076603 /nfs/dbraw/zinc/07/66/03/332076603.db2.gz BCSNTBOEMISIJV-QWHCGFSZSA-N 1 1 262.353 3.696 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490087504 332080815 /nfs/dbraw/zinc/08/08/15/332080815.db2.gz JETSUOFGPUVACL-CYBMUJFWSA-N 1 1 292.379 3.616 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C(C)C ZINC000311862328 333073754 /nfs/dbraw/zinc/07/37/54/333073754.db2.gz KJNNEPRERLSCCZ-UHFFFAOYSA-N 1 1 268.332 3.600 20 5 CHBDMO Cc1c(C[N@@H+]2CCCC[C@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000516994720 333089198 /nfs/dbraw/zinc/08/91/98/333089198.db2.gz TYJJRILJHLEZLK-HNNXBMFYSA-N 1 1 276.380 3.914 20 5 CHBDMO CC[N@@H+](CC1CC1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182782650 333117614 /nfs/dbraw/zinc/11/76/14/333117614.db2.gz KJLCBLRIHUMLCY-LBPRGKRZSA-N 1 1 262.353 3.696 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000522299725 333280744 /nfs/dbraw/zinc/28/07/44/333280744.db2.gz SOIBNXQNXMPKGV-OAHLLOKOSA-N 1 1 276.380 3.853 20 5 CHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000522418961 333286724 /nfs/dbraw/zinc/28/67/24/333286724.db2.gz VZDSXMYEIIKKTH-PBHICJAKSA-N 1 1 296.370 3.973 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523841153 333347696 /nfs/dbraw/zinc/34/76/96/333347696.db2.gz OPEJOOKXMAGDLK-JTQLQIEISA-N 1 1 270.760 3.725 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]([C@@H](C)C1CC1)C1CC1 ZINC000546705346 334047128 /nfs/dbraw/zinc/04/71/28/334047128.db2.gz QRMAFDOMHDMKRC-LBPRGKRZSA-N 1 1 274.364 3.666 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000548587379 334163034 /nfs/dbraw/zinc/16/30/34/334163034.db2.gz IWAGTLCTKPTFRV-CYBMUJFWSA-N 1 1 262.353 3.668 20 5 CHBDMO C[C@H](CNc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000347322338 335376042 /nfs/dbraw/zinc/37/60/42/335376042.db2.gz VETXKVNNKAKASI-CQSZACIVSA-N 1 1 299.374 3.527 20 5 CHBDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000353664063 534074319 /nfs/dbraw/zinc/07/43/19/534074319.db2.gz FQXJDRUBFASGTF-CYBMUJFWSA-N 1 1 282.343 3.542 20 5 CHBDMO CO[C@]1(C)CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000280495957 521752096 /nfs/dbraw/zinc/75/20/96/521752096.db2.gz MOKFQNORUOMEGB-XJKSGUPXSA-N 1 1 292.379 3.547 20 5 CHBDMO Cc1c(C[N@H+](C)[C@@H](C)C2CCC2)cccc1[N+](=O)[O-] ZINC000357026896 525702671 /nfs/dbraw/zinc/70/26/71/525702671.db2.gz RGKJTOXVLOVTAO-LBPRGKRZSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H](c1ccco1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276346558 526136516 /nfs/dbraw/zinc/13/65/16/526136516.db2.gz VLRPDINXDGDUEM-JTQLQIEISA-N 1 1 278.283 3.520 20 5 CHBDMO C[C@@H](c1ccco1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276346558 526136527 /nfs/dbraw/zinc/13/65/27/526136527.db2.gz VLRPDINXDGDUEM-JTQLQIEISA-N 1 1 278.283 3.520 20 5 CHBDMO CC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H](C)C(C)C ZINC000509295198 1121518867 /nfs/dbraw/zinc/51/88/67/1121518867.db2.gz UHCPGYAEQMYZDR-JTQLQIEISA-N 1 1 286.322 3.739 20 5 CHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCCC[C@@H]1c1ccccc1 ZINC000886136162 1125655435 /nfs/dbraw/zinc/65/54/35/1125655435.db2.gz HQGHLYNGLKBCPM-MRXNPFEDSA-N 1 1 297.358 3.717 20 5 CHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCC[C@@H]1c1ccccc1 ZINC000886136162 1125655436 /nfs/dbraw/zinc/65/54/36/1125655436.db2.gz HQGHLYNGLKBCPM-MRXNPFEDSA-N 1 1 297.358 3.717 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000886540831 1125687225 /nfs/dbraw/zinc/68/72/25/1125687225.db2.gz LNABQOLEXMUDMI-XJKSGUPXSA-N 1 1 297.358 3.573 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000482304836 1126750306 /nfs/dbraw/zinc/75/03/06/1126750306.db2.gz BCBPXTZLYSDICF-GFCCVEGCSA-N 1 1 262.353 3.525 20 5 CHBDMO CC1=C(C)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000482458724 1126757574 /nfs/dbraw/zinc/75/75/74/1126757574.db2.gz MMCFREWQODZHPC-FNORWQNLSA-N 1 1 272.348 3.650 20 5 CHBDMO C[C@@H]([NH2+]Cc1cnc(Cl)s1)c1cccc([N+](=O)[O-])c1 ZINC000180456477 1126844442 /nfs/dbraw/zinc/84/44/42/1126844442.db2.gz VUUUFUSPKUCPKG-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000043643203 1127005323 /nfs/dbraw/zinc/00/53/23/1127005323.db2.gz JZQUVIRAGLXFPB-UHFFFAOYSA-N 1 1 282.343 3.759 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccccc1)C1CC1 ZINC000043643203 1127005324 /nfs/dbraw/zinc/00/53/24/1127005324.db2.gz JZQUVIRAGLXFPB-UHFFFAOYSA-N 1 1 282.343 3.759 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000487235834 1127026807 /nfs/dbraw/zinc/02/68/07/1127026807.db2.gz UYCMCJMQXOEEIX-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000487291786 1127030236 /nfs/dbraw/zinc/03/02/36/1127030236.db2.gz RZMRUPQBBCPLQX-RYUDHWBXSA-N 1 1 250.342 3.634 20 5 CHBDMO CCc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000271679788 1127097000 /nfs/dbraw/zinc/09/70/00/1127097000.db2.gz OQSGOVFGAMGGEK-LLVKDONJSA-N 1 1 274.320 3.601 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[NH+]2C3CCCC2CCC3)c(F)c1 ZINC000586765323 1127138957 /nfs/dbraw/zinc/13/89/57/1127138957.db2.gz WTBLABIXOQZANS-UHFFFAOYSA-N 1 1 296.317 3.780 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1cccnc1)C(C)C ZINC000349276587 1127145059 /nfs/dbraw/zinc/14/50/59/1127145059.db2.gz KEPUTRMFDQLDKS-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2cccs2)C2CC2)c1 ZINC000045006605 1127167123 /nfs/dbraw/zinc/16/71/23/1127167123.db2.gz HLHJECCMAUTHIZ-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000588977944 1127209156 /nfs/dbraw/zinc/20/91/56/1127209156.db2.gz DZMAALWBHWEIQM-GXTWGEPZSA-N 1 1 274.364 3.778 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000589209387 1127216240 /nfs/dbraw/zinc/21/62/40/1127216240.db2.gz KXHRHBVMMGDYNU-GIZXNFQBSA-N 1 1 286.375 3.730 20 5 CHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C3CCCC3)C2)cc1 ZINC000590757613 1127270451 /nfs/dbraw/zinc/27/04/51/1127270451.db2.gz ILJTXMPVDCKLJO-AWEZNQCLSA-N 1 1 274.364 3.717 20 5 CHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000359293441 1127456838 /nfs/dbraw/zinc/45/68/38/1127456838.db2.gz FLEHWNOBCZSDNQ-CJNGLKHVSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])C(C)(C)C ZINC000595290176 1127457098 /nfs/dbraw/zinc/45/70/98/1127457098.db2.gz JAQNJGQHRHIHGB-SNVBAGLBSA-N 1 1 268.332 3.600 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-])C(C)(C)C ZINC000595290175 1127457617 /nfs/dbraw/zinc/45/76/17/1127457617.db2.gz JAQNJGQHRHIHGB-JTQLQIEISA-N 1 1 268.332 3.600 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2Cc3ccccc3C3(CC3)C2)cc1 ZINC000360702283 1127507012 /nfs/dbraw/zinc/50/70/12/1127507012.db2.gz IKFVTKAETGIOOC-UHFFFAOYSA-N 1 1 294.354 3.642 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+]([C@@H]1C[C@H]1c1ccccc1)CC2 ZINC000361314806 1127556090 /nfs/dbraw/zinc/55/60/90/1127556090.db2.gz SLCOROYBYXIPIY-ZWKOTPCHSA-N 1 1 294.354 3.509 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+]([C@H]1C[C@@H]1c1ccccc1)CC2 ZINC000361314803 1127556453 /nfs/dbraw/zinc/55/64/53/1127556453.db2.gz SLCOROYBYXIPIY-MSOLQXFVSA-N 1 1 294.354 3.509 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000599059221 1127653560 /nfs/dbraw/zinc/65/35/60/1127653560.db2.gz PXEAYSYBZQJZGI-GRYCIOLGSA-N 1 1 298.333 3.879 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000599060166 1127653626 /nfs/dbraw/zinc/65/36/26/1127653626.db2.gz TXSLFLDKYUDKCD-GRYCIOLGSA-N 1 1 298.333 3.879 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000603582123 1127660352 /nfs/dbraw/zinc/66/03/52/1127660352.db2.gz UMHVGIFGUIUMGN-OCCSQVGLSA-N 1 1 292.379 3.614 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000603582121 1127660582 /nfs/dbraw/zinc/66/05/82/1127660582.db2.gz UMHVGIFGUIUMGN-GXTWGEPZSA-N 1 1 292.379 3.614 20 5 CHBDMO CCC(CC)C[N@@H+](CC)Cc1cccc([N+](=O)[O-])c1 ZINC000603849650 1127675904 /nfs/dbraw/zinc/67/59/04/1127675904.db2.gz MYKSMQAUTOACJB-UHFFFAOYSA-N 1 1 264.369 3.853 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000599570101 1127679405 /nfs/dbraw/zinc/67/94/05/1127679405.db2.gz UJZIMNUUQBXXOC-QGZVFWFLSA-N 1 1 297.358 3.621 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC(F)(F)CC1 ZINC000599552065 1127679983 /nfs/dbraw/zinc/67/99/83/1127679983.db2.gz UTXQJNCUNWKCDB-NSHDSACASA-N 1 1 284.306 3.777 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccco2)C1 ZINC000374007185 1127870683 /nfs/dbraw/zinc/87/06/83/1127870683.db2.gz CJWZFJSKXIVTJV-JSGCOSHPSA-N 1 1 286.331 3.738 20 5 CHBDMO Cc1ccc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000539824825 1127940688 /nfs/dbraw/zinc/94/06/88/1127940688.db2.gz LGHUFINXMASNRK-AAEUAGOBSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000544612065 1127979421 /nfs/dbraw/zinc/97/94/21/1127979421.db2.gz XCLWUGLXMADCNQ-FZMZJTMJSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@@]1(C)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468138133 1127994795 /nfs/dbraw/zinc/99/47/95/1127994795.db2.gz KHUBSAJGCZYWAD-WFASDCNBSA-N 1 1 262.353 3.778 20 5 CHBDMO CS[C@H]1CCCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468258103 1128000628 /nfs/dbraw/zinc/00/06/28/1128000628.db2.gz AVGHYVXOISAXKT-STQMWFEESA-N 1 1 294.420 3.873 20 5 CHBDMO COc1ccc(C[N@@H+](C)[C@H]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000468409056 1128007168 /nfs/dbraw/zinc/00/71/68/1128007168.db2.gz RGYCBMFHTNKNCU-ZDUSSCGKSA-N 1 1 292.379 3.614 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000541553681 1128027536 /nfs/dbraw/zinc/02/75/36/1128027536.db2.gz SRLLOJUMYOZPDA-OCOPJHETSA-N 1 1 286.375 3.896 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](C)C1 ZINC000470175903 1128064896 /nfs/dbraw/zinc/06/48/96/1128064896.db2.gz TUGRBAIGFWBRIG-OZYJXZHSSA-N 1 1 274.364 3.730 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094801057 1128080010 /nfs/dbraw/zinc/08/00/10/1128080010.db2.gz OKMFXDSIHSWEJK-UHFFFAOYSA-N 1 1 280.343 3.746 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C2CC2)C1 ZINC000492785037 1128113016 /nfs/dbraw/zinc/11/30/16/1128113016.db2.gz RWKPQAQALHQXDJ-JSGCOSHPSA-N 1 1 274.364 3.696 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC(C)(C)C ZINC000761505961 1128132378 /nfs/dbraw/zinc/13/23/78/1128132378.db2.gz JMLZVJHSLMFEFD-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO C[C@@H]([N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-])C1(C)CC1 ZINC000493310367 1128138384 /nfs/dbraw/zinc/13/83/84/1128138384.db2.gz KIMVZFYURLOCAQ-SNVBAGLBSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-])C1(C)CC1 ZINC000493310367 1128138386 /nfs/dbraw/zinc/13/83/86/1128138386.db2.gz KIMVZFYURLOCAQ-SNVBAGLBSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000487967782 1128312402 /nfs/dbraw/zinc/31/24/02/1128312402.db2.gz DETYEFKYJSLLEO-XQQFMLRXSA-N 1 1 262.353 3.634 20 5 CHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000915685331 1128334211 /nfs/dbraw/zinc/33/42/11/1128334211.db2.gz VEFPDVRKNMDXGB-SMDDNHRTSA-N 1 1 280.343 3.744 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2cccc(F)c2)c1 ZINC000035368248 1128329303 /nfs/dbraw/zinc/32/93/03/1128329303.db2.gz VIGYRDRJYZXKNW-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000916152115 1128409704 /nfs/dbraw/zinc/40/97/04/1128409704.db2.gz NKILBOYLNKXRFI-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccn1 ZINC000932443835 1128409985 /nfs/dbraw/zinc/40/99/85/1128409985.db2.gz ROQBTZOHDNFYQB-UHFFFAOYSA-N 1 1 299.374 3.648 20 5 CHBDMO CC1CCC([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000917013566 1128467963 /nfs/dbraw/zinc/46/79/63/1128467963.db2.gz HAXQSBNSVWUKSY-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO CC1(C)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000565984234 1128536454 /nfs/dbraw/zinc/53/64/54/1128536454.db2.gz SPRWGVDLRFMWLV-BIENSFFJSA-N 1 1 286.375 3.728 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000567548696 1128566910 /nfs/dbraw/zinc/56/69/10/1128566910.db2.gz NEESUPSUCUGOAX-LBPRGKRZSA-N 1 1 280.368 3.614 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCc3sccc3C2)cc1 ZINC000609322827 1128698102 /nfs/dbraw/zinc/69/81/02/1128698102.db2.gz MTTICYJPMOUZLQ-UHFFFAOYSA-N 1 1 288.372 3.605 20 5 CHBDMO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000601112697 1128698526 /nfs/dbraw/zinc/69/85/26/1128698526.db2.gz ASQOQOFSGOEGKN-LBPRGKRZSA-N 1 1 288.322 3.893 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)C[C@H]1C ZINC000610133399 1128739563 /nfs/dbraw/zinc/73/95/63/1128739563.db2.gz MJQCNADJFPAFHX-CHWSQXEVSA-N 1 1 292.379 3.612 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](CC1CCC1)C(C)C ZINC000430243207 1117911238 /nfs/dbraw/zinc/91/12/38/1117911238.db2.gz UOGMLXRTOCFIQN-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000444747534 1117918692 /nfs/dbraw/zinc/91/86/92/1117918692.db2.gz AIBXRNUGZAZSFJ-OAHLLOKOSA-N 1 1 276.380 3.505 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000430280759 1117989618 /nfs/dbraw/zinc/98/96/18/1117989618.db2.gz YCORPJFFMDXTRF-YPMHNXCESA-N 1 1 260.337 3.554 20 5 CHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1CCCC1 ZINC000110512635 1118347350 /nfs/dbraw/zinc/34/73/50/1118347350.db2.gz DNVUUGVJVRGMSV-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC(C)=C[C@@H](C)C1 ZINC000430884418 1118783147 /nfs/dbraw/zinc/78/31/47/1118783147.db2.gz WOVIVUADSIDVHU-MGMWDDNKSA-N 1 1 286.375 3.896 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC(C)=C[C@@H](C)C1 ZINC000430884415 1118783507 /nfs/dbraw/zinc/78/35/07/1118783507.db2.gz WOVIVUADSIDVHU-ATDKOCKZSA-N 1 1 286.375 3.896 20 5 CHBDMO Cc1cccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511067255 1119002525 /nfs/dbraw/zinc/00/25/25/1119002525.db2.gz ULMIKXSQPWRHKT-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000540055016 1119024828 /nfs/dbraw/zinc/02/48/28/1119024828.db2.gz AUJZCXUHJYUXAD-RISCZKNCSA-N 1 1 262.353 3.666 20 5 CHBDMO Cc1c(C[N@H+](CC(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000051735416 1119104738 /nfs/dbraw/zinc/10/47/38/1119104738.db2.gz DCMOBJHUKWPUAN-UHFFFAOYSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000166556913 1119263631 /nfs/dbraw/zinc/26/36/31/1119263631.db2.gz GIAQQCOBQCJSQC-WOPDTQHZSA-N 1 1 280.343 3.600 20 5 CHBDMO Cc1c(C[N@H+](Cc2ccccn2)C(C)C)cccc1[N+](=O)[O-] ZINC000052218531 1119326244 /nfs/dbraw/zinc/32/62/44/1119326244.db2.gz KWBSLGVVPLWXBM-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000219697480 1119510940 /nfs/dbraw/zinc/51/09/40/1119510940.db2.gz FINOUWLVCUQVAS-WFASDCNBSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000273437282 1120116429 /nfs/dbraw/zinc/11/64/29/1120116429.db2.gz MFXKXVRFWXARKV-MRXNPFEDSA-N 1 1 285.347 3.568 20 5 CHBDMO CC[N@H+](Cc1ccncc1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271000463 1120220718 /nfs/dbraw/zinc/22/07/18/1120220718.db2.gz JYVZEMKYULLWIG-CYBMUJFWSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[N@@H+](Cc1ccncc1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271000463 1120220720 /nfs/dbraw/zinc/22/07/20/1120220720.db2.gz JYVZEMKYULLWIG-CYBMUJFWSA-N 1 1 285.347 3.573 20 5 CHBDMO Cc1[nH+]c2cc(Nc3ccc([N+](=O)[O-])c(C)c3)ccc2n1C ZINC000301960084 1120490139 /nfs/dbraw/zinc/49/01/39/1120490139.db2.gz PWVPVUSOGVDGSV-UHFFFAOYSA-N 1 1 296.330 3.842 20 5 CHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000053422362 1120495473 /nfs/dbraw/zinc/49/54/73/1120495473.db2.gz PFFMAAJDSWBYGE-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1cccs1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000053428424 1120497763 /nfs/dbraw/zinc/49/77/63/1120497763.db2.gz BXKDSEYTSCZPHS-LLVKDONJSA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000053428424 1120497764 /nfs/dbraw/zinc/49/77/64/1120497764.db2.gz BXKDSEYTSCZPHS-LLVKDONJSA-N 1 1 276.361 3.849 20 5 CHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000466934917 1120567949 /nfs/dbraw/zinc/56/79/49/1120567949.db2.gz GRNQDRVIWPZKIE-GXFFZTMASA-N 1 1 282.771 3.869 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2CCCSCC2)cc1[N+](=O)[O-] ZINC000357225641 1121053200 /nfs/dbraw/zinc/05/32/00/1121053200.db2.gz AIWUAMZERSRIDA-UHFFFAOYSA-N 1 1 294.420 3.657 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCC(F)(F)F ZINC000072981260 1121129561 /nfs/dbraw/zinc/12/95/61/1121129561.db2.gz YJPMEPMXJBVMOH-VIFPVBQESA-N 1 1 276.258 3.540 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCC(F)(F)F ZINC000072981260 1121129562 /nfs/dbraw/zinc/12/95/62/1121129562.db2.gz YJPMEPMXJBVMOH-VIFPVBQESA-N 1 1 276.258 3.540 20 5 CHBDMO Cc1ccc(C[N@@H+]2CC3(CCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000432789116 1121350819 /nfs/dbraw/zinc/35/08/19/1121350819.db2.gz PMNWMWWOGKUKGW-CYBMUJFWSA-N 1 1 274.364 3.668 20 5 CHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543631615 1121538318 /nfs/dbraw/zinc/53/83/18/1121538318.db2.gz MHOFOSWDQHUPHA-CYBMUJFWSA-N 1 1 296.436 3.867 20 5 CHBDMO COc1ccc(Nc2ccc3c[nH+]ccc3c2)cc1[N+](=O)[O-] ZINC001176363307 1121614090 /nfs/dbraw/zinc/61/40/90/1121614090.db2.gz LOJOMIIUDMHXSJ-UHFFFAOYSA-N 1 1 295.298 3.895 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000611516522 1121653999 /nfs/dbraw/zinc/65/39/99/1121653999.db2.gz OPJNZHWQIOILQP-CYBMUJFWSA-N 1 1 294.395 3.711 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCC1CCCCC1)CC2 ZINC001180267314 1121969200 /nfs/dbraw/zinc/96/92/00/1121969200.db2.gz TUKRPEFFRJWHNY-UHFFFAOYSA-N 1 1 288.391 3.923 20 5 CHBDMO Cc1cc(C)cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000501775562 1122008370 /nfs/dbraw/zinc/00/83/70/1122008370.db2.gz MEVKIBRFZOYPGJ-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-])C1(C)CC1 ZINC000437532844 1122639096 /nfs/dbraw/zinc/63/90/96/1122639096.db2.gz DIKSUOWXGVEMSY-JTQLQIEISA-N 1 1 282.771 3.869 20 5 CHBDMO CC1(C)CCCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000438367824 1122694702 /nfs/dbraw/zinc/69/47/02/1122694702.db2.gz PJXMCZUNSDBASG-UHFFFAOYSA-N 1 1 268.382 3.668 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1 ZINC001193742728 1122712321 /nfs/dbraw/zinc/71/23/21/1122712321.db2.gz FIECBWRHXJOMHY-UHFFFAOYSA-N 1 1 298.386 3.886 20 5 CHBDMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429600741 1122726854 /nfs/dbraw/zinc/72/68/54/1122726854.db2.gz WTRKEGVAQLQQQM-WDEREUQCSA-N 1 1 282.771 3.869 20 5 CHBDMO CC(C)C[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000506495046 1122756944 /nfs/dbraw/zinc/75/69/44/1122756944.db2.gz IMTCLDCSJVHSNJ-UHFFFAOYSA-N 1 1 288.347 3.943 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](CCCC)Cc1cn(C)nc1[N+](=O)[O-] ZINC001194570515 1122784528 /nfs/dbraw/zinc/78/45/28/1122784528.db2.gz KIPDMHIMENVJFK-CYBMUJFWSA-N 1 1 296.415 3.509 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426524698 1122812319 /nfs/dbraw/zinc/81/23/19/1122812319.db2.gz PNQPWWYAGKGMAB-GWCFXTLKSA-N 1 1 280.755 3.623 20 5 CHBDMO C[C@H](c1ccccn1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183679133 1129081262 /nfs/dbraw/zinc/08/12/62/1129081262.db2.gz XOPNJWSGGUOVNY-RCQQVGEISA-N 1 1 297.358 3.696 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000348525654 1122891463 /nfs/dbraw/zinc/89/14/63/1122891463.db2.gz PDPZCWMSIIIWCL-OAHLLOKOSA-N 1 1 268.316 3.542 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000348525654 1122891465 /nfs/dbraw/zinc/89/14/65/1122891465.db2.gz PDPZCWMSIIIWCL-OAHLLOKOSA-N 1 1 268.316 3.542 20 5 CHBDMO C/C=C\C[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001196612715 1122927584 /nfs/dbraw/zinc/92/75/84/1122927584.db2.gz FFIWYFJSKVSFAU-XQJDBVBESA-N 1 1 292.354 3.912 20 5 CHBDMO Cc1ccoc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507151351 1122932798 /nfs/dbraw/zinc/93/27/98/1122932798.db2.gz DSMMCYFJXMDUQU-UHFFFAOYSA-N 1 1 288.347 3.907 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000543628050 1122945378 /nfs/dbraw/zinc/94/53/78/1122945378.db2.gz KCJHPXYRLNEVJW-AWEZNQCLSA-N 1 1 262.353 3.668 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000025938369 1123843602 /nfs/dbraw/zinc/84/36/02/1123843602.db2.gz RUPVGUYRZFWLAR-KRWDZBQOSA-N 1 1 282.343 3.714 20 5 CHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC1CCC1 ZINC000475547607 1124007262 /nfs/dbraw/zinc/00/72/62/1124007262.db2.gz JYDMIZHYEHUALR-POHAHGRESA-N 1 1 274.364 3.730 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000519917696 1124069095 /nfs/dbraw/zinc/06/90/95/1124069095.db2.gz DUNYYPXDBWRCCQ-UHFFFAOYSA-N 1 1 284.359 3.925 20 5 CHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccoc1 ZINC000872025016 1124659329 /nfs/dbraw/zinc/65/93/29/1124659329.db2.gz YFQAVKGVDBJFJZ-JTQLQIEISA-N 1 1 292.360 3.761 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)CC(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872064013 1124671205 /nfs/dbraw/zinc/67/12/05/1124671205.db2.gz VIJBJFUMGWVRLA-JGVFFNPUSA-N 1 1 294.248 3.725 20 5 CHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]2C2CC2)o1 ZINC000449429586 1124735738 /nfs/dbraw/zinc/73/57/38/1124735738.db2.gz XDFLQOGZTHZRAB-OAHLLOKOSA-N 1 1 298.342 3.839 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC1CC(F)(F)C1)C1CC1 ZINC000450599067 1125064031 /nfs/dbraw/zinc/06/40/31/1125064031.db2.gz KLZDKOYIEKAQNQ-UHFFFAOYSA-N 1 1 296.317 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CC=CCC2)C2CC2)cc1 ZINC000215663826 1125144303 /nfs/dbraw/zinc/14/43/03/1125144303.db2.gz DPMUOXYVSSEMEK-AWEZNQCLSA-N 1 1 286.375 3.916 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@H]2c2ccccn2)cccc1[N+](=O)[O-] ZINC000530963489 1125189641 /nfs/dbraw/zinc/18/96/41/1125189641.db2.gz VRJBKOWPQMLUNE-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000531202530 1125200876 /nfs/dbraw/zinc/20/08/76/1125200876.db2.gz QSGLMCHWFXHFGL-KDOFPFPSSA-N 1 1 296.370 3.973 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000531378680 1125212539 /nfs/dbraw/zinc/21/25/39/1125212539.db2.gz JNOMWEJNEZFAPO-CXAGYDPISA-N 1 1 282.343 3.788 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)C(C)C ZINC000065299240 1129434169 /nfs/dbraw/zinc/43/41/69/1129434169.db2.gz MIXOJLDOZTWKQX-CYBMUJFWSA-N 1 1 264.369 3.770 20 5 CHBDMO CCCC[N@@H+](Cc1ccccc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169030252 1129690423 /nfs/dbraw/zinc/69/04/23/1129690423.db2.gz XJUBTDQGFYXXBO-IAGOWNOFSA-N 1 1 290.407 3.734 20 5 CHBDMO C[N@@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C1CCC(C(C)(C)C)CC1 ZINC001169036352 1129690533 /nfs/dbraw/zinc/69/05/33/1129690533.db2.gz FRBHNRGECUFPBK-LMPOIIKSSA-N 1 1 296.455 3.969 20 5 CHBDMO CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169048722 1129691774 /nfs/dbraw/zinc/69/17/74/1129691774.db2.gz AXLMVPHBFVVJNI-ZMSDIMECSA-N 1 1 290.407 3.903 20 5 CHBDMO C[C@H](c1ccccc1Cl)[N@@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169049590 1129692113 /nfs/dbraw/zinc/69/21/13/1129692113.db2.gz WQKLLLDQLUOGOR-AGIUHOORSA-N 1 1 296.798 3.778 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801516030 1129923763 /nfs/dbraw/zinc/92/37/63/1129923763.db2.gz QKMHHPJZLMYILY-AWEZNQCLSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000903341289 1130163534 /nfs/dbraw/zinc/16/35/34/1130163534.db2.gz XIOLEYCTMIPTMR-PXAZEXFGSA-N 1 1 297.358 3.792 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788480512 1130190376 /nfs/dbraw/zinc/19/03/76/1130190376.db2.gz KXKCNHWOGPDNFW-OSAQELSMSA-N 1 1 292.354 3.887 20 5 CHBDMO CCCCC[N@@H+](C)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329379 1130483285 /nfs/dbraw/zinc/48/32/85/1130483285.db2.gz PTONHCVJVONXCM-ZDUSSCGKSA-N 1 1 294.395 3.656 20 5 CHBDMO C[Si](C)(C)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001170409715 1130491813 /nfs/dbraw/zinc/49/18/13/1130491813.db2.gz BCNYMJWYKNJJIS-CQSZACIVSA-N 1 1 292.455 3.652 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@@H+]1CCN[C@H]2C[C@H]21 ZINC001235287477 1130731130 /nfs/dbraw/zinc/73/11/30/1130731130.db2.gz CSMVMOASDGRXND-VQTJNVASSA-N 1 1 288.394 3.539 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCN[C@H]2C[C@H]21 ZINC001235287477 1130731133 /nfs/dbraw/zinc/73/11/33/1130731133.db2.gz CSMVMOASDGRXND-VQTJNVASSA-N 1 1 288.394 3.539 20 5 CHBDMO C[C@@H]([NH3+])CN(C)Cc1c2ccccc2cc2ccccc21 ZINC001235963175 1130818084 /nfs/dbraw/zinc/81/80/84/1130818084.db2.gz QBGMJIFJCVTXTO-CQSZACIVSA-N 1 1 278.399 3.772 20 5 CHBDMO C[C@@H](N)C[N@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC001235963175 1130818091 /nfs/dbraw/zinc/81/80/91/1130818091.db2.gz QBGMJIFJCVTXTO-CQSZACIVSA-N 1 1 278.399 3.772 20 5 CHBDMO C[C@@H](N)C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC001235963175 1130818096 /nfs/dbraw/zinc/81/80/96/1130818096.db2.gz QBGMJIFJCVTXTO-CQSZACIVSA-N 1 1 278.399 3.772 20 5 CHBDMO C[C@@H]1C[C@H](N)C[N@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001237203978 1131070379 /nfs/dbraw/zinc/07/03/79/1131070379.db2.gz OWFDOYUTVSZRLV-PBHICJAKSA-N 1 1 290.410 3.915 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000816646320 1131117089 /nfs/dbraw/zinc/11/70/89/1131117089.db2.gz BTWORNNSSHVNIU-VXGBXAGGSA-N 1 1 286.331 3.695 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC001115984280 1131124481 /nfs/dbraw/zinc/12/44/81/1131124481.db2.gz NGIGNZUCSHERGD-QWHCGFSZSA-N 1 1 292.354 3.746 20 5 CHBDMO CC(C)[NH+]1CC(Oc2cccc3cc4ccccc4nc32)C1 ZINC001228175257 1131823329 /nfs/dbraw/zinc/82/33/29/1131823329.db2.gz AWXUBJWTEJACIE-UHFFFAOYSA-N 1 1 292.382 3.859 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CCCC2(CCC2)C1 ZINC000348194884 1131896076 /nfs/dbraw/zinc/89/60/76/1131896076.db2.gz UFDQCKFAKSRBPJ-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC2(CCC2)C1 ZINC000348194884 1131896083 /nfs/dbraw/zinc/89/60/83/1131896083.db2.gz UFDQCKFAKSRBPJ-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@@H]1O ZINC001141722574 1132239523 /nfs/dbraw/zinc/23/95/23/1132239523.db2.gz DJYUKWPQOBGLPU-XOBRGWDASA-N 1 1 291.394 3.806 20 5 CHBDMO CCC[N@@H+](CC)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907446 1132350362 /nfs/dbraw/zinc/35/03/62/1132350362.db2.gz DUKLOTRNUIQZNI-OAHLLOKOSA-N 1 1 276.380 3.574 20 5 CHBDMO CC[C@@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172913017 1132371854 /nfs/dbraw/zinc/37/18/54/1132371854.db2.gz OGTPLPJZIRFFDK-CJNGLKHVSA-N 1 1 288.391 3.574 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC001173226044 1132412565 /nfs/dbraw/zinc/41/25/65/1132412565.db2.gz KWCVOGBIKPLOLL-AWEZNQCLSA-N 1 1 296.370 3.584 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)[C@H]1C ZINC001173227892 1132412637 /nfs/dbraw/zinc/41/26/37/1132412637.db2.gz SHVXPKZHKMITSG-HZSPNIEDSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccsc1 ZINC001173233728 1132413574 /nfs/dbraw/zinc/41/35/74/1132413574.db2.gz MSTYIOOFCUXUNV-LBPRGKRZSA-N 1 1 290.388 3.719 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001173233718 1132413691 /nfs/dbraw/zinc/41/36/91/1132413691.db2.gz MLBDIBLCQIOCAQ-UNEWFSDZSA-N 1 1 288.391 3.790 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H]1CC1(C)C ZINC001173231264 1132414000 /nfs/dbraw/zinc/41/40/00/1132414000.db2.gz AGJJWIOABFKCSH-OCCSQVGLSA-N 1 1 276.380 3.504 20 5 CHBDMO CC[C@H]1CCC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173235809 1132414981 /nfs/dbraw/zinc/41/49/81/1132414981.db2.gz ZNDHNLDBGBKYGL-KBPBESRZSA-N 1 1 276.380 3.648 20 5 CHBDMO CC[C@@H]1CCC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173235818 1132415230 /nfs/dbraw/zinc/41/52/30/1132415230.db2.gz ZNDHNLDBGBKYGL-ZIAGYGMSSA-N 1 1 276.380 3.648 20 5 CHBDMO Nc1ccc2cc3ccc(NC4=C[NH2+]CCC4)cc3nc2c1 ZINC001159700790 1132893733 /nfs/dbraw/zinc/89/37/33/1132893733.db2.gz SNHULVKRFFUGED-UHFFFAOYSA-N 1 1 290.370 3.607 20 5 CHBDMO CC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)CC(C)C ZINC001204881725 1133495483 /nfs/dbraw/zinc/49/54/83/1133495483.db2.gz SMYRMDRBODALJG-ZROIWOOFSA-N 1 1 276.380 3.976 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1Nc1ccc2c[nH+]ccc2c1 ZINC001210444097 1134215332 /nfs/dbraw/zinc/21/53/32/1134215332.db2.gz DYCAGWNDYIIJLW-UHFFFAOYSA-N 1 1 295.298 3.895 20 5 CHBDMO C[N@H+]1CC[C@@H](OCc2c3ccccc3nc3ccccc32)C1 ZINC001223333019 1135329966 /nfs/dbraw/zinc/32/99/66/1135329966.db2.gz YBJABJSECNYJMW-CQSZACIVSA-N 1 1 292.382 3.609 20 5 CHBDMO C[N@H+]1CC[C@H](OCc2c3ccccc3nc3ccccc32)C1 ZINC001223333017 1135330032 /nfs/dbraw/zinc/33/00/32/1135330032.db2.gz YBJABJSECNYJMW-AWEZNQCLSA-N 1 1 292.382 3.609 20 5 CHBDMO CC(C)[N@H+]1CCC[C@@H](O[C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001224024712 1135411755 /nfs/dbraw/zinc/41/17/55/1135411755.db2.gz KTKVZOWWGQXVPR-CZUORRHYSA-N 1 1 292.379 3.545 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCCCCF)C2CC2)c1 ZINC000341879268 130105530 /nfs/dbraw/zinc/10/55/30/130105530.db2.gz WOVWSYIXJYNFEF-UHFFFAOYSA-N 1 1 280.343 3.699 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000035140408 172008275 /nfs/dbraw/zinc/00/82/75/172008275.db2.gz IKGVWSFUTIZWCN-GHMZBOCLSA-N 1 1 260.293 3.600 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000035738494 172391320 /nfs/dbraw/zinc/39/13/20/172391320.db2.gz ZOBZJSRJXXTNPU-QWRGUYRKSA-N 1 1 260.293 3.600 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCc3ccccc3C2)cs1 ZINC000171595195 335072142 /nfs/dbraw/zinc/07/21/42/335072142.db2.gz OGIREXHCUCTVNK-UHFFFAOYSA-N 1 1 288.372 3.605 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCc3ccccc3C2)cs1 ZINC000171595195 335072143 /nfs/dbraw/zinc/07/21/43/335072143.db2.gz OGIREXHCUCTVNK-UHFFFAOYSA-N 1 1 288.372 3.605 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426766151 260213956 /nfs/dbraw/zinc/21/39/56/260213956.db2.gz XGDXLKBVGJBSCW-AEGPPILISA-N 1 1 274.364 3.778 20 5 CHBDMO CC[N@@H+](Cc1cccs1)Cc1cccc([N+](=O)[O-])c1C ZINC000501492713 262185594 /nfs/dbraw/zinc/18/55/94/262185594.db2.gz WCHXUCLUDHWJSI-UHFFFAOYSA-N 1 1 290.388 3.987 20 5 CHBDMO CC(C)[N@H+](Cc1ccco1)Cc1ccccc1[N+](=O)[O-] ZINC000299327119 263239609 /nfs/dbraw/zinc/23/96/09/263239609.db2.gz BITKIOWAAGKOHN-UHFFFAOYSA-N 1 1 274.320 3.598 20 5 CHBDMO CC(C)[N@@H+](Cc1ccco1)Cc1ccccc1[N+](=O)[O-] ZINC000299327119 263239610 /nfs/dbraw/zinc/23/96/10/263239610.db2.gz BITKIOWAAGKOHN-UHFFFAOYSA-N 1 1 274.320 3.598 20 5 CHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C(C)C ZINC000571466209 328123720 /nfs/dbraw/zinc/12/37/20/328123720.db2.gz PELDTINSKZOWSB-UHFFFAOYSA-N 1 1 290.285 3.844 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000559418267 327244472 /nfs/dbraw/zinc/24/44/72/327244472.db2.gz PQXHUHAVCRLIRI-JSGCOSHPSA-N 1 1 274.364 3.778 20 5 CHBDMO O=[N+]([O-])c1ccc(CCNc2cc[nH+]c3ccsc32)cc1 ZINC000462785531 331328960 /nfs/dbraw/zinc/32/89/60/331328960.db2.gz OVUZRPJIARZNNI-UHFFFAOYSA-N 1 1 299.355 3.859 20 5 CHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])CC(C)(C)C ZINC000463366168 331346631 /nfs/dbraw/zinc/34/66/31/331346631.db2.gz IYBRLBPDAXDGFS-UHFFFAOYSA-N 1 1 268.332 3.602 20 5 CHBDMO CCC[C@H]1[C@H](C)CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000464743416 331365787 /nfs/dbraw/zinc/36/57/87/331365787.db2.gz YJGBKONLDFYXLW-HIFRSBDPSA-N 1 1 276.380 3.995 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC(C)(C)C1 ZINC000464795533 331368797 /nfs/dbraw/zinc/36/87/97/331368797.db2.gz QPDMMWLVJUSORU-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000464857373 331371376 /nfs/dbraw/zinc/37/13/76/331371376.db2.gz NHIIUTMSBMLPQP-GFCCVEGCSA-N 1 1 296.436 3.867 20 5 CHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000488402929 332004347 /nfs/dbraw/zinc/00/43/47/332004347.db2.gz KTFZIIKVUCQOLE-CQSZACIVSA-N 1 1 276.380 3.995 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCC(F)(F)F ZINC000489135639 332042309 /nfs/dbraw/zinc/04/23/09/332042309.db2.gz HNXIATWHSNMTJB-JTQLQIEISA-N 1 1 290.285 3.848 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000489138706 332042379 /nfs/dbraw/zinc/04/23/79/332042379.db2.gz ULBISHZYXHPDNF-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2sccc2C1 ZINC000489138706 332042380 /nfs/dbraw/zinc/04/23/80/332042380.db2.gz ULBISHZYXHPDNF-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO COc1cc(C[N@H+]2CCC[C@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000489198465 332043242 /nfs/dbraw/zinc/04/32/42/332043242.db2.gz RARDSKBCXVMERC-HNNXBMFYSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489228744 332043723 /nfs/dbraw/zinc/04/37/23/332043723.db2.gz XAWCAEGLPCFWAU-DGCLKSJQSA-N 1 1 264.369 3.942 20 5 CHBDMO COc1cc(C[N@H+]2C[C@@H](C)CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000490029444 332077568 /nfs/dbraw/zinc/07/75/68/332077568.db2.gz KIMCXNCUPXRCHA-QWHCGFSZSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490043090 332078176 /nfs/dbraw/zinc/07/81/76/332078176.db2.gz XSXMLYSVEGGBSF-MRXNPFEDSA-N 1 1 292.379 3.616 20 5 CHBDMO CC[C@@H]1C[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCS1 ZINC000490088537 332080734 /nfs/dbraw/zinc/08/07/34/332080734.db2.gz OWZRDLMMELKVNA-GXTWGEPZSA-N 1 1 294.420 3.792 20 5 CHBDMO CC[C@@H]1C[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CCS1 ZINC000490088540 332080892 /nfs/dbraw/zinc/08/08/92/332080892.db2.gz OWZRDLMMELKVNA-TZMCWYRMSA-N 1 1 294.420 3.792 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C)CC2)ccc1[N+](=O)[O-] ZINC000492416511 332396542 /nfs/dbraw/zinc/39/65/42/332396542.db2.gz KPTOHWIIQWJUAW-CYBMUJFWSA-N 1 1 292.379 3.616 20 5 CHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000307832480 333017673 /nfs/dbraw/zinc/01/76/73/333017673.db2.gz LOIHFRQYOBIGTQ-LBPRGKRZSA-N 1 1 280.343 3.602 20 5 CHBDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000513689859 333032468 /nfs/dbraw/zinc/03/24/68/333032468.db2.gz GAICOPGQLGMNAJ-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC(C)C ZINC000521818351 333189652 /nfs/dbraw/zinc/18/96/52/333189652.db2.gz YBBRSGOGDVISOA-UHFFFAOYSA-N 1 1 264.369 3.771 20 5 CHBDMO CCC(CC)[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)C1CC1 ZINC000522057111 333232319 /nfs/dbraw/zinc/23/23/19/333232319.db2.gz NKYPOHHXKFUKON-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000524811130 333388977 /nfs/dbraw/zinc/38/89/77/333388977.db2.gz AHTCGYFVQFODLB-CZUORRHYSA-N 1 1 276.380 3.995 20 5 CHBDMO CCC[C@@H]([NH2+]Cc1cnc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000397901195 333430235 /nfs/dbraw/zinc/43/02/35/333430235.db2.gz SMLTUWPMOSSLLQ-OAHLLOKOSA-N 1 1 289.335 3.522 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2ccsc2C1 ZINC000132850822 334007963 /nfs/dbraw/zinc/00/79/63/334007963.db2.gz GRHAGJJRZSYYEW-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccsc2C1 ZINC000132850822 334007964 /nfs/dbraw/zinc/00/79/64/334007964.db2.gz GRHAGJJRZSYYEW-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H](C[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000551012152 334236368 /nfs/dbraw/zinc/23/63/68/334236368.db2.gz LZURDPIZHNJOLG-OAHLLOKOSA-N 1 1 298.386 3.873 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000576392592 335197631 /nfs/dbraw/zinc/19/76/31/335197631.db2.gz SCUTUDVEYGPBDG-ZNNBYXKUSA-N 1 1 298.386 3.873 20 5 CHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000195670009 336057978 /nfs/dbraw/zinc/05/79/78/336057978.db2.gz OKKHOSUIYOCYDE-CZUORRHYSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000195670008 336058189 /nfs/dbraw/zinc/05/81/89/336058189.db2.gz OKKHOSUIYOCYDE-BBRMVZONSA-N 1 1 276.380 3.648 20 5 CHBDMO CO[C@]1(C)CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000280647278 521753083 /nfs/dbraw/zinc/75/30/83/521753083.db2.gz YUNRUGJUBYLTHQ-XJKSGUPXSA-N 1 1 292.379 3.547 20 5 CHBDMO CC[C@H]([NH2+]Cc1nc(C)cs1)c1cccc([N+](=O)[O-])c1 ZINC000038090914 522669138 /nfs/dbraw/zinc/66/91/38/522669138.db2.gz KAMOWKCVQUKZKT-ZDUSSCGKSA-N 1 1 291.376 3.601 20 5 CHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000339919922 524300643 /nfs/dbraw/zinc/30/06/43/524300643.db2.gz DSCAZKPFLONZNO-ZYHUDNBSSA-N 1 1 268.382 3.667 20 5 CHBDMO Cc1cccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1F ZINC000295367924 524436525 /nfs/dbraw/zinc/43/65/25/524436525.db2.gz JQHMMMQGEJUREZ-LBPRGKRZSA-N 1 1 288.322 3.893 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289647962 526118683 /nfs/dbraw/zinc/11/86/83/526118683.db2.gz DPNWYLLAMMMXHU-GHMZBOCLSA-N 1 1 284.306 3.633 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\CNc1cccc(C2CC2)[nH+]1 ZINC000339428092 527398121 /nfs/dbraw/zinc/39/81/21/527398121.db2.gz JILJSDCKAXLAST-XQRVVYSFSA-N 1 1 295.342 3.993 20 5 CHBDMO CC(C)c1ccc(C[N@H+](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000350387455 528093341 /nfs/dbraw/zinc/09/33/41/528093341.db2.gz DPODYKQUGOTMBH-UHFFFAOYSA-N 1 1 299.374 3.745 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000350387455 528093346 /nfs/dbraw/zinc/09/33/46/528093346.db2.gz DPODYKQUGOTMBH-UHFFFAOYSA-N 1 1 299.374 3.745 20 5 CHBDMO CCS[C@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000353611235 529225327 /nfs/dbraw/zinc/22/53/27/529225327.db2.gz YEQYOQKPFKENDO-HNNXBMFYSA-N 1 1 294.420 3.702 20 5 CHBDMO CC[C@@H](c1ccccc1)[N@@H+](CC)Cc1cccnc1[N+](=O)[O-] ZINC000885969345 1125631566 /nfs/dbraw/zinc/63/15/66/1125631566.db2.gz PHEZCNDGNYBXHA-INIZCTEOSA-N 1 1 299.374 3.963 20 5 CHBDMO CC(C)CCC(N)=[NH+]OCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000734834222 1129324643 /nfs/dbraw/zinc/32/46/43/1129324643.db2.gz HSSJISYSYDBHFX-UHFFFAOYSA-N 1 1 299.758 3.683 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1F ZINC000338014146 1126710619 /nfs/dbraw/zinc/71/06/19/1126710619.db2.gz ROCZXXQTJKCXIU-GHMZBOCLSA-N 1 1 289.310 3.541 20 5 CHBDMO CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC1CCC1 ZINC000483130628 1126769140 /nfs/dbraw/zinc/76/91/40/1126769140.db2.gz OPWHHNZJEYKTOB-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO CC(C)CCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000571779775 1127177202 /nfs/dbraw/zinc/17/72/02/1127177202.db2.gz YHLLDUNXIHETAV-UHFFFAOYSA-N 1 1 264.369 3.505 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)cs1 ZINC000353897341 1127276675 /nfs/dbraw/zinc/27/66/75/1127276675.db2.gz HXLTZPFZBDMKHE-HNNXBMFYSA-N 1 1 292.404 3.979 20 5 CHBDMO C[N@@H+](CCC(C)(C)C)Cc1csc([N+](=O)[O-])c1 ZINC000592145427 1127338986 /nfs/dbraw/zinc/33/89/86/1127338986.db2.gz ZOFCIFAYLQQAOD-UHFFFAOYSA-N 1 1 256.371 3.524 20 5 CHBDMO Cc1noc(C[NH+]2CCC(CCC(C)C)CC2)c1[N+](=O)[O-] ZINC000595343801 1127458945 /nfs/dbraw/zinc/45/89/45/1127458945.db2.gz JWNGEXCBJDWCRC-UHFFFAOYSA-N 1 1 295.383 3.539 20 5 CHBDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000060562502 1127544411 /nfs/dbraw/zinc/54/44/11/1127544411.db2.gz FTASCVBBXDRLPF-OLZOCXBDSA-N 1 1 276.380 3.994 20 5 CHBDMO CCCCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C(C)C ZINC000603845649 1127676146 /nfs/dbraw/zinc/67/61/46/1127676146.db2.gz DXNCMBIANJCIMX-UHFFFAOYSA-N 1 1 264.369 3.995 20 5 CHBDMO CCCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000603849965 1127676682 /nfs/dbraw/zinc/67/66/82/1127676682.db2.gz ZXLDVWMCBUACMK-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC(F)(F)CC1 ZINC000599551896 1127679474 /nfs/dbraw/zinc/67/94/74/1127679474.db2.gz UENAPYBPBNHYDC-LLVKDONJSA-N 1 1 284.306 3.777 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](C2CC2)C2CCCCC2)cc1 ZINC000603875064 1127679960 /nfs/dbraw/zinc/67/99/60/1127679960.db2.gz ZMCGMWDQAYEPPG-UHFFFAOYSA-N 1 1 288.391 3.934 20 5 CHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H](C)C(C)C ZINC000604475236 1127706504 /nfs/dbraw/zinc/70/65/04/1127706504.db2.gz QXUQJPUMGJYNQM-CQSZACIVSA-N 1 1 294.395 3.730 20 5 CHBDMO CC(C)(C)C1=CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000533957637 1127778749 /nfs/dbraw/zinc/77/87/49/1127778749.db2.gz CUHRVJSPSKHBMK-UHFFFAOYSA-N 1 1 274.364 3.773 20 5 CHBDMO Cc1ccc(C[N@H+]2C[C@H](C)CC[C@@H]2C)cc1[N+](=O)[O-] ZINC000539824828 1127941300 /nfs/dbraw/zinc/94/13/00/1127941300.db2.gz LGHUFINXMASNRK-YPMHNXCESA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000466903938 1127949483 /nfs/dbraw/zinc/94/94/83/1127949483.db2.gz BALZSDCOPXRKLB-RISCZKNCSA-N 1 1 262.353 3.524 20 5 CHBDMO CCc1ccc([C@@H]([NH2+]C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544362052 1127969918 /nfs/dbraw/zinc/96/99/18/1127969918.db2.gz FQSWSSGHPOTFDI-INIZCTEOSA-N 1 1 286.331 3.592 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@H](C)C1 ZINC000468257581 1127999626 /nfs/dbraw/zinc/99/96/26/1127999626.db2.gz SUNANIUJYJEGTC-STQMWFEESA-N 1 1 262.353 3.778 20 5 CHBDMO CS[C@@H]1CCCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468258100 1128000157 /nfs/dbraw/zinc/00/01/57/1128000157.db2.gz AVGHYVXOISAXKT-CHWSQXEVSA-N 1 1 294.420 3.873 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1cc(C)cc[nH+]1 ZINC000468628357 1128014572 /nfs/dbraw/zinc/01/45/72/1128014572.db2.gz DNXZMPLCZFEHLP-MDWZMJQESA-N 1 1 283.331 3.814 20 5 CHBDMO C[C@@H]1c2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000542134540 1128052750 /nfs/dbraw/zinc/05/27/50/1128052750.db2.gz RPKOFTOHSYLYQC-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO CC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC000470170767 1128063907 /nfs/dbraw/zinc/06/39/07/1128063907.db2.gz ADDAQDMDIZXACR-LCYFTJDESA-N 1 1 274.364 3.730 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccco1 ZINC000470175315 1128064562 /nfs/dbraw/zinc/06/45/62/1128064562.db2.gz PWJROLPYXWBNJE-LCYFTJDESA-N 1 1 286.331 3.723 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC=C(C)CC1 ZINC000470181800 1128064809 /nfs/dbraw/zinc/06/48/09/1128064809.db2.gz HBJXEWVPSMQCIK-UVTDQMKNSA-N 1 1 272.348 3.650 20 5 CHBDMO CCC(C)(C)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000471023208 1128085281 /nfs/dbraw/zinc/08/52/81/1128085281.db2.gz SXWHSQOCQWGGMO-UHFFFAOYSA-N 1 1 270.760 3.869 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](CC)C2)ccc1[N+](=O)[O-] ZINC000492542637 1128102207 /nfs/dbraw/zinc/10/22/07/1128102207.db2.gz XGEUFIOKWUQPGQ-CYBMUJFWSA-N 1 1 292.379 3.616 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@@H](C)CC2(C)C)ccc1[N+](=O)[O-] ZINC000492789869 1128113135 /nfs/dbraw/zinc/11/31/35/1128113135.db2.gz NRBANUSMXIWSAQ-LBPRGKRZSA-N 1 1 292.379 3.614 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1C(C)(C)C ZINC000609195399 1128170938 /nfs/dbraw/zinc/17/09/38/1128170938.db2.gz DTSZDPVPVXXFFH-OAHLLOKOSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000609204311 1128173306 /nfs/dbraw/zinc/17/33/06/1128173306.db2.gz FTASCVBBXDRLPF-QWHCGFSZSA-N 1 1 276.380 3.994 20 5 CHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000915685329 1128333977 /nfs/dbraw/zinc/33/39/77/1128333977.db2.gz VEFPDVRKNMDXGB-FZMZJTMJSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccccc2[N+](=O)[O-])C1 ZINC000301119365 1128390715 /nfs/dbraw/zinc/39/07/15/1128390715.db2.gz VTDDAXNEUALYSM-CQSZACIVSA-N 1 1 291.395 3.519 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000916369079 1128417609 /nfs/dbraw/zinc/41/76/09/1128417609.db2.gz KXGAAPDLFYTUAY-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO CC(C)C[N@H+](Cc1ccccn1)Cc1ccccc1[N+](=O)[O-] ZINC000932443310 1128410018 /nfs/dbraw/zinc/41/00/18/1128410018.db2.gz QAYMKTVGPKDPFM-UHFFFAOYSA-N 1 1 299.374 3.648 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccccn1)Cc1ccccc1[N+](=O)[O-] ZINC000932443310 1128410020 /nfs/dbraw/zinc/41/00/20/1128410020.db2.gz QAYMKTVGPKDPFM-UHFFFAOYSA-N 1 1 299.374 3.648 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cncs1 ZINC000934196101 1128454871 /nfs/dbraw/zinc/45/48/71/1128454871.db2.gz NSTQMSFUEUVCMO-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)O[NH+]=C(N)C1CCCC1 ZINC000778592282 1128565479 /nfs/dbraw/zinc/56/54/79/1128565479.db2.gz YKSXJVIMVZUGOB-LLVKDONJSA-N 1 1 291.351 3.653 20 5 CHBDMO CC(C)CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000042338336 1128573450 /nfs/dbraw/zinc/57/34/50/1128573450.db2.gz UAGRMBHJNFIBGB-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCCc3ccccc3C2)cc1 ZINC000498904932 1128618787 /nfs/dbraw/zinc/61/87/87/1128618787.db2.gz LXLJOWVGUTVERK-UHFFFAOYSA-N 1 1 296.370 3.586 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000570611840 1128628368 /nfs/dbraw/zinc/62/83/68/1128628368.db2.gz ADEHSSFXVSABCO-INIZCTEOSA-N 1 1 286.375 3.668 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000578403733 1128716668 /nfs/dbraw/zinc/71/66/68/1128716668.db2.gz RXINZOYANGBZFK-GFCCVEGCSA-N 1 1 250.342 3.605 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609631874 1128721405 /nfs/dbraw/zinc/72/14/05/1128721405.db2.gz BPKRWLMLQKSMLZ-ZDUSSCGKSA-N 1 1 294.370 3.992 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000609766728 1128725179 /nfs/dbraw/zinc/72/51/79/1128725179.db2.gz JUDJGRRCFURRHG-LLVKDONJSA-N 1 1 268.382 3.668 20 5 CHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610001969 1128734036 /nfs/dbraw/zinc/73/40/36/1128734036.db2.gz PVAFRERVEVUQMX-XJKSGUPXSA-N 1 1 276.380 3.995 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000610080189 1128737858 /nfs/dbraw/zinc/73/78/58/1128737858.db2.gz WHEFJLSQFUUQMW-CQSZACIVSA-N 1 1 292.379 3.758 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000610080161 1128738240 /nfs/dbraw/zinc/73/82/40/1128738240.db2.gz KFWQRTQAMTVOHN-GFCCVEGCSA-N 1 1 268.382 3.811 20 5 CHBDMO Cc1cc(NC[C@@H](C)[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000510096002 1117882249 /nfs/dbraw/zinc/88/22/49/1117882249.db2.gz VQUJWRPEDIFWKW-ZIAGYGMSSA-N 1 1 291.395 3.578 20 5 CHBDMO COc1ccc(C[N@@H+](C)C2CCCCCC2)cc1[N+](=O)[O-] ZINC000097472612 1117895589 /nfs/dbraw/zinc/89/55/89/1117895589.db2.gz CWUFLIKSBWQJJH-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccco2)C1 ZINC000610369521 1118362565 /nfs/dbraw/zinc/36/25/65/1118362565.db2.gz KUFNWEVDXSFLNZ-OLZOCXBDSA-N 1 1 286.331 3.738 20 5 CHBDMO C[C@@H]([N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])C1(C)CC1 ZINC000255331688 1118415162 /nfs/dbraw/zinc/41/51/62/1118415162.db2.gz DSNUFLJBKYPHLY-FWPCIQOSSA-N 1 1 274.364 3.728 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccccc1 ZINC000050508414 1118505078 /nfs/dbraw/zinc/50/50/78/1118505078.db2.gz UFZOVAVFXUTPDZ-CQSZACIVSA-N 1 1 284.359 3.830 20 5 CHBDMO C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1(C)CCCC1 ZINC000510799738 1118818068 /nfs/dbraw/zinc/81/80/68/1118818068.db2.gz UIAQGOOTKYSAIQ-UHFFFAOYSA-N 1 1 284.306 3.638 20 5 CHBDMO C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1(C)CCCC1 ZINC000510799738 1118818074 /nfs/dbraw/zinc/81/80/74/1118818074.db2.gz UIAQGOOTKYSAIQ-UHFFFAOYSA-N 1 1 284.306 3.638 20 5 CHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCC1 ZINC000339005961 1119090063 /nfs/dbraw/zinc/09/00/63/1119090063.db2.gz JQAVMFBOIPNCOJ-UHFFFAOYSA-N 1 1 288.269 3.598 20 5 CHBDMO Cc1cn2cc(Nc3ccc(C)c([N+](=O)[O-])c3)ccc2[nH+]1 ZINC001213663361 1119269870 /nfs/dbraw/zinc/26/98/70/1119269870.db2.gz BNCAJEPSACEWTR-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO Cc1cc(NCC[N@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000583951887 1119438798 /nfs/dbraw/zinc/43/87/98/1119438798.db2.gz VVSWUFQBDZLLAJ-UHFFFAOYSA-N 1 1 291.395 3.580 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C)[C@H]1C ZINC000470180543 1120029084 /nfs/dbraw/zinc/02/90/84/1120029084.db2.gz OQZOPUGEGPPXTC-JKOFNFNQSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)CC[C@H]1C ZINC000542701426 1120122054 /nfs/dbraw/zinc/12/20/54/1120122054.db2.gz FDIKXQCYPQTBHL-WCQYABFASA-N 1 1 262.353 3.524 20 5 CHBDMO COc1ccc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000111158786 1120138285 /nfs/dbraw/zinc/13/82/85/1120138285.db2.gz RDWGSHXXUINQER-SNVBAGLBSA-N 1 1 292.360 3.516 20 5 CHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000542974914 1120305231 /nfs/dbraw/zinc/30/52/31/1120305231.db2.gz FWFFUPCSSBJMNE-COXVUDFISA-N 1 1 288.391 3.648 20 5 CHBDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000525636065 1120385205 /nfs/dbraw/zinc/38/52/05/1120385205.db2.gz DBJLNJRZWIYSKV-WDEREUQCSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@@H](C)C[N@@H+](CC)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000466201939 1120448681 /nfs/dbraw/zinc/44/86/81/1120448681.db2.gz KNCRIXHCPQLNIH-LLVKDONJSA-N 1 1 298.358 3.611 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1CCCC1 ZINC000107701345 1120722020 /nfs/dbraw/zinc/72/20/20/1120722020.db2.gz MYJMRNDGOZBTHL-LBPRGKRZSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(F)c1F ZINC000181989905 1121007379 /nfs/dbraw/zinc/00/73/79/1121007379.db2.gz OXNFZKFCZIUYFJ-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1c(C[N@@H+]2CCCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000512203217 1121198744 /nfs/dbraw/zinc/19/87/44/1121198744.db2.gz PFGWYKPZFZOQFS-GFCCVEGCSA-N 1 1 262.353 3.668 20 5 CHBDMO CC[C@H](Nc1cc(C)cc[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000090147302 1121205578 /nfs/dbraw/zinc/20/55/78/1121205578.db2.gz OUEVVJKIIUMHFT-AWEZNQCLSA-N 1 1 271.320 3.861 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000512224247 1121213054 /nfs/dbraw/zinc/21/30/54/1121213054.db2.gz ARUMYVDTLXJAEA-ZDUSSCGKSA-N 1 1 264.369 3.770 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000543621601 1121529293 /nfs/dbraw/zinc/52/92/93/1121529293.db2.gz VYKDXKKYXWAPDI-CQSZACIVSA-N 1 1 274.364 3.691 20 5 CHBDMO C[C@@H]1CC[C@H]([N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000433037399 1121532211 /nfs/dbraw/zinc/53/22/11/1121532211.db2.gz FACAXIAXFLZVDJ-LGVMCUBASA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC000543631498 1121539109 /nfs/dbraw/zinc/53/91/09/1121539109.db2.gz NNLZYKUZOCVZCK-CZUORRHYSA-N 1 1 274.364 3.668 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccnc1 ZINC000611191206 1121630963 /nfs/dbraw/zinc/63/09/63/1121630963.db2.gz KGQLVFTUCNHIBK-AWEZNQCLSA-N 1 1 299.374 3.615 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000611271342 1121634250 /nfs/dbraw/zinc/63/42/50/1121634250.db2.gz SNRPIEXWYVGVTP-BYPUDFOVSA-N 1 1 298.342 3.691 20 5 CHBDMO C[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccccc1[N+](=O)[O-] ZINC000619611487 1128999429 /nfs/dbraw/zinc/99/94/29/1128999429.db2.gz IXPAZOIGOPGELL-IUODEOHRSA-N 1 1 297.358 3.718 20 5 CHBDMO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000611395310 1121643854 /nfs/dbraw/zinc/64/38/54/1121643854.db2.gz MWXSGBWEDPQCHA-UWVGGRQHSA-N 1 1 291.376 3.772 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CCC(C)C ZINC000611515312 1121653747 /nfs/dbraw/zinc/65/37/47/1121653747.db2.gz FVASCICPBDVYAG-ZDUSSCGKSA-N 1 1 264.369 3.942 20 5 CHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCc2ccccc21 ZINC000611549038 1121655542 /nfs/dbraw/zinc/65/55/42/1121655542.db2.gz KVGJFCPTDAXCGL-HNNXBMFYSA-N 1 1 296.370 3.757 20 5 CHBDMO Cc1ccc(C[N@H+]2CC=CC23CCCCC3)cc1[N+](=O)[O-] ZINC001176994621 1121704937 /nfs/dbraw/zinc/70/49/37/1121704937.db2.gz AAHZGYWTOYUPRW-UHFFFAOYSA-N 1 1 286.375 3.978 20 5 CHBDMO Cc1c(C[N@H+]2CCSC(C)(C)CC2)cccc1[N+](=O)[O-] ZINC000434685646 1122394163 /nfs/dbraw/zinc/39/41/63/1122394163.db2.gz QUWAJMVCPJSZLS-UHFFFAOYSA-N 1 1 294.420 3.621 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505596649 1122432117 /nfs/dbraw/zinc/43/21/17/1122432117.db2.gz LZNQANYFDHNCGQ-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CC1CCCC1 ZINC000435418034 1122464701 /nfs/dbraw/zinc/46/47/01/1122464701.db2.gz WAKOQUQTGPKKEO-LBPRGKRZSA-N 1 1 262.353 3.778 20 5 CHBDMO CC[C@@H]1C[C@H]1C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001192079680 1122627672 /nfs/dbraw/zinc/62/76/72/1122627672.db2.gz CEEJCXXHHJZHQH-MNOVXSKESA-N 1 1 282.771 3.726 20 5 CHBDMO Cc1c(C[N@@H+]2C[C@@H](C)CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC001192500879 1122649037 /nfs/dbraw/zinc/64/90/37/1122649037.db2.gz JUXNMROKDWDXIT-LBPRGKRZSA-N 1 1 276.380 3.771 20 5 CHBDMO Cc1c(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC001192481517 1122649617 /nfs/dbraw/zinc/64/96/17/1122649617.db2.gz NCVPHPDEZOWGAS-MJEQTWJJSA-N 1 1 288.391 3.914 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC1(c2ccccc2)CC1 ZINC000438276321 1122688969 /nfs/dbraw/zinc/68/89/69/1122688969.db2.gz LAUCBUBSSCEART-UHFFFAOYSA-N 1 1 296.370 3.758 20 5 CHBDMO CCc1cccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC001193744106 1122712159 /nfs/dbraw/zinc/71/21/59/1122712159.db2.gz ZEGSZGULKVHVPV-UHFFFAOYSA-N 1 1 298.386 3.832 20 5 CHBDMO CC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000506324240 1122717818 /nfs/dbraw/zinc/71/78/18/1122717818.db2.gz CPNJSGVINWQAIB-UHFFFAOYSA-N 1 1 276.361 3.775 20 5 CHBDMO CCC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000506482093 1122752579 /nfs/dbraw/zinc/75/25/79/1122752579.db2.gz RWHWRKUWJRJNDW-UHFFFAOYSA-N 1 1 274.320 3.697 20 5 CHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000506622156 1122792921 /nfs/dbraw/zinc/79/29/21/1122792921.db2.gz ALLNFCKXAVMBPQ-GFCCVEGCSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@H](C)[C@H]1C ZINC001195277910 1122859656 /nfs/dbraw/zinc/85/96/56/1122859656.db2.gz HDJRJOXALBBZSU-YVECIDJPSA-N 1 1 262.353 3.632 20 5 CHBDMO COc1cc(C[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])cc1F ZINC000184233887 1122880162 /nfs/dbraw/zinc/88/01/62/1122880162.db2.gz WRYCYEIZHGMWCX-UHFFFAOYSA-N 1 1 296.342 3.507 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507020287 1122919547 /nfs/dbraw/zinc/91/95/47/1122919547.db2.gz HHMQZBAGYQPYBH-PGJNLMOESA-N 1 1 262.353 3.728 20 5 CHBDMO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000507221545 1122939834 /nfs/dbraw/zinc/93/98/34/1122939834.db2.gz LCFWDZQNIDUCEL-UHFFFAOYSA-N 1 1 286.331 3.839 20 5 CHBDMO C[N@@H+](CCC1CCCCC1)Cc1cccc([N+](=O)[O-])c1 ZINC000507614665 1122977118 /nfs/dbraw/zinc/97/71/18/1122977118.db2.gz IMNVFHZMVCCMQP-UHFFFAOYSA-N 1 1 276.380 3.997 20 5 CHBDMO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000081599885 1122986339 /nfs/dbraw/zinc/98/63/39/1122986339.db2.gz WVXPZIXCAHCBGT-GFCCVEGCSA-N 1 1 290.388 3.719 20 5 CHBDMO CC(C)c1[nH+]ccn1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037403914 1123028414 /nfs/dbraw/zinc/02/84/14/1123028414.db2.gz BYRTYIFUDSJUSV-UHFFFAOYSA-N 1 1 279.727 3.616 20 5 CHBDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520590532 1123180770 /nfs/dbraw/zinc/18/07/70/1123180770.db2.gz LIGHQTXNIJNEPO-STQMWFEESA-N 1 1 276.380 3.994 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)nc1)c1ccccc1[N+](=O)[O-] ZINC000930235902 1123403742 /nfs/dbraw/zinc/40/37/42/1123403742.db2.gz RSLGJYDHLPKERZ-WDEREUQCSA-N 1 1 289.310 3.541 20 5 CHBDMO CCc1ccc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000866541319 1124079976 /nfs/dbraw/zinc/07/99/76/1124079976.db2.gz YCUNIUKKUBBWTE-LBPRGKRZSA-N 1 1 288.347 3.909 20 5 CHBDMO Cc1cc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)oc1C ZINC000866539954 1124080503 /nfs/dbraw/zinc/08/05/03/1124080503.db2.gz IFHJITCEEJYFMO-GFCCVEGCSA-N 1 1 288.347 3.964 20 5 CHBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C1CCCC1 ZINC000184246078 1129178875 /nfs/dbraw/zinc/17/88/75/1129178875.db2.gz MJUSFDHUSNYZFM-UHFFFAOYSA-N 1 1 296.342 3.507 20 5 CHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H]3C3CC3)o2)c1 ZINC000449423986 1124733001 /nfs/dbraw/zinc/73/30/01/1124733001.db2.gz ITUJLGZWKNIMLX-INIZCTEOSA-N 1 1 298.342 3.839 20 5 CHBDMO Cc1cncc([C@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000879748374 1125230146 /nfs/dbraw/zinc/23/01/46/1125230146.db2.gz ICWLMFRAYJEEBT-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1cncc([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000879748374 1125230150 /nfs/dbraw/zinc/23/01/50/1125230150.db2.gz ICWLMFRAYJEEBT-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000532072998 1125233154 /nfs/dbraw/zinc/23/31/54/1125233154.db2.gz WOHXTWVWGDAMRA-ZDUSSCGKSA-N 1 1 292.379 3.616 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000734152218 1129296099 /nfs/dbraw/zinc/29/60/99/1129296099.db2.gz HLTFWLKLIKNNIA-CYBMUJFWSA-N 1 1 294.370 3.992 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774419 1129451719 /nfs/dbraw/zinc/45/17/19/1129451719.db2.gz LZQLVSWEYUFZCE-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2C2CCCC2)cc1F ZINC000094774714 1129452052 /nfs/dbraw/zinc/45/20/52/1129452052.db2.gz PESPLRKUUBAJEX-OAHLLOKOSA-N 1 1 292.354 3.889 20 5 CHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000741795664 1129453951 /nfs/dbraw/zinc/45/39/51/1129453951.db2.gz QKBHONMNCFYQCU-NWDGAFQWSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169012543 1129689911 /nfs/dbraw/zinc/68/99/11/1129689911.db2.gz QXBXTIXSMMUYRF-VYDXJSESSA-N 1 1 288.391 3.577 20 5 CHBDMO Cc1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169025016 1129691213 /nfs/dbraw/zinc/69/12/13/1129691213.db2.gz ILURVVJBSNOLED-PVAVHDDUSA-N 1 1 288.391 3.577 20 5 CHBDMO C[N@@H+](Cc1ccc2ccccc2c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046787 1129691424 /nfs/dbraw/zinc/69/14/24/1129691424.db2.gz NANWOJCGYNPXLE-QAPCUYQASA-N 1 1 298.386 3.717 20 5 CHBDMO CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169048721 1129692152 /nfs/dbraw/zinc/69/21/52/1129692152.db2.gz AXLMVPHBFVVJNI-YQQAZPJKSA-N 1 1 290.407 3.903 20 5 CHBDMO Cc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169055866 1129693157 /nfs/dbraw/zinc/69/31/57/1129693157.db2.gz QXBXTIXSMMUYRF-BFYDXBDKSA-N 1 1 288.391 3.577 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C(C1CC1)C1CC1 ZINC000768540908 1129860764 /nfs/dbraw/zinc/86/07/64/1129860764.db2.gz BGMMFOREYSBMKO-UHFFFAOYSA-N 1 1 294.782 3.869 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000746667096 1130143455 /nfs/dbraw/zinc/14/34/55/1130143455.db2.gz VOJOANQTTLLEFU-CYBMUJFWSA-N 1 1 280.755 3.623 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000903288596 1130146594 /nfs/dbraw/zinc/14/65/94/1130146594.db2.gz ZYIUHVNBBXQEBX-MNOVXSKESA-N 1 1 289.310 3.541 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788480515 1130189758 /nfs/dbraw/zinc/18/97/58/1130189758.db2.gz KXKCNHWOGPDNFW-ZLDLUXBVSA-N 1 1 292.354 3.887 20 5 CHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1C=CCCCCC1 ZINC001170192572 1130457422 /nfs/dbraw/zinc/45/74/22/1130457422.db2.gz AFXSKHSYSFXIFI-MRXNPFEDSA-N 1 1 288.391 3.958 20 5 CHBDMO Cc1cc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(C)o1 ZINC000813791692 1130784626 /nfs/dbraw/zinc/78/46/26/1130784626.db2.gz HRNRLPUIBZTOCU-UHFFFAOYSA-N 1 1 288.347 3.830 20 5 CHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678029 1130846789 /nfs/dbraw/zinc/84/67/89/1130846789.db2.gz BCZSWMOMLCIVPU-GXFFZTMASA-N 1 1 282.771 3.869 20 5 CHBDMO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000784388953 1130902991 /nfs/dbraw/zinc/90/29/91/1130902991.db2.gz BDELDNHFWATTCO-LBPRGKRZSA-N 1 1 278.327 3.522 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2C[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000816646778 1131118629 /nfs/dbraw/zinc/11/86/29/1131118629.db2.gz IYCGQDQGAPHAPP-VXGBXAGGSA-N 1 1 262.353 3.558 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001170845410 1131128728 /nfs/dbraw/zinc/12/87/28/1131128728.db2.gz BEMJHWDJYILJKV-ZDUSSCGKSA-N 1 1 264.369 3.914 20 5 CHBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001171087147 1131510162 /nfs/dbraw/zinc/51/01/62/1131510162.db2.gz MJCUSOMBAQSOIT-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844436101 1131563364 /nfs/dbraw/zinc/56/33/64/1131563364.db2.gz GQIKIGALNHFCQW-BXUZGUMPSA-N 1 1 296.317 3.777 20 5 CHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000037097275 1131994399 /nfs/dbraw/zinc/99/43/99/1131994399.db2.gz UUVHUZKKRJDHMT-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037173074 1132007143 /nfs/dbraw/zinc/00/71/43/1132007143.db2.gz AOPWGAMCQLBOTG-SNVBAGLBSA-N 1 1 270.760 3.726 20 5 CHBDMO CCCCC[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907907 1132349467 /nfs/dbraw/zinc/34/94/67/1132349467.db2.gz JLIISUXECSAGIK-MRXNPFEDSA-N 1 1 290.407 3.964 20 5 CHBDMO OC1C[NH+](Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC001231826730 1132374820 /nfs/dbraw/zinc/37/48/20/1132374820.db2.gz IOGSGFFRZGKVLS-UHFFFAOYSA-N 1 1 297.785 3.823 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C(F)F)C1 ZINC001173225681 1132412641 /nfs/dbraw/zinc/41/26/41/1132412641.db2.gz FISJPSFCCSNFIS-AAEUAGOBSA-N 1 1 298.333 3.503 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)[C@@H]1C ZINC001173227905 1132412688 /nfs/dbraw/zinc/41/26/88/1132412688.db2.gz SHVXPKZHKMITSG-RDBSUJKOSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@@H]1CCC[N@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232219883 1132438734 /nfs/dbraw/zinc/43/87/34/1132438734.db2.gz VNHKOZNOQJKORR-CYBMUJFWSA-N 1 1 277.371 3.767 20 5 CHBDMO CC(C)(C)C(=[NH2+])Nc1nccc2cc([N+](=O)[O-])ccc21 ZINC001155181827 1132646902 /nfs/dbraw/zinc/64/69/02/1132646902.db2.gz SMDHPKNPDBLHMI-UHFFFAOYSA-N 1 1 272.308 3.578 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](C2CCC2)C1 ZINC001174705306 1132960585 /nfs/dbraw/zinc/96/05/85/1132960585.db2.gz UFXRJWYAHLKHSB-AWEZNQCLSA-N 1 1 274.364 3.607 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H](C)[N@H+]2CCCC[C@H]2C)c1 ZINC001162152894 1133055234 /nfs/dbraw/zinc/05/52/34/1133055234.db2.gz JKJVHHQQVCEHAL-KGLIPLIRSA-N 1 1 291.395 3.578 20 5 CHBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000176444837 1134470077 /nfs/dbraw/zinc/47/00/77/1134470077.db2.gz VTFXQNQCNDTBBF-JTQLQIEISA-N 1 1 296.417 3.781 20 5 CHBDMO Cc1ccc(Nc2c(C)cc[nH+]c2C)cc1[N+](=O)[O-] ZINC001213661931 1134474760 /nfs/dbraw/zinc/47/47/60/1134474760.db2.gz XWCSOONVJXWFRG-UHFFFAOYSA-N 1 1 257.293 3.659 20 5 CHBDMO C[NH+]1CC(OCc2c3ccccc3cc3ccccc32)C1 ZINC001223148578 1135310230 /nfs/dbraw/zinc/31/02/30/1135310230.db2.gz BCWUXZXOIQUXTI-UHFFFAOYSA-N 1 1 277.367 3.824 20 5 CHBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000519968917 260035390 /nfs/dbraw/zinc/03/53/90/260035390.db2.gz VXLRSALXGJSINS-TZMCWYRMSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCCCCF)C2CC2)cc1 ZINC000341913955 130127137 /nfs/dbraw/zinc/12/71/37/130127137.db2.gz YATNIXKCSKNZQS-UHFFFAOYSA-N 1 1 280.343 3.699 20 5 CHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000342071541 130235839 /nfs/dbraw/zinc/23/58/39/130235839.db2.gz NFJYRFYTBYVULO-AOOOYVTPSA-N 1 1 268.744 3.621 20 5 CHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353878478 228161807 /nfs/dbraw/zinc/16/18/07/228161807.db2.gz DEXKCVKVDVTXOY-QWRGUYRKSA-N 1 1 268.382 3.667 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426773465 260351684 /nfs/dbraw/zinc/35/16/84/260351684.db2.gz JUAKLAKNOVVOIS-MELADBBJSA-N 1 1 274.364 3.778 20 5 CHBDMO Cc1nc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)sc1C ZINC000153941444 261085690 /nfs/dbraw/zinc/08/56/90/261085690.db2.gz PXDSKNXONMKEAB-JTQLQIEISA-N 1 1 291.376 3.519 20 5 CHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359293513 266560843 /nfs/dbraw/zinc/56/08/43/266560843.db2.gz FPFTUFGXWWVTIJ-CJNGLKHVSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@H](C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000534513142 328305069 /nfs/dbraw/zinc/30/50/69/328305069.db2.gz KKHLUWKPFFWFEL-CQSZACIVSA-N 1 1 296.370 3.757 20 5 CHBDMO CC(C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000111173015 328332538 /nfs/dbraw/zinc/33/25/38/328332538.db2.gz RTUMVTGGLYJBLN-UHFFFAOYSA-N 1 1 292.379 3.627 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc2C1 ZINC000303512433 328352759 /nfs/dbraw/zinc/35/27/59/328352759.db2.gz BOKDKNRIWOCWDL-GOSISDBHSA-N 1 1 296.370 3.584 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000569533794 327194589 /nfs/dbraw/zinc/19/45/89/327194589.db2.gz OXWLETRKDPMYEP-LLVKDONJSA-N 1 1 298.358 3.753 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)C1CC1 ZINC000582921342 329288815 /nfs/dbraw/zinc/28/88/15/329288815.db2.gz XQKHGBKWGZUHMT-GFCCVEGCSA-N 1 1 292.379 3.612 20 5 CHBDMO CCCC[C@H](CN)[NH2+][C@@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000423301654 330188989 /nfs/dbraw/zinc/18/89/89/330188989.db2.gz UHMWYMNNSWYPOB-ZBFHGGJFSA-N 1 1 293.411 3.543 20 5 CHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCCCCF)C2)cc1 ZINC000451545544 331033442 /nfs/dbraw/zinc/03/34/42/331033442.db2.gz HRSMHMLYXWQSLI-HNNXBMFYSA-N 1 1 294.370 3.914 20 5 CHBDMO CC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)CC(C)(C)C ZINC000463357163 331346589 /nfs/dbraw/zinc/34/65/89/331346589.db2.gz HNHZCSITUAAIAO-UHFFFAOYSA-N 1 1 286.322 3.741 20 5 CHBDMO CC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)CC(C)(C)C ZINC000463357163 331346590 /nfs/dbraw/zinc/34/65/90/331346590.db2.gz HNHZCSITUAAIAO-UHFFFAOYSA-N 1 1 286.322 3.741 20 5 CHBDMO CC[N@@H+](CC(C)C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000488539016 332016130 /nfs/dbraw/zinc/01/61/30/332016130.db2.gz IAJZRKIHEIZRIJ-LBPRGKRZSA-N 1 1 250.342 3.634 20 5 CHBDMO CCC[N@@H+](CC)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489108287 332041791 /nfs/dbraw/zinc/04/17/91/332041791.db2.gz VGUHDPVIDOVSDA-LBPRGKRZSA-N 1 1 250.342 3.696 20 5 CHBDMO COc1cc(C[N@H+]2CCC[C@@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000489140074 332042529 /nfs/dbraw/zinc/04/25/29/332042529.db2.gz PFTNKWQDCYXVOG-CQSZACIVSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489228746 332043807 /nfs/dbraw/zinc/04/38/07/332043807.db2.gz XAWCAEGLPCFWAU-YPMHNXCESA-N 1 1 264.369 3.942 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490036324 332077722 /nfs/dbraw/zinc/07/77/22/332077722.db2.gz FSMAMRRILHQPGM-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000490036535 332077729 /nfs/dbraw/zinc/07/77/29/332077729.db2.gz FVJOFTXDIRHTCX-XQQFMLRXSA-N 1 1 262.353 3.552 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490551771 332091302 /nfs/dbraw/zinc/09/13/02/332091302.db2.gz ZJQKRJKTPPJZNU-XHBSWPGZSA-N 1 1 292.354 3.887 20 5 CHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)CC(C)C ZINC000311439776 333068270 /nfs/dbraw/zinc/06/82/70/333068270.db2.gz PBBXVGNINMQRGL-UHFFFAOYSA-N 1 1 268.332 3.602 20 5 CHBDMO Cc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000195674228 333260516 /nfs/dbraw/zinc/26/05/16/333260516.db2.gz YXOVTPADQQBQAY-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO Cc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000195674228 333260518 /nfs/dbraw/zinc/26/05/18/333260518.db2.gz YXOVTPADQQBQAY-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000564324907 334101186 /nfs/dbraw/zinc/10/11/86/334101186.db2.gz JIVDRTIKERMZED-TZMCWYRMSA-N 1 1 262.353 3.666 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(Cl)c2F)cc1 ZINC000135236297 334120699 /nfs/dbraw/zinc/12/06/99/334120699.db2.gz MCFLMMDONLRDTD-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO C[C@@H]1CCCCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000547931337 334129743 /nfs/dbraw/zinc/12/97/43/334129743.db2.gz JZHYRYDFUNLXLB-JKEYDSJLSA-N 1 1 274.364 3.873 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000548587380 334162999 /nfs/dbraw/zinc/16/29/99/334162999.db2.gz IWAGTLCTKPTFRV-ZDUSSCGKSA-N 1 1 262.353 3.668 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549169004 334187054 /nfs/dbraw/zinc/18/70/54/334187054.db2.gz RHAQRJOAGARZML-CQSZACIVSA-N 1 1 284.359 3.830 20 5 CHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@H]21 ZINC000550442912 334222621 /nfs/dbraw/zinc/22/26/21/334222621.db2.gz BTUXODZBHCEPIJ-CVEARBPZSA-N 1 1 288.391 3.648 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](c3ccccc3)C2)cc1 ZINC000576851281 335255974 /nfs/dbraw/zinc/25/59/74/335255974.db2.gz MLSRVJWNNAZDRR-KRWDZBQOSA-N 1 1 296.370 3.974 20 5 CHBDMO C[C@@H](CNc1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000347322337 335376137 /nfs/dbraw/zinc/37/61/37/335376137.db2.gz VETXKVNNKAKASI-AWEZNQCLSA-N 1 1 299.374 3.527 20 5 CHBDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000353665552 534074258 /nfs/dbraw/zinc/07/42/58/534074258.db2.gz LDXRQMKPCMFWGS-CYBMUJFWSA-N 1 1 282.343 3.542 20 5 CHBDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000050564681 525641488 /nfs/dbraw/zinc/64/14/88/525641488.db2.gz JKNWDXIKNWROJR-WDEREUQCSA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000036960135 525742029 /nfs/dbraw/zinc/74/20/29/525742029.db2.gz GEBKUPPVOLANAG-NWDGAFQWSA-N 1 1 274.320 3.908 20 5 CHBDMO C[C@H](c1ccco1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276346563 526147491 /nfs/dbraw/zinc/14/74/91/526147491.db2.gz VLRPDINXDGDUEM-SNVBAGLBSA-N 1 1 278.283 3.520 20 5 CHBDMO C[C@H](c1ccco1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000276346563 526147497 /nfs/dbraw/zinc/14/74/97/526147497.db2.gz VLRPDINXDGDUEM-SNVBAGLBSA-N 1 1 278.283 3.520 20 5 CHBDMO Cc1csc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000069168423 526435594 /nfs/dbraw/zinc/43/55/94/526435594.db2.gz GFOKLLCZRBXPDQ-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccncc1 ZINC000347376659 527528900 /nfs/dbraw/zinc/52/89/00/527528900.db2.gz OKFPIONJGQNEHD-GXDHUFHOSA-N 1 1 297.358 3.525 20 5 CHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)CC1CCC1 ZINC000355596510 528795353 /nfs/dbraw/zinc/79/53/53/528795353.db2.gz CVSSUGKCDXLHDG-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO CC(C)c1ccc[nH+]c1NCc1ccc([N+](=O)[O-])cc1 ZINC000341956090 535376755 /nfs/dbraw/zinc/37/67/55/535376755.db2.gz VVUKKGPGMNHSIA-UHFFFAOYSA-N 1 1 271.320 3.725 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCc3ccsc3C2)cc1[N+](=O)[O-] ZINC000127056246 1125458818 /nfs/dbraw/zinc/45/88/18/1125458818.db2.gz HWJZTWBLZLVVND-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1ccc(C[N@H+]2CCc3ccsc3C2)cc1[N+](=O)[O-] ZINC000127056246 1125458820 /nfs/dbraw/zinc/45/88/20/1125458820.db2.gz HWJZTWBLZLVVND-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO CCC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1 ZINC000037097276 1131993436 /nfs/dbraw/zinc/99/34/36/1131993436.db2.gz CPQDRLFDSCEFBM-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccccc2[N+](=O)[O-])c1 ZINC000067710843 1125706394 /nfs/dbraw/zinc/70/63/94/1125706394.db2.gz JANDCUWOAABXOQ-UHFFFAOYSA-N 1 1 299.374 3.659 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccccc1Cl ZINC000020045596 1125760605 /nfs/dbraw/zinc/76/06/05/1125760605.db2.gz FEYNEWVCHZDNMX-UHFFFAOYSA-N 1 1 276.723 3.538 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)cc1Cl ZINC000826538729 1125760124 /nfs/dbraw/zinc/76/01/24/1125760124.db2.gz IYOHQOSDWMOQNC-AAEUAGOBSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)cc1Cl ZINC000826538729 1125760132 /nfs/dbraw/zinc/76/01/32/1125760132.db2.gz IYOHQOSDWMOQNC-AAEUAGOBSA-N 1 1 280.755 3.623 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1F ZINC000338014155 1126711001 /nfs/dbraw/zinc/71/10/01/1126711001.db2.gz ROCZXXQTJKCXIU-QWRGUYRKSA-N 1 1 289.310 3.541 20 5 CHBDMO CC(C)SCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000338271758 1126729094 /nfs/dbraw/zinc/72/90/94/1126729094.db2.gz OXXHFNGFDJEQKH-UHFFFAOYSA-N 1 1 294.420 3.701 20 5 CHBDMO C[C@H]1CCCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000482314779 1126751021 /nfs/dbraw/zinc/75/10/21/1126751021.db2.gz WIIWIRSVNUCTJB-PIZKADEWSA-N 1 1 274.364 3.730 20 5 CHBDMO C[C@H]1CCCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000482314368 1126751130 /nfs/dbraw/zinc/75/11/30/1126751130.db2.gz WIIWIRSVNUCTJB-MRZGDXHCSA-N 1 1 274.364 3.730 20 5 CHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000482489462 1126761156 /nfs/dbraw/zinc/76/11/56/1126761156.db2.gz KJWJYVJZIUHWQI-XHDPSFHLSA-N 1 1 262.353 3.524 20 5 CHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC000483120474 1126767643 /nfs/dbraw/zinc/76/76/43/1126767643.db2.gz UJOPONADPYSTJY-LLVKDONJSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC1CCC1 ZINC000483124272 1126769131 /nfs/dbraw/zinc/76/91/31/1126769131.db2.gz TWSOIYSQLDIBAY-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO CC[N@@H+](CC1CCC1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000483131151 1126769179 /nfs/dbraw/zinc/76/91/79/1126769179.db2.gz YVEBBNPAEFMNOD-GFCCVEGCSA-N 1 1 262.353 3.778 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000042977997 1126866503 /nfs/dbraw/zinc/86/65/03/1126866503.db2.gz FZKXJOTYDIIXTK-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO CC[N@@H+](CC(C)C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485718684 1126946301 /nfs/dbraw/zinc/94/63/01/1126946301.db2.gz SEZATZILKRFDEC-ZDUSSCGKSA-N 1 1 264.369 3.942 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2c2ccccc2)c1 ZINC000054669777 1127086184 /nfs/dbraw/zinc/08/61/84/1127086184.db2.gz ZCVOVGXPQOBCSQ-KRWDZBQOSA-N 1 1 282.343 3.932 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000589209389 1127216336 /nfs/dbraw/zinc/21/63/36/1127216336.db2.gz KXHRHBVMMGDYNU-QQNRWZHASA-N 1 1 286.375 3.730 20 5 CHBDMO CC(C)CC[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000057627036 1127268904 /nfs/dbraw/zinc/26/89/04/1127268904.db2.gz GLSCTKVJUHOGIV-LBPRGKRZSA-N 1 1 250.342 3.634 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573046306 1127281126 /nfs/dbraw/zinc/28/11/26/1127281126.db2.gz XFKRKANPCKCJCA-GXTWGEPZSA-N 1 1 262.353 3.666 20 5 CHBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573046310 1127281436 /nfs/dbraw/zinc/28/14/36/1127281436.db2.gz XFKRKANPCKCJCA-TZMCWYRMSA-N 1 1 262.353 3.666 20 5 CHBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000166557138 1127288718 /nfs/dbraw/zinc/28/87/18/1127288718.db2.gz GIAQQCOBQCJSQC-UTUOFQBUSA-N 1 1 280.343 3.600 20 5 CHBDMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC001168400617 1127298137 /nfs/dbraw/zinc/29/81/37/1127298137.db2.gz BZSOBHUPGSWDDL-NUEKZKHPSA-N 1 1 288.391 3.914 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000355108024 1127318231 /nfs/dbraw/zinc/31/82/31/1127318231.db2.gz KBYJZIVHXZCVIQ-MNOVXSKESA-N 1 1 268.382 3.524 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC12CCCC2 ZINC000593037839 1127369476 /nfs/dbraw/zinc/36/94/76/1127369476.db2.gz FAAZCVORGOHQDF-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC12CCCC2 ZINC000593037839 1127369479 /nfs/dbraw/zinc/36/94/79/1127369479.db2.gz FAAZCVORGOHQDF-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO Cc1noc(C[N@@H+]2CCCCC[C@@H]2CC(C)C)c1[N+](=O)[O-] ZINC000595334815 1127458987 /nfs/dbraw/zinc/45/89/87/1127458987.db2.gz WBLGJIHMUGZYMN-CYBMUJFWSA-N 1 1 295.383 3.682 20 5 CHBDMO Cc1noc(C[N@H+](C)[C@@H]2CCC[C@@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595553259 1127467042 /nfs/dbraw/zinc/46/70/42/1127467042.db2.gz WKWBBUIYEFISAH-NWDGAFQWSA-N 1 1 295.383 3.538 20 5 CHBDMO Cc1noc(C[N@H+](C)[C@@H]2CCC[C@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595553261 1127467323 /nfs/dbraw/zinc/46/73/23/1127467323.db2.gz WKWBBUIYEFISAH-VXGBXAGGSA-N 1 1 295.383 3.538 20 5 CHBDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000362187305 1127617934 /nfs/dbraw/zinc/61/79/34/1127617934.db2.gz DBZJOXICYSYMHD-JQWIXIFHSA-N 1 1 296.342 3.505 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC(F)(F)CC1 ZINC000599551897 1127679751 /nfs/dbraw/zinc/67/97/51/1127679751.db2.gz UENAPYBPBNHYDC-NSHDSACASA-N 1 1 284.306 3.777 20 5 CHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])s1 ZINC000604409327 1127703346 /nfs/dbraw/zinc/70/33/46/1127703346.db2.gz ZJPWOZSOIHNDSI-LBPRGKRZSA-N 1 1 297.424 3.723 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000061779232 1127716741 /nfs/dbraw/zinc/71/67/41/1127716741.db2.gz VYTIWCHMDIUVPG-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccco2)C1 ZINC000374007186 1127870892 /nfs/dbraw/zinc/87/08/92/1127870892.db2.gz CJWZFJSKXIVTJV-OCCSQVGLSA-N 1 1 286.331 3.738 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(N[C@@H]2C[N@H+](C)Cc3ccccc32)c1 ZINC000535266408 1127911728 /nfs/dbraw/zinc/91/17/28/1127911728.db2.gz UJPBMKTVDQSIHX-MRXNPFEDSA-N 1 1 297.358 3.502 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(N[C@H]2C[N@H+](C)Cc3ccccc32)c1 ZINC000535266405 1127911804 /nfs/dbraw/zinc/91/18/04/1127911804.db2.gz UJPBMKTVDQSIHX-INIZCTEOSA-N 1 1 297.358 3.502 20 5 CHBDMO Cc1ccc(C[N@@H+]2C[C@@H](C)CC2(C)C)cc1[N+](=O)[O-] ZINC000539828083 1127945389 /nfs/dbraw/zinc/94/53/89/1127945389.db2.gz GIIBXRHRXIBZPT-NSHDSACASA-N 1 1 262.353 3.524 20 5 CHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC34CCC4)o2)cc1 ZINC000539835381 1127946540 /nfs/dbraw/zinc/94/65/40/1127946540.db2.gz ZONUOIKIBUDHCH-UHFFFAOYSA-N 1 1 298.342 3.983 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000540055017 1127958946 /nfs/dbraw/zinc/95/89/46/1127958946.db2.gz AUJZCXUHJYUXAD-SMDDNHRTSA-N 1 1 262.353 3.666 20 5 CHBDMO CSCCC[N@@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000467554102 1127973228 /nfs/dbraw/zinc/97/32/28/1127973228.db2.gz NXBFIUUYCCNSQA-JLHYYAGUSA-N 1 1 294.420 3.683 20 5 CHBDMO Cc1c(C[N@@H+](C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000541318385 1128017724 /nfs/dbraw/zinc/01/77/24/1128017724.db2.gz JPNFNGINYHWYJC-CQSZACIVSA-N 1 1 274.364 3.691 20 5 CHBDMO CCOc1cc(C[N@@H+]2[C@H](CC)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492603722 1128105566 /nfs/dbraw/zinc/10/55/66/1128105566.db2.gz CGQNTPDDSIPKTK-GXTWGEPZSA-N 1 1 292.379 3.756 20 5 CHBDMO CCOc1cc(C[N@H+]2CC[C@@H](C)[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492816886 1128113639 /nfs/dbraw/zinc/11/36/39/1128113639.db2.gz JKZRDAPAURMGMC-OCCSQVGLSA-N 1 1 292.379 3.614 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CC1 ZINC000761505021 1128132183 /nfs/dbraw/zinc/13/21/83/1128132183.db2.gz COLWSHNZAODLIR-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1)C1(C)CC1 ZINC000761514468 1128132993 /nfs/dbraw/zinc/13/29/93/1128132993.db2.gz JVALVMPRQPFUMO-JTQLQIEISA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000609204552 1128173023 /nfs/dbraw/zinc/17/30/23/1128173023.db2.gz WAOSZAWMZYFBEC-OLZOCXBDSA-N 1 1 276.380 3.994 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000916369080 1128417776 /nfs/dbraw/zinc/41/77/76/1128417776.db2.gz KXGAAPDLFYTUAY-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000917040473 1128468705 /nfs/dbraw/zinc/46/87/05/1128468705.db2.gz QXOTVEXMRDZIHK-CQSZACIVSA-N 1 1 296.370 3.757 20 5 CHBDMO Cc1ccoc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154267210 1128471412 /nfs/dbraw/zinc/47/14/12/1128471412.db2.gz VSNIPOHLHLDORT-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO Cc1ccoc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154267210 1128471415 /nfs/dbraw/zinc/47/14/15/1128471415.db2.gz VSNIPOHLHLDORT-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO Cc1cc(C)c(COc2c(F)cccc2[N+](=O)[O-])c(C)[nH+]1 ZINC000601080539 1128696885 /nfs/dbraw/zinc/69/68/85/1128696885.db2.gz DIWVBIKTJGXRSO-UHFFFAOYSA-N 1 1 290.294 3.633 20 5 CHBDMO Cc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000601304446 1128708857 /nfs/dbraw/zinc/70/88/57/1128708857.db2.gz OVISSGDLKOKZFS-LBPRGKRZSA-N 1 1 274.320 3.655 20 5 CHBDMO CC(C)[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CCCC1 ZINC000609388478 1128713848 /nfs/dbraw/zinc/71/38/48/1128713848.db2.gz MMUGUGJOAXOARV-UHFFFAOYSA-N 1 1 280.343 3.887 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1C=CCCC1 ZINC000609417619 1128714564 /nfs/dbraw/zinc/71/45/64/1128714564.db2.gz VDNJBWKHVHNBQX-HNNXBMFYSA-N 1 1 274.364 3.914 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609631959 1128721146 /nfs/dbraw/zinc/72/11/46/1128721146.db2.gz YMYUDXVMYBYYLU-AWEZNQCLSA-N 1 1 276.380 3.853 20 5 CHBDMO CC[C@H]1CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000430194365 1117838699 /nfs/dbraw/zinc/83/86/99/1117838699.db2.gz UQZLZBXIENKUSZ-ZDUSSCGKSA-N 1 1 286.331 3.839 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1CCC(C)CC1 ZINC000430197722 1117850536 /nfs/dbraw/zinc/85/05/36/1117850536.db2.gz OXRKANLMVFSVIN-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC3(C2)CCCCC3)cs1 ZINC000610216143 1117881019 /nfs/dbraw/zinc/88/10/19/1117881019.db2.gz OZHRZHRHLBNTGN-UHFFFAOYSA-N 1 1 280.393 3.813 20 5 CHBDMO C[C@H]1CCC[C@H](C)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215362 1117881936 /nfs/dbraw/zinc/88/19/36/1117881936.db2.gz HJLWBGMZXAOIMM-KBPBESRZSA-N 1 1 276.380 3.648 20 5 CHBDMO CC(C)[N@H+](Cc1c(F)cccc1[N+](=O)[O-])CC1CCC1 ZINC000444765117 1117925438 /nfs/dbraw/zinc/92/54/38/1117925438.db2.gz IOEUBFHMDJLITK-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO CC1=C[C@H](C)C[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000430280755 1117989666 /nfs/dbraw/zinc/98/96/66/1117989666.db2.gz YCORPJFFMDXTRF-AAEUAGOBSA-N 1 1 260.337 3.554 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000547747056 1117996585 /nfs/dbraw/zinc/99/65/85/1117996585.db2.gz AICDNNCFNFAFRM-PWSUYJOCSA-N 1 1 268.382 3.667 20 5 CHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)CC1CC1 ZINC000261454816 1118101079 /nfs/dbraw/zinc/10/10/79/1118101079.db2.gz JWUGIOHKUWTCFC-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1cccc(CNc2cc[nH+]c3ccsc32)c1 ZINC000301338063 1118194574 /nfs/dbraw/zinc/19/45/74/1118194574.db2.gz DPAWSKBUPYKQNE-UHFFFAOYSA-N 1 1 285.328 3.817 20 5 CHBDMO O=[N+]([O-])c1ccccc1CNc1cc[nH+]c2ccsc21 ZINC000301377551 1118195816 /nfs/dbraw/zinc/19/58/16/1118195816.db2.gz SATKALVTJVCAOM-UHFFFAOYSA-N 1 1 285.328 3.817 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H]1C1CC1 ZINC000615835583 1128764484 /nfs/dbraw/zinc/76/44/84/1128764484.db2.gz TYWXAQDVWOAMFW-JIIJFUIFSA-N 1 1 286.375 3.873 20 5 CHBDMO CC1(C)CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000510535151 1118766995 /nfs/dbraw/zinc/76/69/95/1118766995.db2.gz SUIVWSJSPSEZKP-VMPITWQZSA-N 1 1 274.364 3.730 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC(C)=C[C@H](C)C1 ZINC000430884420 1118783228 /nfs/dbraw/zinc/78/32/28/1118783228.db2.gz WOVIVUADSIDVHU-PBTLCFMXSA-N 1 1 286.375 3.896 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](C)S[C@@H](C)C1 ZINC000538709417 1118949276 /nfs/dbraw/zinc/94/92/76/1118949276.db2.gz IFYUSMBOHYSBDO-XQQFMLRXSA-N 1 1 294.420 3.790 20 5 CHBDMO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc(F)c1F ZINC000121863449 1119183439 /nfs/dbraw/zinc/18/34/39/1119183439.db2.gz PJCYRDHARIKGEG-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000219697639 1119511152 /nfs/dbraw/zinc/51/11/52/1119511152.db2.gz FINOUWLVCUQVAS-SWLSCSKDSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000219697743 1119511322 /nfs/dbraw/zinc/51/13/22/1119511322.db2.gz GMUQKTQWFUGXJU-DOMZBBRYSA-N 1 1 262.353 3.605 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCCC[C@@H]1C ZINC000219699172 1119511344 /nfs/dbraw/zinc/51/13/44/1119511344.db2.gz SZAPHYCDVLUGDT-SWLSCSKDSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000179315991 1119709950 /nfs/dbraw/zinc/70/99/50/1119709950.db2.gz OVGCSDBBQXIDQB-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1cc(F)ccc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000179315991 1119709952 /nfs/dbraw/zinc/70/99/52/1119709952.db2.gz OVGCSDBBQXIDQB-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC[N@@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1C ZINC000612578220 1119801408 /nfs/dbraw/zinc/80/14/08/1119801408.db2.gz KCCXWBYJYQRBIL-UHFFFAOYSA-N 1 1 290.285 3.678 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cccs1 ZINC000066562544 1119912758 /nfs/dbraw/zinc/91/27/58/1119912758.db2.gz PWRDPMZXGYGBEN-NSHDSACASA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000066696331 1120047664 /nfs/dbraw/zinc/04/76/64/1120047664.db2.gz NQAGGXPVHFOEDK-CYBMUJFWSA-N 1 1 270.332 3.788 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccsc2C1 ZINC000341041340 1120190758 /nfs/dbraw/zinc/19/07/58/1120190758.db2.gz GIHMPYPLTLLWPY-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccsc2C1 ZINC000341041340 1120190761 /nfs/dbraw/zinc/19/07/61/1120190761.db2.gz GIHMPYPLTLLWPY-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H]1c2ccccc2C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000542134541 1120194428 /nfs/dbraw/zinc/19/44/28/1120194428.db2.gz RPKOFTOHSYLYQC-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542882661 1120220280 /nfs/dbraw/zinc/22/02/80/1120220280.db2.gz CENHLVYXYMNLBE-PBHICJAKSA-N 1 1 288.391 3.649 20 5 CHBDMO CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(C)C ZINC000065299133 1120338141 /nfs/dbraw/zinc/33/81/41/1120338141.db2.gz QXUQJPUMGJYNQM-AWEZNQCLSA-N 1 1 294.395 3.730 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1sccc1[N+](=O)[O-] ZINC000301979458 1120512259 /nfs/dbraw/zinc/51/22/59/1120512259.db2.gz FZIGITDRRJPYTR-GFCCVEGCSA-N 1 1 297.424 3.723 20 5 CHBDMO CSCC[C@H](C)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093558615 1120562641 /nfs/dbraw/zinc/56/26/41/1120562641.db2.gz JBKZEONLYGMVAS-CFNZNRNTSA-N 1 1 294.420 3.681 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000302740915 1120656921 /nfs/dbraw/zinc/65/69/21/1120656921.db2.gz KNDAFOHELIDYRV-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001174781182 1121027886 /nfs/dbraw/zinc/02/78/86/1121027886.db2.gz ULPKTRZJFIXTIL-UONOGXRCSA-N 1 1 292.379 3.627 20 5 CHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCC1 ZINC000706765108 1121439544 /nfs/dbraw/zinc/43/95/44/1121439544.db2.gz ZUKAQLQNRISSGG-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000051966758 1121481571 /nfs/dbraw/zinc/48/15/71/1121481571.db2.gz QFHNILYQYJRSGB-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)o1 ZINC000051966758 1121481572 /nfs/dbraw/zinc/48/15/72/1121481572.db2.gz QFHNILYQYJRSGB-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO C[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@@H]1C ZINC000512647834 1121506139 /nfs/dbraw/zinc/50/61/39/1121506139.db2.gz HTGBOAZWEOWWIW-MVUUYHCISA-N 1 1 274.364 3.728 20 5 CHBDMO C[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@H]1C ZINC000512647890 1121506911 /nfs/dbraw/zinc/50/69/11/1121506911.db2.gz HTGBOAZWEOWWIW-VVYAQTJFSA-N 1 1 274.364 3.728 20 5 CHBDMO CC[C@@H]1CCCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509277338 1121509428 /nfs/dbraw/zinc/50/94/28/1121509428.db2.gz AROFDHMYZSJSLS-SNVBAGLBSA-N 1 1 284.306 3.638 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509277338 1121509432 /nfs/dbraw/zinc/50/94/32/1121509432.db2.gz AROFDHMYZSJSLS-SNVBAGLBSA-N 1 1 284.306 3.638 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000512653208 1121509852 /nfs/dbraw/zinc/50/98/52/1121509852.db2.gz VGMYTIWHJKWOGZ-WCQYABFASA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000512653188 1121510455 /nfs/dbraw/zinc/51/04/55/1121510455.db2.gz VGMYTIWHJKWOGZ-AAEUAGOBSA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000120463255 1121547367 /nfs/dbraw/zinc/54/73/67/1121547367.db2.gz SKZOHOOIALTPEK-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000120463255 1121547372 /nfs/dbraw/zinc/54/73/72/1121547372.db2.gz SKZOHOOIALTPEK-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO Cc1c(C[N@@H+]2CC3(CCC3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000433256850 1121631846 /nfs/dbraw/zinc/63/18/46/1121631846.db2.gz CATFGSBYIKQYKH-LBPRGKRZSA-N 1 1 274.364 3.668 20 5 CHBDMO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccccc1[N+](=O)[O-] ZINC000619611488 1128999807 /nfs/dbraw/zinc/99/98/07/1128999807.db2.gz IXPAZOIGOPGELL-SWLSCSKDSA-N 1 1 297.358 3.718 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611516984 1121654034 /nfs/dbraw/zinc/65/40/34/1121654034.db2.gz QLRXZECDDVRUCY-HUBLWGQQSA-N 1 1 280.343 3.644 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000611516984 1121654037 /nfs/dbraw/zinc/65/40/37/1121654037.db2.gz QLRXZECDDVRUCY-HUBLWGQQSA-N 1 1 280.343 3.644 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC001180199383 1121967145 /nfs/dbraw/zinc/96/71/45/1121967145.db2.gz RNGSGNNNEAYHLT-YPMHNXCESA-N 1 1 276.380 3.690 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)C1(C)CC1 ZINC000183391751 1129051737 /nfs/dbraw/zinc/05/17/37/1129051737.db2.gz DHYPFHWFRPOHND-LBPRGKRZSA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000434986115 1122426821 /nfs/dbraw/zinc/42/68/21/1122426821.db2.gz MPZDGTIYXTZGAQ-INIZCTEOSA-N 1 1 282.343 3.850 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000434986115 1122426823 /nfs/dbraw/zinc/42/68/23/1122426823.db2.gz MPZDGTIYXTZGAQ-INIZCTEOSA-N 1 1 282.343 3.850 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2cccs2)cc1[N+](=O)[O-] ZINC000505633358 1122443996 /nfs/dbraw/zinc/44/39/96/1122443996.db2.gz HBSCFWKQXKRKFQ-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000509546648 1122726397 /nfs/dbraw/zinc/72/63/97/1122726397.db2.gz WOOFNUXLZWRKIF-ZDUSSCGKSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429600740 1122727411 /nfs/dbraw/zinc/72/74/11/1122727411.db2.gz WTRKEGVAQLQQQM-QWRGUYRKSA-N 1 1 282.771 3.869 20 5 CHBDMO C=C/C=C/CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194478308 1122779367 /nfs/dbraw/zinc/77/93/67/1122779367.db2.gz SOJLVIKKRRBIBZ-QDLOVBKTSA-N 1 1 286.375 3.907 20 5 CHBDMO CC[C@H](C)[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000507190269 1122845457 /nfs/dbraw/zinc/84/54/57/1122845457.db2.gz YKQLSVKDGJOFOP-LBPRGKRZSA-N 1 1 264.369 3.949 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](C3CCC3)C2)cc1 ZINC001196255107 1122913055 /nfs/dbraw/zinc/91/30/55/1122913055.db2.gz QWIHQBHYQFEXCW-INIZCTEOSA-N 1 1 288.391 3.649 20 5 CHBDMO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@@H]1CC1(C)C ZINC001196458570 1122924177 /nfs/dbraw/zinc/92/41/77/1122924177.db2.gz NDEWDHTYMKJCAE-NSHDSACASA-N 1 1 282.771 3.726 20 5 CHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1C[C@@H]1c1ccccc1 ZINC000507162060 1122932476 /nfs/dbraw/zinc/93/24/76/1122932476.db2.gz UANIIZGPPHEXKL-IAGOWNOFSA-N 1 1 296.370 3.830 20 5 CHBDMO Cc1ccc(C)c(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000507151161 1122933303 /nfs/dbraw/zinc/93/33/03/1122933303.db2.gz BDNWAQHLPAGVEX-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507227181 1122941645 /nfs/dbraw/zinc/94/16/45/1122941645.db2.gz DNXCDEOHKKKZBO-FNOHHLHBSA-N 1 1 262.353 3.584 20 5 CHBDMO CCc1cccnc1[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000507520975 1122963047 /nfs/dbraw/zinc/96/30/47/1122963047.db2.gz UVAXBLAKOPLPIJ-OLZOCXBDSA-N 1 1 299.374 3.964 20 5 CHBDMO C[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339012683 1123668332 /nfs/dbraw/zinc/66/83/32/1123668332.db2.gz URZJMSJZRYAZBQ-VIFPVBQESA-N 1 1 288.269 3.598 20 5 CHBDMO C[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339012683 1123668335 /nfs/dbraw/zinc/66/83/35/1123668335.db2.gz URZJMSJZRYAZBQ-VIFPVBQESA-N 1 1 288.269 3.598 20 5 CHBDMO CC[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783547704 1123748983 /nfs/dbraw/zinc/74/89/83/1123748983.db2.gz UOSQNPZARNKDER-NSHDSACASA-N 1 1 268.744 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccc(F)cc1 ZINC000084439667 1129152192 /nfs/dbraw/zinc/15/21/92/1129152192.db2.gz RMBHRSNAZFJBGM-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO CC[C@H](F)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000440699695 1124078314 /nfs/dbraw/zinc/07/83/14/1124078314.db2.gz UKZBUYFDHYBMRA-ZDUSSCGKSA-N 1 1 268.332 3.553 20 5 CHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000144578310 1124114565 /nfs/dbraw/zinc/11/45/65/1124114565.db2.gz URSSTKRMNXBNHR-OAHLLOKOSA-N 1 1 276.380 3.995 20 5 CHBDMO CC(C)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001119253248 1131249573 /nfs/dbraw/zinc/24/95/73/1131249573.db2.gz DMHIHEYKQUBZPZ-UHFFFAOYSA-N 1 1 294.395 3.730 20 5 CHBDMO Cc1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cs1 ZINC000449316492 1124691712 /nfs/dbraw/zinc/69/17/12/1124691712.db2.gz ZERYZKQMSHUUGI-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO COc1ccsc1C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000873183517 1124748154 /nfs/dbraw/zinc/74/81/54/1124748154.db2.gz UJBKOSONHKRIJB-JTQLQIEISA-N 1 1 292.360 3.516 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532293469 1125248449 /nfs/dbraw/zinc/24/84/49/1125248449.db2.gz GOQRZDXNCSQTPX-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)s1 ZINC000093443685 1129423571 /nfs/dbraw/zinc/42/35/71/1129423571.db2.gz LOZFSVWIDXPHMU-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1ccc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)s1 ZINC000093443685 1129423572 /nfs/dbraw/zinc/42/35/72/1129423572.db2.gz LOZFSVWIDXPHMU-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCCCCC1 ZINC000094774338 1129451639 /nfs/dbraw/zinc/45/16/39/1129451639.db2.gz YPIKYIHRUMRELS-UHFFFAOYSA-N 1 1 280.343 3.889 20 5 CHBDMO C[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1C ZINC000252216494 1129559240 /nfs/dbraw/zinc/55/92/40/1129559240.db2.gz XVKOUWJXNCMXHX-QWRGUYRKSA-N 1 1 282.771 3.869 20 5 CHBDMO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCCC[C@H]2c2ccccc2)C1 ZINC001169051998 1129692486 /nfs/dbraw/zinc/69/24/86/1129692486.db2.gz FIPBYULVNOJYAP-XIRDDKMYSA-N 1 1 288.391 3.659 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001169724912 1129750964 /nfs/dbraw/zinc/75/09/64/1129750964.db2.gz YWACNECHSJFQGB-CQSZACIVSA-N 1 1 276.380 3.853 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cscc2Cl)cc1 ZINC000771943219 1129997771 /nfs/dbraw/zinc/99/77/71/1129997771.db2.gz KDEGJZNRAGLHKK-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO C[N@H+](Cc1ccsc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783509363 1130832890 /nfs/dbraw/zinc/83/28/90/1130832890.db2.gz LJNKPJXNBYGLCQ-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[N@@H+](Cc1ccsc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783509363 1130832893 /nfs/dbraw/zinc/83/28/93/1130832893.db2.gz LJNKPJXNBYGLCQ-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783534587 1130835700 /nfs/dbraw/zinc/83/57/00/1130835700.db2.gz XDNFDMPENFPNFA-SNVBAGLBSA-N 1 1 270.760 3.726 20 5 CHBDMO CCC(C)(C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783566039 1130837376 /nfs/dbraw/zinc/83/73/76/1130837376.db2.gz HADNQOYIHITUQS-UHFFFAOYSA-N 1 1 270.760 3.869 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799196887 1131075294 /nfs/dbraw/zinc/07/52/94/1131075294.db2.gz ZDHHDDIRPLAPKS-DZGCQCFKSA-N 1 1 297.358 3.540 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1C ZINC000816648933 1131120918 /nfs/dbraw/zinc/12/09/18/1131120918.db2.gz QWSOHKLWVIDRFC-VXGBXAGGSA-N 1 1 286.331 3.695 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CC1CCCCCC1)C2 ZINC001116592945 1131155875 /nfs/dbraw/zinc/15/58/75/1131155875.db2.gz PSYWTKWUTYIQMV-UHFFFAOYSA-N 1 1 274.364 3.881 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC12CCCC2 ZINC000844361418 1131555287 /nfs/dbraw/zinc/55/52/87/1131555287.db2.gz WVSQPWRZPBJRIZ-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC12CCCC2 ZINC000844361418 1131555291 /nfs/dbraw/zinc/55/52/91/1131555291.db2.gz WVSQPWRZPBJRIZ-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036790525 1131974547 /nfs/dbraw/zinc/97/45/47/1131974547.db2.gz KVOCMIHSZWOMDX-JTQLQIEISA-N 1 1 270.760 3.869 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914560 1132360225 /nfs/dbraw/zinc/36/02/25/1132360225.db2.gz HSOCFMNMDUJHPA-HZPDHXFCSA-N 1 1 288.391 3.717 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H](C)C1 ZINC001173226056 1132412333 /nfs/dbraw/zinc/41/23/33/1132412333.db2.gz KXAXSWUDWPDTLK-UONOGXRCSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001173223104 1132412693 /nfs/dbraw/zinc/41/26/93/1132412693.db2.gz XRQXYDQSGOXQRC-VNQPRFMTSA-N 1 1 288.391 3.648 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233457 1132413651 /nfs/dbraw/zinc/41/36/51/1132413651.db2.gz WSAJJNBAMKFIAF-ZFWWWQNUSA-N 1 1 276.380 3.790 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H]1CC1(C)C ZINC001173231263 1132413821 /nfs/dbraw/zinc/41/38/21/1132413821.db2.gz AGJJWIOABFKCSH-JSGCOSHPSA-N 1 1 276.380 3.504 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H]1CC1(C)C ZINC001173231265 1132414048 /nfs/dbraw/zinc/41/40/48/1132414048.db2.gz AGJJWIOABFKCSH-TZMCWYRMSA-N 1 1 276.380 3.504 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC001173233753 1132414112 /nfs/dbraw/zinc/41/41/12/1132414112.db2.gz NETIMAOYHQFIIN-KBXCAEBGSA-N 1 1 296.370 3.973 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCCC12CC2 ZINC001173235749 1132415733 /nfs/dbraw/zinc/41/57/33/1132415733.db2.gz ZAZNJTCGPJPMPK-ZDUSSCGKSA-N 1 1 274.364 3.544 20 5 CHBDMO C[N@H+](Cc1ccc2ccc3cccnc3c2n1)CC1CC1 ZINC001232219936 1132439333 /nfs/dbraw/zinc/43/93/33/1132439333.db2.gz YAXRSQIQMOHNPJ-UHFFFAOYSA-N 1 1 277.371 3.625 20 5 CHBDMO F[C@@H]1CCC[N@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232221571 1132439596 /nfs/dbraw/zinc/43/95/96/1132439596.db2.gz IUDCQMPESBMDJS-OAHLLOKOSA-N 1 1 295.361 3.717 20 5 CHBDMO F[C@@H]1CCC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232221571 1132439598 /nfs/dbraw/zinc/43/95/98/1132439598.db2.gz IUDCQMPESBMDJS-OAHLLOKOSA-N 1 1 295.361 3.717 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1Nc1ccc2[nH]c[nH+]c2c1 ZINC001160224537 1132950093 /nfs/dbraw/zinc/95/00/93/1132950093.db2.gz SAMKKPOTEZXKPY-UHFFFAOYSA-N 1 1 268.276 3.523 20 5 CHBDMO CC(C)CC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC001167004971 1133298986 /nfs/dbraw/zinc/29/89/86/1133298986.db2.gz MSYNMBLTWOVHTF-UHFFFAOYSA-N 1 1 298.333 3.884 20 5 CHBDMO CC(C)CC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC001167004971 1133298989 /nfs/dbraw/zinc/29/89/89/1133298989.db2.gz MSYNMBLTWOVHTF-UHFFFAOYSA-N 1 1 298.333 3.884 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCC(C)(C)C1 ZINC000344471402 529995710 /nfs/dbraw/zinc/99/57/10/529995710.db2.gz XNTBRYIJFFJLBQ-AWEZNQCLSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccco2)cc1[N+](=O)[O-] ZINC000035738643 172392515 /nfs/dbraw/zinc/39/25/15/172392515.db2.gz ZCEOUOYASHCEBI-RYUDHWBXSA-N 1 1 274.320 3.908 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1cccc([N+](=O)[O-])c1 ZINC000037495500 260112659 /nfs/dbraw/zinc/11/26/59/260112659.db2.gz GNDDJDLKHUJLBD-SECBINFHSA-N 1 1 280.711 3.692 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000080266580 260179218 /nfs/dbraw/zinc/17/92/18/260179218.db2.gz LVOGURVSNGLRHA-WDEREUQCSA-N 1 1 291.376 3.772 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccncc1 ZINC000289751785 263111871 /nfs/dbraw/zinc/11/18/71/263111871.db2.gz JECKEZZDGHNIJH-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000514095299 263273754 /nfs/dbraw/zinc/27/37/54/263273754.db2.gz QNKRIMVWEPTIOA-CQSZACIVSA-N 1 1 262.353 3.605 20 5 CHBDMO CC(C)(C)C1=CC[N@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000534659179 328341987 /nfs/dbraw/zinc/34/19/87/328341987.db2.gz IQFOYRSJTFVGKP-UHFFFAOYSA-N 1 1 280.393 3.835 20 5 CHBDMO CC(C)(C)C1=CC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000534659179 328341989 /nfs/dbraw/zinc/34/19/89/328341989.db2.gz IQFOYRSJTFVGKP-UHFFFAOYSA-N 1 1 280.393 3.835 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000303586664 328354170 /nfs/dbraw/zinc/35/41/70/328354170.db2.gz GLASITINEIHMBB-OAHLLOKOSA-N 1 1 276.380 3.853 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(F)cc2)c(Cl)c1 ZINC000049963197 328380118 /nfs/dbraw/zinc/38/01/18/328380118.db2.gz SZXHHSDJPKLYKO-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532038422 328398576 /nfs/dbraw/zinc/39/85/76/328398576.db2.gz ASPZKMDTEVBEAR-GOSISDBHSA-N 1 1 296.370 3.758 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000533527438 326851616 /nfs/dbraw/zinc/85/16/16/326851616.db2.gz XQYQFHQMGUYICO-UHFFFAOYSA-N 1 1 286.306 3.513 20 5 CHBDMO COc1ccccc1[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037562548 326855340 /nfs/dbraw/zinc/85/53/40/326855340.db2.gz WLIGLEVTFGTYIR-JTQLQIEISA-N 1 1 292.360 3.516 20 5 CHBDMO CCc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000089513368 327170916 /nfs/dbraw/zinc/17/09/16/327170916.db2.gz QALXDYJXIILRKS-NSHDSACASA-N 1 1 274.320 3.601 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000533821140 327203595 /nfs/dbraw/zinc/20/35/95/327203595.db2.gz XLCHQPJRQYIOMJ-QGZVFWFLSA-N 1 1 297.358 3.502 20 5 CHBDMO C[C@@H](c1ccco1)[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000086233284 330369097 /nfs/dbraw/zinc/36/90/97/330369097.db2.gz CQRNPPNMKOPFCO-LBPRGKRZSA-N 1 1 286.331 3.913 20 5 CHBDMO C[C@@H](c1ccco1)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000086233284 330369098 /nfs/dbraw/zinc/36/90/98/330369098.db2.gz CQRNPPNMKOPFCO-LBPRGKRZSA-N 1 1 286.331 3.913 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C(C)(F)F ZINC000449414420 330923656 /nfs/dbraw/zinc/92/36/56/330923656.db2.gz LXWAFSSKHQPPOG-WDEREUQCSA-N 1 1 286.322 3.549 20 5 CHBDMO Cc1cc[nH+]c(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000450760350 330998581 /nfs/dbraw/zinc/99/85/81/330998581.db2.gz NRDNKOZDTDFXLE-HNNXBMFYSA-N 1 1 297.358 3.682 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489228745 332043784 /nfs/dbraw/zinc/04/37/84/332043784.db2.gz XAWCAEGLPCFWAU-WCQYABFASA-N 1 1 264.369 3.942 20 5 CHBDMO CC(C)SCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000513881121 333046187 /nfs/dbraw/zinc/04/61/87/333046187.db2.gz KHWDPHHYLAWSCA-UHFFFAOYSA-N 1 1 296.436 3.947 20 5 CHBDMO C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CCCCCC1 ZINC000195718802 333261517 /nfs/dbraw/zinc/26/15/17/333261517.db2.gz OFDGRMTWUUNKLS-UHFFFAOYSA-N 1 1 292.379 3.628 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000522300614 333280792 /nfs/dbraw/zinc/28/07/92/333280792.db2.gz AITYZPZOORCPHZ-CYBMUJFWSA-N 1 1 282.409 3.914 20 5 CHBDMO CCC(CC)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000523701869 333340140 /nfs/dbraw/zinc/34/01/40/333340140.db2.gz YOSINDLOLUEYOH-UHFFFAOYSA-N 1 1 276.380 3.790 20 5 CHBDMO CCC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC1CC1 ZINC000523841067 333347607 /nfs/dbraw/zinc/34/76/07/333347607.db2.gz HSHLMHRDKCUHSM-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000524811129 333389124 /nfs/dbraw/zinc/38/91/24/333389124.db2.gz AHTCGYFVQFODLB-CJNGLKHVSA-N 1 1 276.380 3.995 20 5 CHBDMO Cc1csc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000126241586 333595181 /nfs/dbraw/zinc/59/51/81/333595181.db2.gz AFPALCVQNPKWHZ-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000564324905 334101112 /nfs/dbraw/zinc/10/11/12/334101112.db2.gz JIVDRTIKERMZED-OCCSQVGLSA-N 1 1 262.353 3.666 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000247333965 334279328 /nfs/dbraw/zinc/27/93/28/334279328.db2.gz PZPARNVOTDXTTD-QGZVFWFLSA-N 1 1 296.370 3.802 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000576392593 335197583 /nfs/dbraw/zinc/19/75/83/335197583.db2.gz SCUTUDVEYGPBDG-ZVVFDCPKSA-N 1 1 298.386 3.873 20 5 CHBDMO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000130074527 523122022 /nfs/dbraw/zinc/12/20/22/523122022.db2.gz IZUAFGQADMIPNT-HNNXBMFYSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000130074527 523122029 /nfs/dbraw/zinc/12/20/29/523122029.db2.gz IZUAFGQADMIPNT-HNNXBMFYSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000130115993 523122517 /nfs/dbraw/zinc/12/25/17/523122517.db2.gz RBZOTPQSRGRLCQ-INIZCTEOSA-N 1 1 285.347 3.573 20 5 CHBDMO Cc1cccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000352784892 534703387 /nfs/dbraw/zinc/70/33/87/534703387.db2.gz SDPDIRWRRCJNIN-CQSZACIVSA-N 1 1 299.374 3.800 20 5 CHBDMO Cc1cccc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000352784892 534703394 /nfs/dbraw/zinc/70/33/94/534703394.db2.gz SDPDIRWRRCJNIN-CQSZACIVSA-N 1 1 299.374 3.800 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccsc1 ZINC000061363413 525463206 /nfs/dbraw/zinc/46/32/06/525463206.db2.gz LKTTXOXZDVAZHI-SNVBAGLBSA-N 1 1 292.360 3.516 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000037151286 525535558 /nfs/dbraw/zinc/53/55/58/525535558.db2.gz RSZZHWDHBLQZLS-RYUDHWBXSA-N 1 1 286.331 3.712 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000129723853 1118889979 /nfs/dbraw/zinc/88/99/79/1118889979.db2.gz NHHIOFMDTWPWQK-MNOVXSKESA-N 1 1 282.771 3.726 20 5 CHBDMO CC(C)[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000068449060 1118988845 /nfs/dbraw/zinc/98/88/45/1118988845.db2.gz UPWGIVIFZDZUDF-UHFFFAOYSA-N 1 1 262.353 3.748 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccns1 ZINC000715957021 1131997321 /nfs/dbraw/zinc/99/73/21/1131997321.db2.gz ZIIZZEFALDQPIE-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2cccc(Cl)c2)cs1 ZINC000051634355 1125511281 /nfs/dbraw/zinc/51/12/81/1125511281.db2.gz KVYPWAOSAGMDIH-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO CC1=CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000533762959 1125780356 /nfs/dbraw/zinc/78/03/56/1125780356.db2.gz FTANUHKNZMOWIE-UHFFFAOYSA-N 1 1 290.363 3.534 20 5 CHBDMO CC1=CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000533762959 1125780361 /nfs/dbraw/zinc/78/03/61/1125780361.db2.gz FTANUHKNZMOWIE-UHFFFAOYSA-N 1 1 290.363 3.534 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccncc1F ZINC000338015397 1126711021 /nfs/dbraw/zinc/71/10/21/1126711021.db2.gz SAMVRRDXEHPAQN-WDEREUQCSA-N 1 1 289.310 3.541 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@H]2CCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000483095375 1126767788 /nfs/dbraw/zinc/76/77/88/1126767788.db2.gz AKFLKSJGNANRIT-ZDUSSCGKSA-N 1 1 292.379 3.614 20 5 CHBDMO CC1=C(C)C[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000483366362 1126783484 /nfs/dbraw/zinc/78/34/84/1126783484.db2.gz IZAMHMAILJEVKE-CYBMUJFWSA-N 1 1 260.337 3.698 20 5 CHBDMO CCCC[N@@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485709494 1126944024 /nfs/dbraw/zinc/94/40/24/1126944024.db2.gz PPVARWBKSHRHFC-LBPRGKRZSA-N 1 1 250.342 3.696 20 5 CHBDMO CCCC[N@@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485709493 1126944304 /nfs/dbraw/zinc/94/43/04/1126944304.db2.gz PPVARWBKSHRHFC-GFCCVEGCSA-N 1 1 250.342 3.696 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000485765823 1126951104 /nfs/dbraw/zinc/95/11/04/1126951104.db2.gz MCBOCMFUXDBOEA-YPMHNXCESA-N 1 1 262.353 3.696 20 5 CHBDMO CC1(C)C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000590204419 1127251293 /nfs/dbraw/zinc/25/12/93/1127251293.db2.gz IEXOXACGTIRLIE-SWLSCSKDSA-N 1 1 292.354 3.744 20 5 CHBDMO CC/C=C\CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000466813191 1127269704 /nfs/dbraw/zinc/26/97/04/1127269704.db2.gz OXZMPPLQIZKADO-ARJAWSKDSA-N 1 1 274.364 3.916 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C(C)C)C1CC1 ZINC000355257496 1127329164 /nfs/dbraw/zinc/32/91/64/1127329164.db2.gz VPVHJDHQQUKQAE-UHFFFAOYSA-N 1 1 292.379 3.755 20 5 CHBDMO CC(C)O[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000593055945 1127369718 /nfs/dbraw/zinc/36/97/18/1127369718.db2.gz VJEZYAFWMFJDEL-CJNGLKHVSA-N 1 1 292.379 3.545 20 5 CHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](C1CC1)C1CCCC1 ZINC000595311998 1127459796 /nfs/dbraw/zinc/45/97/96/1127459796.db2.gz KFMFSKRMQALXCX-UHFFFAOYSA-N 1 1 278.327 3.641 20 5 CHBDMO C[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000595425138 1127462353 /nfs/dbraw/zinc/46/23/53/1127462353.db2.gz JYSAOMNXDQXOOK-GFCCVEGCSA-N 1 1 278.327 3.522 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000595569033 1127466148 /nfs/dbraw/zinc/46/61/48/1127466148.db2.gz XGRPJIHTRPWOSX-FZMZJTMJSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)c(Cl)c1 ZINC000595569033 1127466151 /nfs/dbraw/zinc/46/61/51/1127466151.db2.gz XGRPJIHTRPWOSX-FZMZJTMJSA-N 1 1 280.755 3.623 20 5 CHBDMO CCC(F)(F)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000599069120 1127655414 /nfs/dbraw/zinc/65/54/14/1127655414.db2.gz VIZANMSEUWECQM-CYBMUJFWSA-N 1 1 298.333 3.551 20 5 CHBDMO Cc1c(C[N@H+]2CCCC(F)(F)CC2)cccc1[N+](=O)[O-] ZINC000599551260 1127679428 /nfs/dbraw/zinc/67/94/28/1127679428.db2.gz KBYWINSNFVQVBF-UHFFFAOYSA-N 1 1 284.306 3.524 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC(F)(F)CC1 ZINC000599552064 1127679738 /nfs/dbraw/zinc/67/97/38/1127679738.db2.gz UTXQJNCUNWKCDB-LLVKDONJSA-N 1 1 284.306 3.777 20 5 CHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000603873873 1127679883 /nfs/dbraw/zinc/67/98/83/1127679883.db2.gz JAXMJRSVWSNIIP-XJKSGUPXSA-N 1 1 276.380 3.648 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CC3)CC2)c(F)c1 ZINC000599673849 1127686791 /nfs/dbraw/zinc/68/67/91/1127686791.db2.gz ZUNYNPOWPXEVGA-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO Cc1noc(C[N@H+](C)C[C@H](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000599633289 1127684274 /nfs/dbraw/zinc/68/42/74/1127684274.db2.gz PLTXSQLBNIMWRC-NSHDSACASA-N 1 1 295.383 3.539 20 5 CHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CC(C)(C)C1 ZINC000412038452 1127893551 /nfs/dbraw/zinc/89/35/51/1127893551.db2.gz OTZCVKPTDXSFBI-UHFFFAOYSA-N 1 1 268.382 3.667 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+]C2(c3cccc(F)c3)CC2)cs1 ZINC000152851938 1127933136 /nfs/dbraw/zinc/93/31/36/1127933136.db2.gz MZVCTFMDUWKXLW-UHFFFAOYSA-N 1 1 292.335 3.574 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCC(C)(C)C1 ZINC000468392200 1128005317 /nfs/dbraw/zinc/00/53/17/1128005317.db2.gz JVDDAVFURBTCHA-AWEZNQCLSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@H]2CCCC[C@H]12 ZINC000541108999 1128008972 /nfs/dbraw/zinc/00/89/72/1128008972.db2.gz FUAOUBMWBDYHRF-XFJVYGCCSA-N 1 1 292.354 3.744 20 5 CHBDMO Cc1c(C[N@@H+](C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000541318383 1128018420 /nfs/dbraw/zinc/01/84/20/1128018420.db2.gz JPNFNGINYHWYJC-AWEZNQCLSA-N 1 1 274.364 3.691 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000541553683 1128027856 /nfs/dbraw/zinc/02/78/56/1128027856.db2.gz SRLLOJUMYOZPDA-QARUFBMTSA-N 1 1 286.375 3.896 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](C)[C@@H]1C ZINC000541770472 1128038584 /nfs/dbraw/zinc/03/85/84/1128038584.db2.gz FDVKOJSTSDDTCB-YPMHNXCESA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000542049194 1128049612 /nfs/dbraw/zinc/04/96/12/1128049612.db2.gz VXCOUYCRGUQXOD-INWMFGNUSA-N 1 1 274.364 3.605 20 5 CHBDMO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609145812 1128049769 /nfs/dbraw/zinc/04/97/69/1128049769.db2.gz QEWVFMPEESGIJH-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609145812 1128049773 /nfs/dbraw/zinc/04/97/73/1128049773.db2.gz QEWVFMPEESGIJH-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC000542049195 1128049347 /nfs/dbraw/zinc/04/93/47/1128049347.db2.gz VXCOUYCRGUQXOD-IVMMDQJWSA-N 1 1 274.364 3.605 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC=C(C)CC1 ZINC000492784151 1128112849 /nfs/dbraw/zinc/11/28/49/1128112849.db2.gz OMBNNKYGOQDDMY-ZDUSSCGKSA-N 1 1 260.337 3.616 20 5 CHBDMO C[C@@H]([NH2+]Cc1scnc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000932176408 1128398635 /nfs/dbraw/zinc/39/86/35/1128398635.db2.gz CSYJPHZYSKKCLC-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO Cc1c(C[N@@H+](C)CCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000917053786 1128470159 /nfs/dbraw/zinc/47/01/59/1128470159.db2.gz HCRRBVJSIQRYAT-UHFFFAOYSA-N 1 1 298.386 3.968 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000564081516 1128492100 /nfs/dbraw/zinc/49/21/00/1128492100.db2.gz WOFLUAGZGPDZFJ-DZGCQCFKSA-N 1 1 297.358 3.540 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000564081517 1128492233 /nfs/dbraw/zinc/49/22/33/1128492233.db2.gz WOFLUAGZGPDZFJ-HIFRSBDPSA-N 1 1 297.358 3.540 20 5 CHBDMO CCC(CC)[N@@H+](CC)CCc1ccc([N+](=O)[O-])cc1 ZINC000564608206 1128512830 /nfs/dbraw/zinc/51/28/30/1128512830.db2.gz DUQUETOYQUMQLW-UHFFFAOYSA-N 1 1 264.369 3.648 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1ccc([N+](=O)[O-])cc1OC ZINC000569965303 1128612923 /nfs/dbraw/zinc/61/29/23/1128612923.db2.gz RNEBKLPOQAKHOF-UHFFFAOYSA-N 1 1 280.368 3.614 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC(C)(C)C ZINC000609705051 1128722722 /nfs/dbraw/zinc/72/27/22/1128722722.db2.gz LJYGTLJVOCBZLC-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609766747 1128725726 /nfs/dbraw/zinc/72/57/26/1128725726.db2.gz MSMSSJXQGAEQKW-ZDUSSCGKSA-N 1 1 262.353 3.607 20 5 CHBDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000610003513 1128734057 /nfs/dbraw/zinc/73/40/57/1128734057.db2.gz GFXRRMUSQIGOIN-HNNXBMFYSA-N 1 1 298.386 3.966 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610080168 1128738075 /nfs/dbraw/zinc/73/80/75/1128738075.db2.gz LDHCNPBHPNEJJF-CQSZACIVSA-N 1 1 292.379 3.628 20 5 CHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610215376 1117881767 /nfs/dbraw/zinc/88/17/67/1117881767.db2.gz JIPDYLPUUDZLAQ-QWHCGFSZSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215365 1117882646 /nfs/dbraw/zinc/88/26/46/1117882646.db2.gz HJLWBGMZXAOIMM-ZIAGYGMSSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000359877458 1118008014 /nfs/dbraw/zinc/00/80/14/1118008014.db2.gz PWTGDFWOYHFRJA-DYVFJYSZSA-N 1 1 297.358 3.573 20 5 CHBDMO CC[C@H](C)C[N@@H+](CC)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083243352 1118368312 /nfs/dbraw/zinc/36/83/12/1118368312.db2.gz OCANCBWFLPELBC-NSHDSACASA-N 1 1 291.351 3.604 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1ccc([N+](=O)[O-])cc1 ZINC000610538811 1118700290 /nfs/dbraw/zinc/70/02/90/1118700290.db2.gz VBZQYMSCQXSAJT-VIFPVBQESA-N 1 1 280.711 3.692 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1cncs1 ZINC000934194497 1118961556 /nfs/dbraw/zinc/96/15/56/1118961556.db2.gz GDJOPQYTADSBKO-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000071969848 1118990508 /nfs/dbraw/zinc/99/05/08/1118990508.db2.gz TXVVDROYSJPCIP-ZDUSSCGKSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000611802036 1119196051 /nfs/dbraw/zinc/19/60/51/1119196051.db2.gz GDUASRAUCDUJMM-XUJVJEKNSA-N 1 1 292.354 3.744 20 5 CHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ccco3)o2)cc1 ZINC000033553688 1119207734 /nfs/dbraw/zinc/20/77/34/1119207734.db2.gz OFVRVZKXWFZMPE-UHFFFAOYSA-N 1 1 298.298 3.738 20 5 CHBDMO CC(C)([NH2+]Cc1ccc(Cl)o1)c1ccc([N+](=O)[O-])cc1 ZINC000080347343 1119355746 /nfs/dbraw/zinc/35/57/46/1119355746.db2.gz BBENICWFJLCIHB-UHFFFAOYSA-N 1 1 294.738 3.866 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000583588048 1119381277 /nfs/dbraw/zinc/38/12/77/1119381277.db2.gz NATHSXPZTCOEQS-UHFFFAOYSA-N 1 1 280.368 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC(C)=C[C@H](C)C1 ZINC000430265392 1119384338 /nfs/dbraw/zinc/38/43/38/1119384338.db2.gz DSFAAZINVCMNGW-SMDDNHRTSA-N 1 1 274.364 3.862 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccco1)C(C)C ZINC000350021406 1119494267 /nfs/dbraw/zinc/49/42/67/1119494267.db2.gz WSHJILOUVZRCBE-UHFFFAOYSA-N 1 1 288.347 3.907 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C1CC1)[C@H]1C=CCCC1 ZINC000179242466 1119624405 /nfs/dbraw/zinc/62/44/05/1119624405.db2.gz DRNKSTSMMWDOGR-AWEZNQCLSA-N 1 1 272.348 3.668 20 5 CHBDMO Cc1occc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000414374148 1120004793 /nfs/dbraw/zinc/00/47/93/1120004793.db2.gz UZOLSKPRQGESKK-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO Cc1occc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000414374148 1120004796 /nfs/dbraw/zinc/00/47/96/1120004796.db2.gz UZOLSKPRQGESKK-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000181369432 1120044936 /nfs/dbraw/zinc/04/49/36/1120044936.db2.gz CBXPKAJJCYYVJM-LLVKDONJSA-N 1 1 274.295 3.585 20 5 CHBDMO Nc1[nH+]cccc1Nc1cc2cccnc2c2ncccc12 ZINC001212404030 1120063677 /nfs/dbraw/zinc/06/36/77/1120063677.db2.gz IEHDKKXRDUIJBB-UHFFFAOYSA-N 1 1 287.326 3.504 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CC(C)C)C1CC1 ZINC000542702476 1120123166 /nfs/dbraw/zinc/12/31/66/1120123166.db2.gz HSTZKMWCHZIBPA-UHFFFAOYSA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)C(C)(C)C ZINC000542703551 1120124106 /nfs/dbraw/zinc/12/41/06/1120124106.db2.gz QKAUCBLUZSTWCQ-LBPRGKRZSA-N 1 1 264.369 3.770 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C1CC1)C1CCCC1 ZINC000103466463 1120252790 /nfs/dbraw/zinc/25/27/90/1120252790.db2.gz COEIAIQIYZJGQO-UHFFFAOYSA-N 1 1 290.363 3.510 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000313855825 1120413600 /nfs/dbraw/zinc/41/36/00/1120413600.db2.gz UMIBJKJATRDCJU-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000313855825 1120413602 /nfs/dbraw/zinc/41/36/02/1120413602.db2.gz UMIBJKJATRDCJU-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC[C@H]([NH2+][C@@H](C)c1nccs1)c1cccc([N+](=O)[O-])c1 ZINC000080268459 1120464243 /nfs/dbraw/zinc/46/42/43/1120464243.db2.gz PMWMZRKVSVFBIH-GWCFXTLKSA-N 1 1 291.376 3.853 20 5 CHBDMO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000053422380 1120494962 /nfs/dbraw/zinc/49/49/62/1120494962.db2.gz DEFWSTDMZVYAHL-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000053422380 1120494965 /nfs/dbraw/zinc/49/49/65/1120494965.db2.gz DEFWSTDMZVYAHL-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO CC(C)[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCC1 ZINC000093608269 1120563412 /nfs/dbraw/zinc/56/34/12/1120563412.db2.gz SWLWBPKGRGHPDW-SOFGYWHQSA-N 1 1 274.364 3.871 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000302742631 1120656827 /nfs/dbraw/zinc/65/68/27/1120656827.db2.gz ROCITELVAIHXII-CYBMUJFWSA-N 1 1 270.332 3.788 20 5 CHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072900528 1120950212 /nfs/dbraw/zinc/95/02/12/1120950212.db2.gz WSMNYURVZPAYQK-GFCCVEGCSA-N 1 1 282.409 3.558 20 5 CHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC001174760439 1121041885 /nfs/dbraw/zinc/04/18/85/1121041885.db2.gz OWMZZBMZSJZLIB-WFASDCNBSA-N 1 1 292.354 3.889 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)cs1 ZINC000246168622 1121282178 /nfs/dbraw/zinc/28/21/78/1121282178.db2.gz RLCOAYAAQJYDRG-NEPJUHHUSA-N 1 1 298.433 3.516 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCS[C@H]3CCCC[C@H]32)cs1 ZINC000246168622 1121282185 /nfs/dbraw/zinc/28/21/85/1121282185.db2.gz RLCOAYAAQJYDRG-NEPJUHHUSA-N 1 1 298.433 3.516 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CC[C@H](C)C1 ZINC000433038368 1121528377 /nfs/dbraw/zinc/52/83/77/1121528377.db2.gz JRPPGAYJAUCADH-FZMZJTMJSA-N 1 1 262.353 3.524 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccsc1 ZINC000611253016 1121632102 /nfs/dbraw/zinc/63/21/02/1121632102.db2.gz VTFPOTMVDXNZCL-XQRVVYSFSA-N 1 1 288.372 3.802 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611516986 1121653967 /nfs/dbraw/zinc/65/39/67/1121653967.db2.gz QLRXZECDDVRUCY-TYNCELHUSA-N 1 1 280.343 3.644 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C)[C@H](F)C1 ZINC000611516986 1121653970 /nfs/dbraw/zinc/65/39/70/1121653970.db2.gz QLRXZECDDVRUCY-TYNCELHUSA-N 1 1 280.343 3.644 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCc2ccccc21 ZINC000611549613 1121655597 /nfs/dbraw/zinc/65/55/97/1121655597.db2.gz BYMJVLDICCYQOB-MRXNPFEDSA-N 1 1 296.370 3.757 20 5 CHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H]1C=CCCC1 ZINC000731210546 1121854087 /nfs/dbraw/zinc/85/40/87/1121854087.db2.gz QPBFGBOHDNMADI-LBPRGKRZSA-N 1 1 280.755 3.789 20 5 CHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@H]1C=CCCC1 ZINC000731210546 1121854095 /nfs/dbraw/zinc/85/40/95/1121854095.db2.gz QPBFGBOHDNMADI-LBPRGKRZSA-N 1 1 280.755 3.789 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000501792212 1122010995 /nfs/dbraw/zinc/01/09/95/1122010995.db2.gz CWLNPQCGLYWFAN-UPJWGTAASA-N 1 1 262.353 3.634 20 5 CHBDMO Cc1ccc(C)c(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000501823852 1122011739 /nfs/dbraw/zinc/01/17/39/1122011739.db2.gz GZPJKOAXOXJBJM-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO C[N@@H+](CCCCNc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000413347205 1122013343 /nfs/dbraw/zinc/01/33/43/1122013343.db2.gz KNDRQTRYNCMVBX-UHFFFAOYSA-N 1 1 297.786 3.535 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001307450520 1122075214 /nfs/dbraw/zinc/07/52/14/1122075214.db2.gz NNHILEBXVIYHBT-OAHLLOKOSA-N 1 1 276.380 3.914 20 5 CHBDMO Cc1ccoc1C[N@@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001182044228 1122106646 /nfs/dbraw/zinc/10/66/46/1122106646.db2.gz VYIJZQRJHRBFTE-UHFFFAOYSA-N 1 1 288.347 3.745 20 5 CHBDMO Cc1ccoc1C[N@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001182044228 1122106648 /nfs/dbraw/zinc/10/66/48/1122106648.db2.gz VYIJZQRJHRBFTE-UHFFFAOYSA-N 1 1 288.347 3.745 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C(C1CC1)C1CC1 ZINC000183309591 1129044161 /nfs/dbraw/zinc/04/41/61/1129044161.db2.gz ZAIDQQWZWXMHJR-UHFFFAOYSA-N 1 1 274.364 3.524 20 5 CHBDMO Cc1ccc(C[N@H+]([C@H](C)C(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000505256303 1122352305 /nfs/dbraw/zinc/35/23/05/1122352305.db2.gz ZHURRNIXHTUBAI-CYBMUJFWSA-N 1 1 276.380 3.912 20 5 CHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000505617440 1122438261 /nfs/dbraw/zinc/43/82/61/1122438261.db2.gz YWQYBDOJSVCPDH-NWDGAFQWSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000505617441 1122438769 /nfs/dbraw/zinc/43/87/69/1122438769.db2.gz YWQYBDOJSVCPDH-RYUDHWBXSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001191521340 1122604321 /nfs/dbraw/zinc/60/43/21/1122604321.db2.gz PTNYHDIHEHTMDF-UKRRQHHQSA-N 1 1 288.391 3.779 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC001192198578 1122632393 /nfs/dbraw/zinc/63/23/93/1122632393.db2.gz LFDKOCBJIKHOHQ-ZDUSSCGKSA-N 1 1 294.370 3.992 20 5 CHBDMO Cc1c(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC001192481528 1122650234 /nfs/dbraw/zinc/65/02/34/1122650234.db2.gz NCVPHPDEZOWGAS-YLQAJVPDSA-N 1 1 288.391 3.914 20 5 CHBDMO C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCCCCC1 ZINC000518460319 1122758578 /nfs/dbraw/zinc/75/85/78/1122758578.db2.gz QWDFTFGLOGOZKB-UHFFFAOYSA-N 1 1 292.379 3.628 20 5 CHBDMO C=C/C=C\CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194478310 1122779284 /nfs/dbraw/zinc/77/92/84/1122779284.db2.gz SOJLVIKKRRBIBZ-QGZUEGPWSA-N 1 1 286.375 3.907 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC001195147163 1122849169 /nfs/dbraw/zinc/84/91/69/1122849169.db2.gz KJTSRZBNKABHBE-OAHLLOKOSA-N 1 1 274.364 3.525 20 5 CHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000159441081 1122861003 /nfs/dbraw/zinc/86/10/03/1122861003.db2.gz AQXNQONGWCCFET-LLVKDONJSA-N 1 1 282.771 3.726 20 5 CHBDMO Cc1cc(C)cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000507157302 1122930582 /nfs/dbraw/zinc/93/05/82/1122930582.db2.gz WRUAYAJDBOREBX-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507227182 1122941399 /nfs/dbraw/zinc/94/13/99/1122941399.db2.gz DNXCDEOHKKKZBO-JWJUJFCLSA-N 1 1 262.353 3.584 20 5 CHBDMO CCCC[N@@H+](CC)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037403788 1123027550 /nfs/dbraw/zinc/02/75/50/1123027550.db2.gz MSEFKDQVZPGIQU-UHFFFAOYSA-N 1 1 270.760 3.870 20 5 CHBDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520590531 1123181133 /nfs/dbraw/zinc/18/11/33/1123181133.db2.gz LIGHQTXNIJNEPO-QWHCGFSZSA-N 1 1 276.380 3.994 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000053149524 1123231403 /nfs/dbraw/zinc/23/14/03/1123231403.db2.gz NYJMASVZAZPPSC-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO CC(C)[N@@H+](C/C=C/Cl)Cc1ccc([N+](=O)[O-])cc1 ZINC000067458428 1123252012 /nfs/dbraw/zinc/25/20/12/1123252012.db2.gz BDEBYOSSUZLCMG-FPYGCLRLSA-N 1 1 268.744 3.558 20 5 CHBDMO CC(C)C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000507999222 1123253732 /nfs/dbraw/zinc/25/37/32/1123253732.db2.gz NLAFSGBSZYOYPB-FNORWQNLSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1cc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)oc1C ZINC000866539955 1124080261 /nfs/dbraw/zinc/08/02/61/1124080261.db2.gz IFHJITCEEJYFMO-LBPRGKRZSA-N 1 1 288.347 3.964 20 5 CHBDMO CC(C)[C@H]1CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000446737378 1124121577 /nfs/dbraw/zinc/12/15/77/1124121577.db2.gz VCQVMJXFHTURLP-NSHDSACASA-N 1 1 282.771 3.726 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC3(C2)CCCCC3)cc1 ZINC000525636414 1124451316 /nfs/dbraw/zinc/45/13/16/1124451316.db2.gz VOGRNSXQUCCUFH-UHFFFAOYSA-N 1 1 288.391 3.794 20 5 CHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1C ZINC000525636063 1124451868 /nfs/dbraw/zinc/45/18/68/1124451868.db2.gz DBJLNJRZWIYSKV-MNOVXSKESA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872064014 1124671636 /nfs/dbraw/zinc/67/16/36/1124671636.db2.gz VIJBJFUMGWVRLA-SFYZADRCSA-N 1 1 294.248 3.725 20 5 CHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccco3)C2)cc1 ZINC000449498383 1124774159 /nfs/dbraw/zinc/77/41/59/1124774159.db2.gz KJOYGSVTQJJDDX-AWEZNQCLSA-N 1 1 286.331 3.567 20 5 CHBDMO Cc1cccc(C[N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)n1 ZINC000876762721 1124976836 /nfs/dbraw/zinc/97/68/36/1124976836.db2.gz KNXNKBVFMHQQIE-UHFFFAOYSA-N 1 1 299.374 3.547 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)n1 ZINC000876762721 1124976840 /nfs/dbraw/zinc/97/68/40/1124976840.db2.gz KNXNKBVFMHQQIE-UHFFFAOYSA-N 1 1 299.374 3.547 20 5 CHBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000531202529 1125200752 /nfs/dbraw/zinc/20/07/52/1125200752.db2.gz QSGLMCHWFXHFGL-KBXCAEBGSA-N 1 1 296.370 3.973 20 5 CHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000741795665 1129453773 /nfs/dbraw/zinc/45/37/73/1129453773.db2.gz QKBHONMNCFYQCU-RYUDHWBXSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1cccc([C@@H]2CCC[N@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001169006250 1129689342 /nfs/dbraw/zinc/68/93/42/1129689342.db2.gz GJVDZTSIKNPVIS-PVAVHDDUSA-N 1 1 288.391 3.577 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccccc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011216 1129689812 /nfs/dbraw/zinc/68/98/12/1129689812.db2.gz ILVYCMZQMZDTIA-IAGOWNOFSA-N 1 1 290.407 3.590 20 5 CHBDMO CC[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001169334337 1129718980 /nfs/dbraw/zinc/71/89/80/1129718980.db2.gz XTJLEUXQTPSSMD-GDBMZVCRSA-N 1 1 276.380 3.995 20 5 CHBDMO C[C@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC001169665665 1129745184 /nfs/dbraw/zinc/74/51/84/1129745184.db2.gz DIVJUTRPXNDKDJ-CYBMUJFWSA-N 1 1 278.396 3.751 20 5 CHBDMO Cc1cc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c(C)o1 ZINC000114505255 1129840008 /nfs/dbraw/zinc/84/00/08/1129840008.db2.gz HEEYIBGGMBQOJR-UHFFFAOYSA-N 1 1 294.738 3.748 20 5 CHBDMO CC[C@H]1CC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)[C@@H]1C ZINC001462127885 1130204145 /nfs/dbraw/zinc/20/41/45/1130204145.db2.gz SYWQBVABMFILMF-KGLIPLIRSA-N 1 1 276.380 3.832 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000782502358 1130780237 /nfs/dbraw/zinc/78/02/37/1130780237.db2.gz FQYSQQLOPCQYIP-WPGHFRTFSA-N 1 1 292.354 3.744 20 5 CHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C/C=C\Cl)C2)cc1 ZINC000831534531 1131489345 /nfs/dbraw/zinc/48/93/45/1131489345.db2.gz PCRWKCZFSMNRGS-YFBARTHOSA-N 1 1 280.755 3.527 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173227271 1132412439 /nfs/dbraw/zinc/41/24/39/1132412439.db2.gz PCMQEMFNLUJDPH-HNNXBMFYSA-N 1 1 298.386 3.966 20 5 CHBDMO CCCCC[N@@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225897 1132412579 /nfs/dbraw/zinc/41/25/79/1132412579.db2.gz KEJQYBMZUPBNKX-CYBMUJFWSA-N 1 1 264.369 3.648 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1Nc1c(C)cc[nH+]c1C ZINC001211285299 1134403034 /nfs/dbraw/zinc/40/30/34/1134403034.db2.gz CEMGJAVQQAVEFE-UHFFFAOYSA-N 1 1 257.293 3.659 20 5 CHBDMO Cc1ccc(Nc2[nH+]c3ccccc3n2C)cc1[N+](=O)[O-] ZINC001213660236 1134474552 /nfs/dbraw/zinc/47/45/52/1134474552.db2.gz XWQSFUYWSVLZJE-UHFFFAOYSA-N 1 1 282.303 3.534 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccccc1F)c1ccccc1[N+](=O)[O-] ZINC000020526073 171239115 /nfs/dbraw/zinc/23/91/15/171239115.db2.gz VNACLQBMQSHEDE-LLVKDONJSA-N 1 1 274.295 3.585 20 5 CHBDMO CC[N@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1Cl ZINC000518400972 260399483 /nfs/dbraw/zinc/39/94/83/260399483.db2.gz VHHLMCWOQIJNPB-GFCCVEGCSA-N 1 1 297.786 3.535 20 5 CHBDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000161123187 261237770 /nfs/dbraw/zinc/23/77/70/261237770.db2.gz FMTMYCHAYMPHFI-ZDUSSCGKSA-N 1 1 285.347 3.573 20 5 CHBDMO COc1ccsc1[C@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000186202158 262084326 /nfs/dbraw/zinc/08/43/26/262084326.db2.gz OBQNBHUPVHUYSS-JTQLQIEISA-N 1 1 292.360 3.516 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@H]12 ZINC000541111793 328050448 /nfs/dbraw/zinc/05/04/48/328050448.db2.gz SLLAIUKFRXSVJR-WQVCFCJDSA-N 1 1 274.364 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccccc2F)c(Cl)c1 ZINC000049963209 328380019 /nfs/dbraw/zinc/38/00/19/328380019.db2.gz FZGMTAMEAYHVIW-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO CC(C)C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000089512366 327170827 /nfs/dbraw/zinc/17/08/27/327170827.db2.gz MBTWARCTMNGXSF-INIZCTEOSA-N 1 1 299.374 3.867 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC3(CCC3)C2)c(Cl)c1 ZINC000182230193 329241100 /nfs/dbraw/zinc/24/11/00/329241100.db2.gz QXSXLDLOMWPSJA-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CC3)C2)c(Cl)c1 ZINC000186612125 329346441 /nfs/dbraw/zinc/34/64/41/329346441.db2.gz OGGNZHWNUOTBPL-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC3(CC3)C2)c(Cl)c1 ZINC000186612125 329346439 /nfs/dbraw/zinc/34/64/39/329346439.db2.gz OGGNZHWNUOTBPL-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCCC2(CC2)C1 ZINC000186998992 329352907 /nfs/dbraw/zinc/35/29/07/329352907.db2.gz NHTGYGPHTPCXJD-CYBMUJFWSA-N 1 1 274.364 3.840 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000035256243 330244496 /nfs/dbraw/zinc/24/44/96/330244496.db2.gz BOCOKUWMZQLZME-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC2(CCC2)C1 ZINC000119331989 330373183 /nfs/dbraw/zinc/37/31/83/330373183.db2.gz ADEOYWMUEOOBNN-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C2CC2)C2CCCC2)c1 ZINC000057619665 330377033 /nfs/dbraw/zinc/37/70/33/330377033.db2.gz QRKWXYHVGRKWMH-UHFFFAOYSA-N 1 1 260.337 3.502 20 5 CHBDMO Cc1cn2cc(Nc3cc(C)ccc3[N+](=O)[O-])ccc2[nH+]1 ZINC000447050755 330860201 /nfs/dbraw/zinc/86/02/01/330860201.db2.gz PQYLFIIYOVNBQD-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO COc1cc(C[N@H+]2CCCCC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000464676493 331364482 /nfs/dbraw/zinc/36/44/82/331364482.db2.gz HQTTYMWQFSYHGG-LLVKDONJSA-N 1 1 296.342 3.507 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000490043089 332078071 /nfs/dbraw/zinc/07/80/71/332078071.db2.gz XSXMLYSVEGGBSF-INIZCTEOSA-N 1 1 292.379 3.616 20 5 CHBDMO CCOc1cc(C[N@H+]2CCCC[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492374544 332394724 /nfs/dbraw/zinc/39/47/24/332394724.db2.gz HFMPRIHVKSIHSY-CQSZACIVSA-N 1 1 292.379 3.758 20 5 CHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000513702799 333033712 /nfs/dbraw/zinc/03/37/12/333033712.db2.gz NDFFTRFWYDFIAK-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO CCc1ccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000524426331 333362025 /nfs/dbraw/zinc/36/20/25/333362025.db2.gz AYFCFBAURGSNIQ-UHFFFAOYSA-N 1 1 298.386 3.832 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)s1 ZINC000076342187 334079444 /nfs/dbraw/zinc/07/94/44/334079444.db2.gz GVSUGJBUDZXTDM-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO Cc1ccsc1C[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000549195404 334187447 /nfs/dbraw/zinc/18/74/47/334187447.db2.gz ZNWLEELHBPQRQX-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000550079269 334212377 /nfs/dbraw/zinc/21/23/77/334212377.db2.gz LFTFTJIESUGHNM-UKRRQHHQSA-N 1 1 274.364 3.605 20 5 CHBDMO CCOc1cc(C[N@@H+](CC)C2CCCC2)ccc1[N+](=O)[O-] ZINC000551710784 334258662 /nfs/dbraw/zinc/25/86/62/334258662.db2.gz BHFPVALDLLWNPE-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO CC(C)c1[nH+]ccn1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000070423021 519880311 /nfs/dbraw/zinc/88/03/11/519880311.db2.gz PJUJWSUMQJBMHK-UHFFFAOYSA-N 1 1 279.727 3.616 20 5 CHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000130169786 522966380 /nfs/dbraw/zinc/96/63/80/522966380.db2.gz BAFYBSJDYCFYNG-MRXNPFEDSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000290300082 523122486 /nfs/dbraw/zinc/12/24/86/523122486.db2.gz BEBUIMUQFRQEKG-INIZCTEOSA-N 1 1 299.374 3.881 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000289378269 524448476 /nfs/dbraw/zinc/44/84/76/524448476.db2.gz BNIBKMPIQIXNHI-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000289378269 524448485 /nfs/dbraw/zinc/44/84/85/524448485.db2.gz BNIBKMPIQIXNHI-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])o1 ZINC000291774199 524569617 /nfs/dbraw/zinc/56/96/17/524569617.db2.gz UBTWAHUMNBWZHF-UHFFFAOYSA-N 1 1 274.320 3.521 20 5 CHBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@H]2CF)cc1[N+](=O)[O-] ZINC000354519721 528092152 /nfs/dbraw/zinc/09/21/52/528092152.db2.gz HHSFPBLZEWRHAH-ZDUSSCGKSA-N 1 1 280.343 3.652 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]2CF)cc1[N+](=O)[O-] ZINC000354519721 528092159 /nfs/dbraw/zinc/09/21/59/528092159.db2.gz HHSFPBLZEWRHAH-ZDUSSCGKSA-N 1 1 280.343 3.652 20 5 CHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001167655899 1119301295 /nfs/dbraw/zinc/30/12/95/1119301295.db2.gz CNNJDFCVSFQLTQ-LLVKDONJSA-N 1 1 282.771 3.726 20 5 CHBDMO CCC[N@@H+](CC(C)C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232433 1132414297 /nfs/dbraw/zinc/41/42/97/1132414297.db2.gz RFTWRTODIBQWAW-CQSZACIVSA-N 1 1 278.396 3.894 20 5 CHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cscc2Cl)c1 ZINC000771953253 1129998664 /nfs/dbraw/zinc/99/86/64/1129998664.db2.gz RHARFCBLKVUIDW-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO CC1=C(c2ccco2)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000338340933 1126735948 /nfs/dbraw/zinc/73/59/48/1126735948.db2.gz GKMAEFVPUPFADZ-UHFFFAOYSA-N 1 1 298.342 3.867 20 5 CHBDMO CCSCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000159576929 1126746519 /nfs/dbraw/zinc/74/65/19/1126746519.db2.gz PGAXLFLYHFKNNI-UHFFFAOYSA-N 1 1 282.409 3.558 20 5 CHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000482515260 1126763084 /nfs/dbraw/zinc/76/30/84/1126763084.db2.gz VYLAIAMRJOYIDC-AQGQNPDFSA-N 1 1 274.364 3.728 20 5 CHBDMO CC[N@@H+](Cc1ccncc1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000267916295 1127008391 /nfs/dbraw/zinc/00/83/91/1127008391.db2.gz PJRDCWNNNOOQLR-CYBMUJFWSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccncc1 ZINC000348898598 1127133295 /nfs/dbraw/zinc/13/32/95/1127133295.db2.gz YGBKWXPTPRFBLP-FNORWQNLSA-N 1 1 297.358 3.525 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000588977949 1127208946 /nfs/dbraw/zinc/20/89/46/1127208946.db2.gz DZMAALWBHWEIQM-TZMCWYRMSA-N 1 1 274.364 3.778 20 5 CHBDMO C[N@@H+](CCCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000046087832 1127329860 /nfs/dbraw/zinc/32/98/60/1127329860.db2.gz ONTMKNMYNBXIRH-UHFFFAOYSA-N 1 1 284.359 3.659 20 5 CHBDMO CC1(CC(F)F)C[NH+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000592523358 1127395786 /nfs/dbraw/zinc/39/57/86/1127395786.db2.gz LFGKWVQRYFWMCO-GQCTYLIASA-N 1 1 296.317 3.585 20 5 CHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)C1 ZINC000359302887 1127457509 /nfs/dbraw/zinc/45/75/09/1127457509.db2.gz PDALCEXQNIQGRG-CZUORRHYSA-N 1 1 274.364 3.607 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CC2CC=CC2)C2CC2)c1 ZINC000595350528 1127460022 /nfs/dbraw/zinc/46/00/22/1127460022.db2.gz BSLHQAWFKFUFMR-UHFFFAOYSA-N 1 1 272.348 3.525 20 5 CHBDMO CCC(CC)CCC[N@H+](C)Cc1onc(C)c1[N+](=O)[O-] ZINC000595836998 1127477521 /nfs/dbraw/zinc/47/75/21/1127477521.db2.gz ZREVGRQBNVGTMF-UHFFFAOYSA-N 1 1 283.372 3.539 20 5 CHBDMO CCC(CC)CCC[N@@H+](C)Cc1onc(C)c1[N+](=O)[O-] ZINC000595836998 1127477522 /nfs/dbraw/zinc/47/75/22/1127477522.db2.gz ZREVGRQBNVGTMF-UHFFFAOYSA-N 1 1 283.372 3.539 20 5 CHBDMO COc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000361396340 1127561022 /nfs/dbraw/zinc/56/10/22/1127561022.db2.gz GASDNYLTAQXVIZ-HNNXBMFYSA-N 1 1 298.342 3.550 20 5 CHBDMO COc1ccc(C[N@H+]2CC[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000361396340 1127561024 /nfs/dbraw/zinc/56/10/24/1127561024.db2.gz GASDNYLTAQXVIZ-HNNXBMFYSA-N 1 1 298.342 3.550 20 5 CHBDMO CC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000061109026 1127650951 /nfs/dbraw/zinc/65/09/51/1127650951.db2.gz SDNXWASUQSIDNI-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO CCC(CC)C[N@@H+](CC)Cc1ccccc1[N+](=O)[O-] ZINC000603849548 1127676233 /nfs/dbraw/zinc/67/62/33/1127676233.db2.gz DQNQJUAQUMGGTE-UHFFFAOYSA-N 1 1 264.369 3.853 20 5 CHBDMO C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000604011974 1127689641 /nfs/dbraw/zinc/68/96/41/1127689641.db2.gz BHOQLRHWDUKMLS-UHFFFAOYSA-N 1 1 292.379 3.628 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2sccc2Cl)cc1 ZINC000193014274 1127909116 /nfs/dbraw/zinc/90/91/16/1127909116.db2.gz RFBWKKCBPBWECU-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO CC[C@]1(C)CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468138131 1127994832 /nfs/dbraw/zinc/99/48/32/1127994832.db2.gz KHUBSAJGCZYWAD-IUODEOHRSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H](C)C1 ZINC000468257578 1127999556 /nfs/dbraw/zinc/99/95/56/1127999556.db2.gz SUNANIUJYJEGTC-CHWSQXEVSA-N 1 1 262.353 3.778 20 5 CHBDMO CCC(CC)[N@@H+](CCOC)Cc1ccc([N+](=O)[O-])cc1C ZINC000541772239 1128038708 /nfs/dbraw/zinc/03/87/08/1128038708.db2.gz XKFZSQSHBKEFJV-UHFFFAOYSA-N 1 1 294.395 3.540 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC(C)(C)C ZINC000470173571 1128064157 /nfs/dbraw/zinc/06/41/57/1128064157.db2.gz CTXUSSFBJGLCFS-UKTHLTGXSA-N 1 1 276.380 3.976 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC12CCC2 ZINC000470181601 1128065115 /nfs/dbraw/zinc/06/51/15/1128065115.db2.gz FQPCZUDGIPIONT-RAXLEYEMSA-N 1 1 272.348 3.627 20 5 CHBDMO CC[C@@H](C)[N@@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470179135 1128065172 /nfs/dbraw/zinc/06/51/72/1128065172.db2.gz SSXREKYQKCHKEE-CNELAYHGSA-N 1 1 262.353 3.728 20 5 CHBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)C2(C)CC2)ccc1[N+](=O)[O-] ZINC000492793594 1128113723 /nfs/dbraw/zinc/11/37/23/1128113723.db2.gz VSQWVWFOFXTAPR-LBPRGKRZSA-N 1 1 292.379 3.614 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C(C1CC1)C1CC1 ZINC000761506028 1128132659 /nfs/dbraw/zinc/13/26/59/1128132659.db2.gz MJNXINQIRKJRJW-UHFFFAOYSA-N 1 1 294.782 3.869 20 5 CHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493382860 1128140449 /nfs/dbraw/zinc/14/04/49/1128140449.db2.gz IWCDEHJFFGKEHV-LLVKDONJSA-N 1 1 282.771 3.726 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)[C@@H]2CCSC2)cc1[N+](=O)[O-] ZINC000130566991 1128247090 /nfs/dbraw/zinc/24/70/90/1128247090.db2.gz LDQIBJIFTJAJST-CYBMUJFWSA-N 1 1 294.420 3.656 20 5 CHBDMO C[C@H](C[N@H+]1Cc2ccc([N+](=O)[O-])cc2C1)C(C)(C)C ZINC001327187823 1128345093 /nfs/dbraw/zinc/34/50/93/1128345093.db2.gz NGJAEKXTKABHSZ-LLVKDONJSA-N 1 1 262.353 3.593 20 5 CHBDMO Cc1c([C@H](C)[NH2+][C@@H](C)c2nccs2)cccc1[N+](=O)[O-] ZINC000153361954 1128371779 /nfs/dbraw/zinc/37/17/79/1128371779.db2.gz SURONXQWKCMTCU-QWRGUYRKSA-N 1 1 291.376 3.772 20 5 CHBDMO CC1(C)C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@H]2CCC[C@H]21 ZINC000557055457 1128663827 /nfs/dbraw/zinc/66/38/27/1128663827.db2.gz NEUDQBYXNCUSSX-NEPJUHHUSA-N 1 1 280.393 3.667 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc(F)cc1 ZINC000072556270 1117762673 /nfs/dbraw/zinc/76/26/73/1117762673.db2.gz OUTBSGZVTZNTCF-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc(F)cc1 ZINC000072556270 1117762678 /nfs/dbraw/zinc/76/26/78/1117762678.db2.gz OUTBSGZVTZNTCF-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000430194005 1117840644 /nfs/dbraw/zinc/84/06/44/1117840644.db2.gz HSARYLYYBFSMDN-TZMCWYRMSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1cc(NC[C@H](C)[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000510096000 1117882723 /nfs/dbraw/zinc/88/27/23/1117882723.db2.gz VQUJWRPEDIFWKW-KGLIPLIRSA-N 1 1 291.395 3.578 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000610215371 1117882735 /nfs/dbraw/zinc/88/27/35/1117882735.db2.gz JETLCCMMILJNBH-OLZOCXBDSA-N 1 1 262.353 3.605 20 5 CHBDMO CCC[C@@H](C)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000579458369 1118379908 /nfs/dbraw/zinc/37/99/08/1118379908.db2.gz FLQMKMZSNOGHIO-CYBMUJFWSA-N 1 1 264.369 3.505 20 5 CHBDMO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1ccccc1 ZINC000033394624 1118964776 /nfs/dbraw/zinc/96/47/76/1118964776.db2.gz UFUUFCDTWBSUSW-XFFZJAGNSA-N 1 1 296.370 3.783 20 5 CHBDMO CC(C)CCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511125865 1119080737 /nfs/dbraw/zinc/08/07/37/1119080737.db2.gz NNUAEWPIAODJCW-UHFFFAOYSA-N 1 1 264.369 3.505 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000219701529 1119511543 /nfs/dbraw/zinc/51/15/43/1119511543.db2.gz GCPYBZDXSAHDSB-OCCSQVGLSA-N 1 1 262.353 3.605 20 5 CHBDMO CC(C)([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1cccs1 ZINC000612517117 1119796071 /nfs/dbraw/zinc/79/60/71/1119796071.db2.gz GOOGBDGSFWEYPF-UHFFFAOYSA-N 1 1 294.351 3.820 20 5 CHBDMO Cc1occc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000414367243 1120001454 /nfs/dbraw/zinc/00/14/54/1120001454.db2.gz DHNVNTCITFUWFN-UHFFFAOYSA-N 1 1 288.347 3.907 20 5 CHBDMO C[C@H]1CC[C@]2(CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542882664 1120220603 /nfs/dbraw/zinc/22/06/03/1120220603.db2.gz CENHLVYXYMNLBE-YOEHRIQHSA-N 1 1 288.391 3.649 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](CC2CC2)C1 ZINC000584543426 1120232863 /nfs/dbraw/zinc/23/28/63/1120232863.db2.gz JYUWKJMSSVPAGX-GFCCVEGCSA-N 1 1 294.782 3.870 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492788073 1120249207 /nfs/dbraw/zinc/24/92/07/1120249207.db2.gz HQSQJKIUSRRMQT-STQMWFEESA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1occc1C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000254988156 1120306768 /nfs/dbraw/zinc/30/67/68/1120306768.db2.gz SOWCGWLCUHDENU-ALCCZGGFSA-N 1 1 286.331 3.641 20 5 CHBDMO C[C@H](c1cccs1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000313706515 1120406269 /nfs/dbraw/zinc/40/62/69/1120406269.db2.gz TUGYRNNXWJDXJJ-SNVBAGLBSA-N 1 1 294.351 3.988 20 5 CHBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000313706515 1120406271 /nfs/dbraw/zinc/40/62/71/1120406271.db2.gz TUGYRNNXWJDXJJ-SNVBAGLBSA-N 1 1 294.351 3.988 20 5 CHBDMO C[N@@H+](CCCNc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000037859950 1120497318 /nfs/dbraw/zinc/49/73/18/1120497318.db2.gz CGSYRSGAAZXOLT-UHFFFAOYSA-N 1 1 291.395 3.661 20 5 CHBDMO C[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000508978323 1120569120 /nfs/dbraw/zinc/56/91/20/1120569120.db2.gz PYWUSVFTQCAVGS-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@@H]1CC=CCC1 ZINC000509008343 1120588404 /nfs/dbraw/zinc/58/84/04/1120588404.db2.gz MSTTUWAZEMHBGT-LLVKDONJSA-N 1 1 296.317 3.661 20 5 CHBDMO C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@@H]1CC=CCC1 ZINC000509008343 1120588401 /nfs/dbraw/zinc/58/84/01/1120588401.db2.gz MSTTUWAZEMHBGT-LLVKDONJSA-N 1 1 296.317 3.661 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(C)C ZINC000112629142 1120839970 /nfs/dbraw/zinc/83/99/70/1120839970.db2.gz FUSKAPLONTWTNC-ZDUSSCGKSA-N 1 1 264.369 3.504 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000567548695 1120843637 /nfs/dbraw/zinc/84/36/37/1120843637.db2.gz NEESUPSUCUGOAX-GFCCVEGCSA-N 1 1 280.368 3.614 20 5 CHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000072900531 1120949853 /nfs/dbraw/zinc/94/98/53/1120949853.db2.gz WSMNYURVZPAYQK-LBPRGKRZSA-N 1 1 282.409 3.558 20 5 CHBDMO CS[C@@H]1CCCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246577426 1121311612 /nfs/dbraw/zinc/31/16/12/1121311612.db2.gz LUTILWQSUCVTOI-SWLSCSKDSA-N 1 1 294.420 3.873 20 5 CHBDMO C[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000429583663 1121341908 /nfs/dbraw/zinc/34/19/08/1121341908.db2.gz KYVKCWABYDOPKX-GXFFZTMASA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1cn2cc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)ccc2[nH+]1 ZINC001175900604 1121493198 /nfs/dbraw/zinc/49/31/98/1121493198.db2.gz BMJJMXZTMAJGEX-CMDGGOBGSA-N 1 1 294.314 3.634 20 5 CHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000482507478 1121498467 /nfs/dbraw/zinc/49/84/67/1121498467.db2.gz JNLYCRAWSMKSHQ-OCCSQVGLSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H]1CC2(CCC2)C[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000433020751 1121520366 /nfs/dbraw/zinc/52/03/66/1121520366.db2.gz DIVYSIPSQKBRST-HJHHMULASA-N 1 1 286.375 3.873 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C(F)F)C1 ZINC000611516947 1121654387 /nfs/dbraw/zinc/65/43/87/1121654387.db2.gz QAEBHUAKZBSNKK-QWRGUYRKSA-N 1 1 284.306 3.551 20 5 CHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]21 ZINC000542974916 1121737654 /nfs/dbraw/zinc/73/76/54/1121737654.db2.gz FWFFUPCSSBJMNE-KBRIMQKVSA-N 1 1 288.391 3.648 20 5 CHBDMO Cc1c(C[N@H+]2CCCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000730264584 1121800056 /nfs/dbraw/zinc/80/00/56/1121800056.db2.gz JNYSOXLMXCRSQB-UHFFFAOYSA-N 1 1 296.370 3.852 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccsc1 ZINC000619782585 1129013842 /nfs/dbraw/zinc/01/38/42/1129013842.db2.gz FFXSDKVLQGXDDE-SNVBAGLBSA-N 1 1 292.360 3.516 20 5 CHBDMO C[N@@H+](CCNc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000071377559 1122048513 /nfs/dbraw/zinc/04/85/13/1122048513.db2.gz MOUDWLMYUUEHRR-UHFFFAOYSA-N 1 1 297.786 3.535 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC12CCCC2 ZINC001182753480 1122184831 /nfs/dbraw/zinc/18/48/31/1122184831.db2.gz INRYVVHOFIMJDM-UHFFFAOYSA-N 1 1 274.364 3.730 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCSC(C)(C)CC1 ZINC000435050932 1122431301 /nfs/dbraw/zinc/43/13/01/1122431301.db2.gz VJCUJWHGJAMSDP-UHFFFAOYSA-N 1 1 294.420 3.621 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001167959357 1122474203 /nfs/dbraw/zinc/47/42/03/1122474203.db2.gz OUUGXIODJJHHQZ-ZDUSSCGKSA-N 1 1 292.379 3.616 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001167959355 1122474263 /nfs/dbraw/zinc/47/42/63/1122474263.db2.gz OUUGXIODJJHHQZ-CYBMUJFWSA-N 1 1 292.379 3.616 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001191540975 1122604552 /nfs/dbraw/zinc/60/45/52/1122604552.db2.gz KSHFNNOHYRJRAM-UHFFFAOYSA-N 1 1 280.343 3.746 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-])C1(C)CC1 ZINC000437532848 1122638994 /nfs/dbraw/zinc/63/89/94/1122638994.db2.gz DIKSUOWXGVEMSY-SNVBAGLBSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1C ZINC001193413275 1122690477 /nfs/dbraw/zinc/69/04/77/1122690477.db2.gz MJIUBKZDGMADSN-CZUORRHYSA-N 1 1 276.380 3.995 20 5 CHBDMO Cc1cc(C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cs1 ZINC000519521184 1122848362 /nfs/dbraw/zinc/84/83/62/1122848362.db2.gz UFKIEVZJLZXSCT-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1cc(C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cs1 ZINC000519521184 1122848363 /nfs/dbraw/zinc/84/83/63/1122848363.db2.gz UFKIEVZJLZXSCT-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO C[N@H+](Cc1ccc2c(c1)CCC2)Cc1ccccc1[N+](=O)[O-] ZINC000507163573 1122931767 /nfs/dbraw/zinc/93/17/67/1122931767.db2.gz YZERDOMLBCFCSW-UHFFFAOYSA-N 1 1 296.370 3.716 20 5 CHBDMO C[N@@H+](Cc1ccc2c(c1)CCC2)Cc1ccccc1[N+](=O)[O-] ZINC000507163573 1122931773 /nfs/dbraw/zinc/93/17/73/1122931773.db2.gz YZERDOMLBCFCSW-UHFFFAOYSA-N 1 1 296.370 3.716 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](c3ccccc3)C2)c1 ZINC000507665542 1122983627 /nfs/dbraw/zinc/98/36/27/1122983627.db2.gz KVDFQOFNDHNEAZ-INIZCTEOSA-N 1 1 282.343 3.584 20 5 CHBDMO Cc1cc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000449314334 1123263014 /nfs/dbraw/zinc/26/30/14/1123263014.db2.gz CEFGZNKYOSGWET-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000542632228 1129134053 /nfs/dbraw/zinc/13/40/53/1129134053.db2.gz PQTFPNCDPKUVED-AWEZNQCLSA-N 1 1 262.353 3.749 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccns1 ZINC000862539920 1123818217 /nfs/dbraw/zinc/81/82/17/1123818217.db2.gz UPYGQWOTNMZOQH-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1F)CC1CCC1 ZINC000444767041 1124061746 /nfs/dbraw/zinc/06/17/46/1124061746.db2.gz OMFPBPYPZJYPJH-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(F)cc2Cl)cc1 ZINC000037668623 1129165608 /nfs/dbraw/zinc/16/56/08/1129165608.db2.gz VEBLFLDAJVAJDQ-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO CCC(CC)[N@@H+](CCOC)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000508564849 1124114666 /nfs/dbraw/zinc/11/46/66/1124114666.db2.gz QTUZYKDBWXQVRP-UHFFFAOYSA-N 1 1 294.395 3.540 20 5 CHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CCC1 ZINC000441197081 1124132769 /nfs/dbraw/zinc/13/27/69/1124132769.db2.gz FDXUMAXUHWSODN-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1ccsc1C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872028180 1124660544 /nfs/dbraw/zinc/66/05/44/1124660544.db2.gz PQTNVGVJWQEASC-SNVBAGLBSA-N 1 1 294.351 3.955 20 5 CHBDMO CCC(C)(C)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000093279380 1129420225 /nfs/dbraw/zinc/42/02/25/1129420225.db2.gz ITECFOSSKHYUFQ-UHFFFAOYSA-N 1 1 250.342 3.524 20 5 CHBDMO CCC(C)(C)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093279321 1129420505 /nfs/dbraw/zinc/42/05/05/1129420505.db2.gz VCGYQVQPSCYYHL-CSKARUKUSA-N 1 1 262.353 3.728 20 5 CHBDMO Cc1c(C[N@H+]2CCC3(CCCC3)C2)cccc1[N+](=O)[O-] ZINC000743864284 1129542176 /nfs/dbraw/zinc/54/21/76/1129542176.db2.gz ZJCYSCJTGYCXTG-UHFFFAOYSA-N 1 1 274.364 3.669 20 5 CHBDMO Cc1c(C[N@H+]2CCCC(C)(C)CC2)cccc1[N+](=O)[O-] ZINC000303866205 1129576699 /nfs/dbraw/zinc/57/66/99/1129576699.db2.gz HHWNOPOZSFQLEC-UHFFFAOYSA-N 1 1 276.380 3.915 20 5 CHBDMO Cc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001169006251 1129689348 /nfs/dbraw/zinc/68/93/48/1129689348.db2.gz GJVDZTSIKNPVIS-UAGQMJEPSA-N 1 1 288.391 3.577 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169011218 1129689974 /nfs/dbraw/zinc/68/99/74/1129689974.db2.gz ILVYCMZQMZDTIA-SJORKVTESA-N 1 1 290.407 3.590 20 5 CHBDMO CC[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169042785 1129690493 /nfs/dbraw/zinc/69/04/93/1129690493.db2.gz FSCBNWDRFPANNW-DZGCQCFKSA-N 1 1 296.798 3.607 20 5 CHBDMO Cc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001169025014 1129691345 /nfs/dbraw/zinc/69/13/45/1129691345.db2.gz ILURVVJBSNOLED-OIISXLGYSA-N 1 1 288.391 3.577 20 5 CHBDMO C[C@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC001169090988 1129700326 /nfs/dbraw/zinc/70/03/26/1129700326.db2.gz KMUWVQVTKNEMIC-ZDUSSCGKSA-N 1 1 276.380 3.505 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC1CCCCC1 ZINC001169667936 1129745754 /nfs/dbraw/zinc/74/57/54/1129745754.db2.gz YAXQVKIJXHMCAA-UHFFFAOYSA-N 1 1 276.380 3.649 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001169724938 1129751249 /nfs/dbraw/zinc/75/12/49/1129751249.db2.gz ZPKBHEDQNWUOMG-CYBMUJFWSA-N 1 1 294.370 3.992 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001169724911 1129751472 /nfs/dbraw/zinc/75/14/72/1129751472.db2.gz YWACNECHSJFQGB-AWEZNQCLSA-N 1 1 276.380 3.853 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC12CCC2 ZINC000801526344 1129924139 /nfs/dbraw/zinc/92/41/39/1129924139.db2.gz LFFBWQXLYCFMPY-GFCCVEGCSA-N 1 1 292.354 3.746 20 5 CHBDMO CC(C)(C)C1=CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000801525885 1129924329 /nfs/dbraw/zinc/92/43/29/1129924329.db2.gz RAQKBNUJGULVMW-UHFFFAOYSA-N 1 1 292.354 3.912 20 5 CHBDMO CC(C)(C)C1=CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000801525885 1129924332 /nfs/dbraw/zinc/92/43/32/1129924332.db2.gz RAQKBNUJGULVMW-UHFFFAOYSA-N 1 1 292.354 3.912 20 5 CHBDMO CCC(C)(C)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746673229 1130144403 /nfs/dbraw/zinc/14/44/03/1130144403.db2.gz OPKUCDHFPBMIAT-UHFFFAOYSA-N 1 1 270.760 3.869 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748807350 1130248492 /nfs/dbraw/zinc/24/84/92/1130248492.db2.gz MWRQJDQOPRDQOB-AWEZNQCLSA-N 1 1 280.343 3.744 20 5 CHBDMO CC1(C)C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000811512966 1130618436 /nfs/dbraw/zinc/61/84/36/1130618436.db2.gz BPZYPILBXUAWCD-CQSZACIVSA-N 1 1 294.782 3.869 20 5 CHBDMO CC1(C)C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1C1CC1 ZINC000811512966 1130618440 /nfs/dbraw/zinc/61/84/40/1130618440.db2.gz BPZYPILBXUAWCD-CQSZACIVSA-N 1 1 294.782 3.869 20 5 CHBDMO N[C@@]12C[C@@H]1C[N@@H+](Cc1c3ccccc3cc3ccccc31)C2 ZINC001236026479 1130831309 /nfs/dbraw/zinc/83/13/09/1130831309.db2.gz MVZANKXCFWNNDN-OXQOHEQNSA-N 1 1 288.394 3.526 20 5 CHBDMO [NH3+][C@@]12C[C@@H]1CN(Cc1c3ccccc3cc3ccccc31)C2 ZINC001236026479 1130831314 /nfs/dbraw/zinc/83/13/14/1130831314.db2.gz MVZANKXCFWNNDN-OXQOHEQNSA-N 1 1 288.394 3.526 20 5 CHBDMO CC[C@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783573918 1130839631 /nfs/dbraw/zinc/83/96/31/1130839631.db2.gz MYWKFHSUAPDFPR-CQSZACIVSA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000816648856 1131120713 /nfs/dbraw/zinc/12/07/13/1131120713.db2.gz QCEQSVUZROAMKV-NEPJUHHUSA-N 1 1 286.331 3.695 20 5 CHBDMO Cc1cccc(CCC[N@@H+]2Cc3ccc([N+](=O)[O-])cc3C2)c1 ZINC001116493925 1131151064 /nfs/dbraw/zinc/15/10/64/1131151064.db2.gz PGMISEJIVWPIHX-UHFFFAOYSA-N 1 1 296.370 3.852 20 5 CHBDMO Cc1cccc(CCC[N@H+]2Cc3ccc([N+](=O)[O-])cc3C2)c1 ZINC001116493925 1131151065 /nfs/dbraw/zinc/15/10/65/1131151065.db2.gz PGMISEJIVWPIHX-UHFFFAOYSA-N 1 1 296.370 3.852 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844436104 1131564012 /nfs/dbraw/zinc/56/40/12/1131564012.db2.gz GQIKIGALNHFCQW-SMDDNHRTSA-N 1 1 296.317 3.777 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037173077 1132006309 /nfs/dbraw/zinc/00/63/09/1132006309.db2.gz NBGVGJUXHAUOQF-JTQLQIEISA-N 1 1 270.760 3.726 20 5 CHBDMO CC(C)[NH+]1CC(Oc2nccc3c4ccccc4ccc32)C1 ZINC001230203240 1132159465 /nfs/dbraw/zinc/15/94/65/1132159465.db2.gz KHXLRASXBPTUTR-UHFFFAOYSA-N 1 1 292.382 3.859 20 5 CHBDMO CCCC[N@@H+](CC)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908020 1132349248 /nfs/dbraw/zinc/34/92/48/1132349248.db2.gz KGCSSXQIYFUTGY-MRXNPFEDSA-N 1 1 290.407 3.964 20 5 CHBDMO CCCCC[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907906 1132350423 /nfs/dbraw/zinc/35/04/23/1132350423.db2.gz JLIISUXECSAGIK-INIZCTEOSA-N 1 1 290.407 3.964 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@](C)(F)C1 ZINC001173221381 1132411556 /nfs/dbraw/zinc/41/15/56/1132411556.db2.gz HWZZSYPPQUDEEH-BBRMVZONSA-N 1 1 294.370 3.740 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC12CCCCC2 ZINC001173220613 1132411758 /nfs/dbraw/zinc/41/17/58/1132411758.db2.gz BCTDDWYNAGCUOL-CQSZACIVSA-N 1 1 288.391 3.934 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001173225686 1132412860 /nfs/dbraw/zinc/41/28/60/1132412860.db2.gz FISJPSFCCSNFIS-WCQYABFASA-N 1 1 298.333 3.503 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC001173226213 1132413024 /nfs/dbraw/zinc/41/30/24/1132413024.db2.gz LJFSCTQPGJUUNC-NEPJUHHUSA-N 1 1 298.333 3.503 20 5 CHBDMO CC[C@H]1CCC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173235811 1132415153 /nfs/dbraw/zinc/41/51/53/1132415153.db2.gz ZNDHNLDBGBKYGL-KGLIPLIRSA-N 1 1 276.380 3.648 20 5 CHBDMO CC[N@@H+](Cc1ccc2ccc3cccnc3c2n1)C1CC1 ZINC001232219559 1132439574 /nfs/dbraw/zinc/43/95/74/1132439574.db2.gz UDWUQHSJVUIDGX-UHFFFAOYSA-N 1 1 277.371 3.767 20 5 CHBDMO N[C@H]1CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000843047633 1132494837 /nfs/dbraw/zinc/49/48/37/1132494837.db2.gz ZAIDSNYVCMUPDX-INIZCTEOSA-N 1 1 276.383 3.526 20 5 CHBDMO N[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000843047633 1132494840 /nfs/dbraw/zinc/49/48/40/1132494840.db2.gz ZAIDSNYVCMUPDX-INIZCTEOSA-N 1 1 276.383 3.526 20 5 CHBDMO O=[N+]([O-])c1ccc(Nc2ccc3c[nH+]ccc3c2)cc1 ZINC001174478028 1132882090 /nfs/dbraw/zinc/88/20/90/1132882090.db2.gz JDZLOKDJXVGTMS-UHFFFAOYSA-N 1 1 265.272 3.887 20 5 CHBDMO Cc1[nH+]c2c(Nc3ccc([N+](=O)[O-])cc3)cccn2c1C ZINC001174478011 1132883440 /nfs/dbraw/zinc/88/34/40/1132883440.db2.gz IGSKRINWRNSIFW-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO C[C@]1([NH3+])CCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC001204782625 1133485338 /nfs/dbraw/zinc/48/53/38/1133485338.db2.gz HPCNLLNTLVCKMO-FQEVSTJZSA-N 1 1 290.410 3.916 20 5 CHBDMO C[C@]1(N)CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001204782625 1133485340 /nfs/dbraw/zinc/48/53/40/1133485340.db2.gz HPCNLLNTLVCKMO-FQEVSTJZSA-N 1 1 290.410 3.916 20 5 CHBDMO C[C@]1(N)CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001204782625 1133485345 /nfs/dbraw/zinc/48/53/45/1133485345.db2.gz HPCNLLNTLVCKMO-FQEVSTJZSA-N 1 1 290.410 3.916 20 5 CHBDMO CC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)CC(C)C ZINC001204881722 1133494637 /nfs/dbraw/zinc/49/46/37/1133494637.db2.gz SMYRMDRBODALJG-NTEUORMPSA-N 1 1 276.380 3.976 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CCN1 ZINC001206389389 1133697486 /nfs/dbraw/zinc/69/74/86/1133697486.db2.gz RVAAPSUHRFLCEE-OAHLLOKOSA-N 1 1 290.410 3.787 20 5 CHBDMO C[C@@H]1CN(Cc2c3ccccc3cc3ccccc32)CC[NH2+]1 ZINC001206389389 1133697487 /nfs/dbraw/zinc/69/74/87/1133697487.db2.gz RVAAPSUHRFLCEE-OAHLLOKOSA-N 1 1 290.410 3.787 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC000344460643 530004578 /nfs/dbraw/zinc/00/45/78/530004578.db2.gz IYTUGASOXBOYSP-CYBMUJFWSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1c(C[N@H+](C)[C@H](C)C2(C)CC2)cccc1[N+](=O)[O-] ZINC000177243303 261341788 /nfs/dbraw/zinc/34/17/88/261341788.db2.gz BSZZDVGAOPWQFP-GFCCVEGCSA-N 1 1 262.353 3.524 20 5 CHBDMO CC(C)OCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000171500017 335067258 /nfs/dbraw/zinc/06/72/58/335067258.db2.gz IJIYKHIRHVGGGA-UHFFFAOYSA-N 1 1 294.395 3.620 20 5 CHBDMO CC(C)c1[nH+]ccn1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037403912 173180137 /nfs/dbraw/zinc/18/01/37/173180137.db2.gz DASLICAJPZTZJM-UHFFFAOYSA-N 1 1 279.727 3.616 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCc2occc2C1 ZINC000344313828 225023777 /nfs/dbraw/zinc/02/37/77/225023777.db2.gz YILIBNHGSWTGNE-LBPRGKRZSA-N 1 1 286.331 3.697 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCc2occc2C1 ZINC000344313828 225023780 /nfs/dbraw/zinc/02/37/80/225023780.db2.gz YILIBNHGSWTGNE-LBPRGKRZSA-N 1 1 286.331 3.697 20 5 CHBDMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000080274734 260179511 /nfs/dbraw/zinc/17/95/11/260179511.db2.gz GLYCHHWZHSBVKF-WDEREUQCSA-N 1 1 291.376 3.772 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394054093 260212322 /nfs/dbraw/zinc/21/23/22/260212322.db2.gz SIPUFCMWRJRHPW-NSHDSACASA-N 1 1 268.332 3.744 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000514083982 261353871 /nfs/dbraw/zinc/35/38/71/261353871.db2.gz NOSKLCQGQBODCR-LLVKDONJSA-N 1 1 268.382 3.667 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525786412 262236278 /nfs/dbraw/zinc/23/62/78/262236278.db2.gz FTWMCLALEGCUAT-UMVBOHGHSA-N 1 1 274.364 3.748 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC2CC2)CC2CCC2)c(F)c1 ZINC000475673692 264335202 /nfs/dbraw/zinc/33/52/02/264335202.db2.gz HWPNPXVYNJVPJI-UHFFFAOYSA-N 1 1 292.354 3.746 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC12CCC2 ZINC000357025723 266235822 /nfs/dbraw/zinc/23/58/22/266235822.db2.gz PMPDFEXBYJYGHX-LBPRGKRZSA-N 1 1 292.354 3.746 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(Cl)s1 ZINC000048068861 328040970 /nfs/dbraw/zinc/04/09/70/328040970.db2.gz NOOXEHIDKGABQN-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO C[C@@H]([N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000534349904 328047619 /nfs/dbraw/zinc/04/76/19/328047619.db2.gz AWADKSQPNUSLEK-CHOZFAJLSA-N 1 1 276.380 3.974 20 5 CHBDMO Cc1ccc(N[C@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC000534530366 328305104 /nfs/dbraw/zinc/30/51/04/328305104.db2.gz BCSWMDNQGFACHJ-INIZCTEOSA-N 1 1 297.358 3.502 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000110788953 328319214 /nfs/dbraw/zinc/31/92/14/328319214.db2.gz YFMGUFDJPJNZIR-UHFFFAOYSA-N 1 1 262.353 3.748 20 5 CHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000184897330 329263849 /nfs/dbraw/zinc/26/38/49/329263849.db2.gz YQGWQSWJYJANDW-SUMWQHHRSA-N 1 1 297.358 3.573 20 5 CHBDMO CC(C)[C@@H]1CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000445428454 330216072 /nfs/dbraw/zinc/21/60/72/330216072.db2.gz WJGOQIDUDYUYKD-GXTWGEPZSA-N 1 1 262.353 3.634 20 5 CHBDMO CCC1(CC)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)CCS1 ZINC000464568344 331362809 /nfs/dbraw/zinc/36/28/09/331362809.db2.gz INKQRZVOGIMKIL-UHFFFAOYSA-N 1 1 294.420 3.702 20 5 CHBDMO CC(C)[C@@H]1C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CCS1 ZINC000464774712 331367336 /nfs/dbraw/zinc/36/73/36/331367336.db2.gz PZZIPVWKMKMHTI-WFASDCNBSA-N 1 1 294.420 3.729 20 5 CHBDMO CCOc1cc(C[N@@H+](C)C2(C)CCCC2)ccc1[N+](=O)[O-] ZINC000489850678 332070038 /nfs/dbraw/zinc/07/00/38/332070038.db2.gz OAGXFXNFXPRAMK-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000575790869 335115249 /nfs/dbraw/zinc/11/52/49/335115249.db2.gz SXXAANNGXMSNOE-LBPRGKRZSA-N 1 1 250.342 3.605 20 5 CHBDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000513702800 333033613 /nfs/dbraw/zinc/03/36/13/333033613.db2.gz NDFFTRFWYDFIAK-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO CC[C@H](C)C[N@@H+](CC)Cc1ccc([N+](=O)[O-])cc1F ZINC000311403752 333067977 /nfs/dbraw/zinc/06/79/77/333067977.db2.gz GRHGJDJNJCSOAD-NSHDSACASA-N 1 1 268.332 3.602 20 5 CHBDMO CC(C)[N@@H+](Cc1ccco1)Cc1ccc([N+](=O)[O-])cc1 ZINC000194956761 333280141 /nfs/dbraw/zinc/28/01/41/333280141.db2.gz QNOLCGFPGOGMQC-UHFFFAOYSA-N 1 1 274.320 3.598 20 5 CHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000524811131 333388969 /nfs/dbraw/zinc/38/89/69/333388969.db2.gz AHTCGYFVQFODLB-XJKSGUPXSA-N 1 1 276.380 3.995 20 5 CHBDMO CC[N@@H+](CCC1CC1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000546932265 334055735 /nfs/dbraw/zinc/05/57/35/334055735.db2.gz VNXDHKUAXFAOFV-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO CC[N@@H+](CCc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000549208761 334187651 /nfs/dbraw/zinc/18/76/51/334187651.db2.gz RTKPNVKXFCRGOU-UHFFFAOYSA-N 1 1 298.386 3.968 20 5 CHBDMO C[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422553 334191862 /nfs/dbraw/zinc/19/18/62/334191862.db2.gz IXUVUQQYJLEODE-CXAGYDPISA-N 1 1 282.343 3.788 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422553 334191864 /nfs/dbraw/zinc/19/18/64/334191864.db2.gz IXUVUQQYJLEODE-CXAGYDPISA-N 1 1 282.343 3.788 20 5 CHBDMO CC[C@@H]([NH2+]Cc1nc(C)cs1)c1cccc([N+](=O)[O-])c1 ZINC000038090915 522892544 /nfs/dbraw/zinc/89/25/44/522892544.db2.gz KAMOWKCVQUKZKT-CYBMUJFWSA-N 1 1 291.376 3.601 20 5 CHBDMO CCc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000051724389 523944329 /nfs/dbraw/zinc/94/43/29/523944329.db2.gz GXFBFOADZHYIBP-NSHDSACASA-N 1 1 274.320 3.601 20 5 CHBDMO CCc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000051724392 523946459 /nfs/dbraw/zinc/94/64/59/523946459.db2.gz GXFBFOADZHYIBP-LLVKDONJSA-N 1 1 274.320 3.601 20 5 CHBDMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccsc1 ZINC000061361712 525557523 /nfs/dbraw/zinc/55/75/23/525557523.db2.gz VRRLKMSXGHSEAS-MRVPVSSYSA-N 1 1 268.363 3.569 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000036960136 525935032 /nfs/dbraw/zinc/93/50/32/525935032.db2.gz GEBKUPPVOLANAG-RYUDHWBXSA-N 1 1 274.320 3.908 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000036960138 525943976 /nfs/dbraw/zinc/94/39/76/525943976.db2.gz GEBKUPPVOLANAG-NEPJUHHUSA-N 1 1 274.320 3.908 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cccnc1 ZINC000347369043 527528578 /nfs/dbraw/zinc/52/85/78/527528578.db2.gz GYLOWEDYOISMCP-NTEUORMPSA-N 1 1 297.358 3.525 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC1CCCC1)C1CC1 ZINC000532747088 1125575625 /nfs/dbraw/zinc/57/56/25/1125575625.db2.gz ICPBWNRCWVRQJR-UHFFFAOYSA-N 1 1 274.364 3.749 20 5 CHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CCCCCCC1 ZINC000885973698 1125631657 /nfs/dbraw/zinc/63/16/57/1125631657.db2.gz YSMDVZHBJJMWIX-UHFFFAOYSA-N 1 1 277.368 3.535 20 5 CHBDMO C[C@H](c1ccccc1)[N@H+](Cc1cccnc1[N+](=O)[O-])C1CC1 ZINC000886054419 1125642431 /nfs/dbraw/zinc/64/24/31/1125642431.db2.gz BWLCYWHPDGAQLA-CYBMUJFWSA-N 1 1 297.358 3.715 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CC1 ZINC000886054419 1125642434 /nfs/dbraw/zinc/64/24/34/1125642434.db2.gz BWLCYWHPDGAQLA-CYBMUJFWSA-N 1 1 297.358 3.715 20 5 CHBDMO C[C@@]1(c2ccccc2)CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886318076 1125668615 /nfs/dbraw/zinc/66/86/15/1125668615.db2.gz IXJYHLAWUQDRQY-KRWDZBQOSA-N 1 1 297.358 3.501 20 5 CHBDMO CC1=C(C)C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000796020664 1129463128 /nfs/dbraw/zinc/46/31/28/1129463128.db2.gz PTDSQRUAEKEFCX-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO CC1=C(C)C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000796020664 1129463129 /nfs/dbraw/zinc/46/31/29/1129463129.db2.gz PTDSQRUAEKEFCX-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1ccccc1[N+](=O)[O-] ZINC000338014157 1126710664 /nfs/dbraw/zinc/71/06/64/1126710664.db2.gz ROCZXXQTJKCXIU-WDEREUQCSA-N 1 1 289.310 3.541 20 5 CHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000482507476 1126762348 /nfs/dbraw/zinc/76/23/48/1126762348.db2.gz JNLYCRAWSMKSHQ-JSGCOSHPSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000482515263 1126762654 /nfs/dbraw/zinc/76/26/54/1126762654.db2.gz VYLAIAMRJOYIDC-VEXXYJEVSA-N 1 1 274.364 3.728 20 5 CHBDMO CC1=C(C)C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000483352516 1126782214 /nfs/dbraw/zinc/78/22/14/1126782214.db2.gz HUEWYVNJQHWYAC-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO CC1=C(C)C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000483352516 1126782215 /nfs/dbraw/zinc/78/22/15/1126782215.db2.gz HUEWYVNJQHWYAC-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000042977999 1126866524 /nfs/dbraw/zinc/86/65/24/1126866524.db2.gz DKQIFDLNXDWNGN-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1ccco1 ZINC000182599150 1126875253 /nfs/dbraw/zinc/87/52/53/1126875253.db2.gz YEMPJJHNERNUFU-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)Cc1ccco1 ZINC000182599150 1126875255 /nfs/dbraw/zinc/87/52/55/1126875255.db2.gz YEMPJJHNERNUFU-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cncs1 ZINC000271516715 1127088482 /nfs/dbraw/zinc/08/84/82/1127088482.db2.gz PRNSEWFNGSUZOO-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccncc1 ZINC000348898597 1127133547 /nfs/dbraw/zinc/13/35/47/1127133547.db2.gz YGBKWXPTPRFBLP-ALCCZGGFSA-N 1 1 297.358 3.525 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000286725374 1127273037 /nfs/dbraw/zinc/27/30/37/1127273037.db2.gz GSXQYUZPYIHBOG-UHFFFAOYSA-N 1 1 284.306 3.605 20 5 CHBDMO Cc1ccc(C[N@@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)nc1 ZINC000590754360 1127270512 /nfs/dbraw/zinc/27/05/12/1127270512.db2.gz AIUGGGDACFPFSV-CQSZACIVSA-N 1 1 299.374 3.800 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)nc1 ZINC000590754360 1127270514 /nfs/dbraw/zinc/27/05/14/1127270514.db2.gz AIUGGGDACFPFSV-CQSZACIVSA-N 1 1 299.374 3.800 20 5 CHBDMO C[N@@H+](CCCNc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000057877720 1127287608 /nfs/dbraw/zinc/28/76/08/1127287608.db2.gz QMMUBYRMKIYYFF-UHFFFAOYSA-N 1 1 299.374 3.529 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H](C)C1 ZINC000355108025 1127317928 /nfs/dbraw/zinc/31/79/28/1127317928.db2.gz KBYJZIVHXZCVIQ-QWRGUYRKSA-N 1 1 268.382 3.524 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761045771 1127408085 /nfs/dbraw/zinc/40/80/85/1127408085.db2.gz QZLYSMHFCFWEBS-VHSXEESVSA-N 1 1 288.269 3.540 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761045769 1127408137 /nfs/dbraw/zinc/40/81/37/1127408137.db2.gz QZLYSMHFCFWEBS-UWVGGRQHSA-N 1 1 288.269 3.540 20 5 CHBDMO CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000059037343 1127410863 /nfs/dbraw/zinc/41/08/63/1127410863.db2.gz ZBFJJNKTAMKSGT-UHFFFAOYSA-N 1 1 292.379 3.628 20 5 CHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000359303809 1127457678 /nfs/dbraw/zinc/45/76/78/1127457678.db2.gz PTNWVJMWCGBYRL-RISCZKNCSA-N 1 1 280.393 3.668 20 5 CHBDMO Cc1noc(C[N@H+]2CCC[C@H](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000595321183 1127459329 /nfs/dbraw/zinc/45/93/29/1127459329.db2.gz KTIFFIJGHHBYCW-LBPRGKRZSA-N 1 1 295.383 3.539 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](CCF)C1 ZINC000597212104 1127533789 /nfs/dbraw/zinc/53/37/89/1127533789.db2.gz RSKQSCWYAMMDAT-HJHHMULASA-N 1 1 292.354 3.680 20 5 CHBDMO C[C@@H](Nc1cc(C2CC2)cc[nH+]1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294127499 1127551501 /nfs/dbraw/zinc/55/15/01/1127551501.db2.gz LDALRGCLZBHSND-SNVBAGLBSA-N 1 1 298.346 3.623 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]12 ZINC000603662029 1127665053 /nfs/dbraw/zinc/66/50/53/1127665053.db2.gz BDADJFSWWDQPBG-KBRIMQKVSA-N 1 1 288.391 3.995 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CC2CC(F)(F)C2)C2CC2)c1 ZINC000296693406 1127681979 /nfs/dbraw/zinc/68/19/79/1127681979.db2.gz DDBJOJXSXPACEY-UHFFFAOYSA-N 1 1 296.317 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC2(CCCC2)C1 ZINC000174272785 1127887681 /nfs/dbraw/zinc/88/76/81/1127887681.db2.gz VRLZBAQNMSHKBH-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO Cc1ccc(C[N@H+]2C[C@@H](C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000539824827 1127940840 /nfs/dbraw/zinc/94/08/40/1127940840.db2.gz LGHUFINXMASNRK-WCQYABFASA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000466903936 1127949636 /nfs/dbraw/zinc/94/96/36/1127949636.db2.gz BALZSDCOPXRKLB-BXUZGUMPSA-N 1 1 262.353 3.524 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543855682 1127949881 /nfs/dbraw/zinc/94/98/81/1127949881.db2.gz KCZAWRADBBZALC-SNVBAGLBSA-N 1 1 270.760 3.869 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@H](C)C1 ZINC000468257580 1128000470 /nfs/dbraw/zinc/00/04/70/1128000470.db2.gz SUNANIUJYJEGTC-QWHCGFSZSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@H](C)C1 ZINC000468260565 1128000319 /nfs/dbraw/zinc/00/03/19/1128000319.db2.gz KYKAOOKDXIHWFW-QWHCGFSZSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@H]2CCCC[C@@H]12 ZINC000542040501 1128048829 /nfs/dbraw/zinc/04/88/29/1128048829.db2.gz LCIRLVLNHXGBGD-WXHSDQCUSA-N 1 1 280.393 3.667 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]1C(C)C ZINC000470175501 1128064737 /nfs/dbraw/zinc/06/47/37/1128064737.db2.gz ZBZHAUSLVKYSCM-LRFDDAOPSA-N 1 1 274.364 3.728 20 5 CHBDMO CCOc1cc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492629367 1128106607 /nfs/dbraw/zinc/10/66/07/1128106607.db2.gz KCUBHLLCROAKCE-BETUJISGSA-N 1 1 292.379 3.756 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@@H](C)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492788329 1128113347 /nfs/dbraw/zinc/11/33/47/1128113347.db2.gz IFNVYXNOICICCG-STQMWFEESA-N 1 1 292.379 3.614 20 5 CHBDMO CC1(C)CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493002900 1128119631 /nfs/dbraw/zinc/11/96/31/1128119631.db2.gz KAXAKJNYONVFTA-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CCCC[N@H+](CC)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494176956 1128158052 /nfs/dbraw/zinc/15/80/52/1128158052.db2.gz SZBOWFGVBHOMAS-UHFFFAOYSA-N 1 1 270.760 3.870 20 5 CHBDMO CCCC[N@@H+](CC)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494176956 1128158055 /nfs/dbraw/zinc/15/80/55/1128158055.db2.gz SZBOWFGVBHOMAS-UHFFFAOYSA-N 1 1 270.760 3.870 20 5 CHBDMO C[C@@H]1CCCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494196735 1128159881 /nfs/dbraw/zinc/15/98/81/1128159881.db2.gz ZCVDZFIVXNRLOF-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494196735 1128159883 /nfs/dbraw/zinc/15/98/83/1128159883.db2.gz ZCVDZFIVXNRLOF-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000609195404 1128171062 /nfs/dbraw/zinc/17/10/62/1128171062.db2.gz FUQLOWQATNIRJB-OAHLLOKOSA-N 1 1 276.380 3.914 20 5 CHBDMO C[N@H+](Cc1ccccc1CF)Cc1ccccc1[N+](=O)[O-] ZINC000929165969 1128261541 /nfs/dbraw/zinc/26/15/41/1128261541.db2.gz XYCARYICOPGRNQ-UHFFFAOYSA-N 1 1 288.322 3.696 20 5 CHBDMO C[N@@H+](Cc1ccccc1CF)Cc1ccccc1[N+](=O)[O-] ZINC000929165969 1128261545 /nfs/dbraw/zinc/26/15/45/1128261545.db2.gz XYCARYICOPGRNQ-UHFFFAOYSA-N 1 1 288.322 3.696 20 5 CHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCSC1 ZINC000495079244 1128229027 /nfs/dbraw/zinc/22/90/27/1128229027.db2.gz MWJLEGKBGUJELX-CQSZACIVSA-N 1 1 294.420 3.558 20 5 CHBDMO Cc1cscc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000094881100 1128273770 /nfs/dbraw/zinc/27/37/70/1128273770.db2.gz SWOLQTANNOUUJN-UHFFFAOYSA-N 1 1 296.779 3.908 20 5 CHBDMO CCC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000174846624 1128506880 /nfs/dbraw/zinc/50/68/80/1128506880.db2.gz WTYZAKBWQBQMAB-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(Cl)c1 ZINC000042366032 1128575538 /nfs/dbraw/zinc/57/55/38/1128575538.db2.gz ITJHLGNXHQMRKC-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO C[N@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704820 1128722763 /nfs/dbraw/zinc/72/27/63/1128722763.db2.gz OUZSWJZYEHSPFX-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704820 1128722766 /nfs/dbraw/zinc/72/27/66/1128722766.db2.gz OUZSWJZYEHSPFX-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000430194002 1117841218 /nfs/dbraw/zinc/84/12/18/1117841218.db2.gz HSARYLYYBFSMDN-OCCSQVGLSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@@H](C)[C@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000064808238 1117879536 /nfs/dbraw/zinc/87/95/36/1117879536.db2.gz LIGHQTXNIJNEPO-OLZOCXBDSA-N 1 1 276.380 3.994 20 5 CHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000610215476 1117881998 /nfs/dbraw/zinc/88/19/98/1117881998.db2.gz YFNVAUZJTUMUNJ-NWDGAFQWSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610215478 1117882021 /nfs/dbraw/zinc/88/20/21/1117882021.db2.gz YFNVAUZJTUMUNJ-VXGBXAGGSA-N 1 1 280.343 3.744 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000430284716 1117992782 /nfs/dbraw/zinc/99/27/82/1117992782.db2.gz OVDUSJLZULTVCY-YPMHNXCESA-N 1 1 260.337 3.554 20 5 CHBDMO CC[N@H+](Cc1ccoc1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000075684216 1128764369 /nfs/dbraw/zinc/76/43/69/1128764369.db2.gz PKLVBZKCINYRRV-LBPRGKRZSA-N 1 1 274.320 3.771 20 5 CHBDMO CC[N@@H+](Cc1ccoc1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000075684216 1128764373 /nfs/dbraw/zinc/76/43/73/1128764373.db2.gz PKLVBZKCINYRRV-LBPRGKRZSA-N 1 1 274.320 3.771 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1cccc(F)c1 ZINC000084439807 1118356410 /nfs/dbraw/zinc/35/64/10/1118356410.db2.gz IKDRVFAHIJSBTF-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000033299959 1118721859 /nfs/dbraw/zinc/72/18/59/1118721859.db2.gz QORYOCYECXKNSZ-XFFZJAGNSA-N 1 1 282.343 3.740 20 5 CHBDMO CC1(C)CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000510535152 1118767027 /nfs/dbraw/zinc/76/70/27/1118767027.db2.gz SUIVWSJSPSEZKP-YVMONPNESA-N 1 1 274.364 3.730 20 5 CHBDMO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC000610619776 1118798618 /nfs/dbraw/zinc/79/86/18/1118798618.db2.gz YSVJSWJRFZNYFI-UHFFFAOYSA-N 1 1 295.342 3.708 20 5 CHBDMO C[N@@H+](Cc1cc2ccccc2[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC000610619776 1118798619 /nfs/dbraw/zinc/79/86/19/1118798619.db2.gz YSVJSWJRFZNYFI-UHFFFAOYSA-N 1 1 295.342 3.708 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)c(F)c1 ZINC000044437940 1119325915 /nfs/dbraw/zinc/32/59/15/1119325915.db2.gz RMKTWZZRVWLMNH-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)c(F)c1 ZINC000044437940 1119325920 /nfs/dbraw/zinc/32/59/20/1119325920.db2.gz RMKTWZZRVWLMNH-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000583603106 1119384412 /nfs/dbraw/zinc/38/44/12/1119384412.db2.gz UUMXNDKARUPQEH-UKRRQHHQSA-N 1 1 297.358 3.540 20 5 CHBDMO Cc1cccc([C@@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000541388096 1120314987 /nfs/dbraw/zinc/31/49/87/1120314987.db2.gz ZRJBWRAHASTTMW-QGZVFWFLSA-N 1 1 296.370 3.893 20 5 CHBDMO Cc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c(C)o1 ZINC000313812437 1120411641 /nfs/dbraw/zinc/41/16/41/1120411641.db2.gz BGJMUCOFTGCYAB-SNVBAGLBSA-N 1 1 292.310 3.795 20 5 CHBDMO Cc1cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c(C)o1 ZINC000313812434 1120411755 /nfs/dbraw/zinc/41/17/55/1120411755.db2.gz BGJMUCOFTGCYAB-JTQLQIEISA-N 1 1 292.310 3.795 20 5 CHBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000053428446 1120497544 /nfs/dbraw/zinc/49/75/44/1120497544.db2.gz CLWIUNZMVOCVIC-NSHDSACASA-N 1 1 276.361 3.849 20 5 CHBDMO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000092328220 1120540415 /nfs/dbraw/zinc/54/04/15/1120540415.db2.gz XTAQETAOWVSBRD-ZJUUUORDSA-N 1 1 289.335 3.611 20 5 CHBDMO CCC[C@H]([NH2+]Cc1cc(C)no1)c1cccc([N+](=O)[O-])c1 ZINC000044986226 1120742796 /nfs/dbraw/zinc/74/27/96/1120742796.db2.gz NTZIXMJQPCMOLG-HNNXBMFYSA-N 1 1 289.335 3.522 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)C(C)C ZINC000112629144 1120840036 /nfs/dbraw/zinc/84/00/36/1120840036.db2.gz FUSKAPLONTWTNC-CYBMUJFWSA-N 1 1 264.369 3.504 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000511970253 1120946646 /nfs/dbraw/zinc/94/66/46/1120946646.db2.gz BVRYCWBQXWWRIV-GFCCVEGCSA-N 1 1 286.331 3.697 20 5 CHBDMO CC[C@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493002272 1120965111 /nfs/dbraw/zinc/96/51/11/1120965111.db2.gz IFBOMATWYUKCFZ-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000032132146 1121054657 /nfs/dbraw/zinc/05/46/57/1121054657.db2.gz QKKGJBCRUWXLRD-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ccoc2)o1 ZINC000171050679 1121088193 /nfs/dbraw/zinc/08/81/93/1121088193.db2.gz SKPNWKNZXUMEGS-UHFFFAOYSA-N 1 1 298.298 3.738 20 5 CHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000512230856 1121212684 /nfs/dbraw/zinc/21/26/84/1121212684.db2.gz VJLNWKNJRNKMRF-QQBNSCQMSA-N 1 1 276.380 3.974 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)C(C)C ZINC000706418026 1121429290 /nfs/dbraw/zinc/42/92/90/1121429290.db2.gz DZPJOOZBOSXJKZ-LLVKDONJSA-N 1 1 268.332 3.600 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC23CCCC3)ccc1Cl ZINC000707131846 1121450465 /nfs/dbraw/zinc/45/04/65/1121450465.db2.gz XEFWMHIAJOQJAE-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC23CCCC3)ccc1Cl ZINC000707131846 1121450466 /nfs/dbraw/zinc/45/04/66/1121450466.db2.gz XEFWMHIAJOQJAE-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO C[C@@H]1c2sccc2CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001175828546 1121468413 /nfs/dbraw/zinc/46/84/13/1121468413.db2.gz BNFIHKRWKXGTTP-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H]1c2sccc2CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001175828546 1121468417 /nfs/dbraw/zinc/46/84/17/1121468417.db2.gz BNFIHKRWKXGTTP-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO Cc1[nH+]c2ccccn2c1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175898946 1121491977 /nfs/dbraw/zinc/49/19/77/1121491977.db2.gz GMOGRKHKYRXBTM-PKNBQFBNSA-N 1 1 294.314 3.634 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC=C(C)CC1 ZINC000470181799 1121533996 /nfs/dbraw/zinc/53/39/96/1121533996.db2.gz HBJXEWVPSMQCIK-GXDHUFHOSA-N 1 1 272.348 3.650 20 5 CHBDMO CCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000037096132 1121600476 /nfs/dbraw/zinc/60/04/76/1121600476.db2.gz SZSABBQJDSASNY-UHFFFAOYSA-N 1 1 270.760 3.869 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccsc1 ZINC000611203936 1121630970 /nfs/dbraw/zinc/63/09/70/1121630970.db2.gz FMKCJMMRQWTOAD-LLVKDONJSA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccsc1 ZINC000611203936 1121630974 /nfs/dbraw/zinc/63/09/74/1121630974.db2.gz FMKCJMMRQWTOAD-LLVKDONJSA-N 1 1 276.361 3.849 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000619785417 1129013471 /nfs/dbraw/zinc/01/34/71/1129013471.db2.gz QYJBZZBBXPNIPV-GOSISDBHSA-N 1 1 296.370 3.757 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000505337650 1122357642 /nfs/dbraw/zinc/35/76/42/1122357642.db2.gz KUEHVBCJJRNQMI-CLFYSBASSA-N 1 1 274.364 3.873 20 5 CHBDMO CCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(C)C ZINC000434835157 1122416198 /nfs/dbraw/zinc/41/61/98/1122416198.db2.gz ZBFCXQZOVPYQOB-UHFFFAOYSA-N 1 1 291.351 3.604 20 5 CHBDMO CCCC[N@@H+](CC)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000505908656 1122598741 /nfs/dbraw/zinc/59/87/41/1122598741.db2.gz ZJPIVEFDDLFJSA-CSKARUKUSA-N 1 1 262.353 3.730 20 5 CHBDMO CCC1(CC)CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC001193430324 1122691438 /nfs/dbraw/zinc/69/14/38/1122691438.db2.gz HDAKEEXIAKNBNJ-UHFFFAOYSA-N 1 1 291.395 3.782 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1(C)CCCC1 ZINC000426496171 1122806597 /nfs/dbraw/zinc/80/65/97/1122806597.db2.gz JIHHUDNGXPKLMZ-CLFYSBASSA-N 1 1 274.364 3.873 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426524701 1122812232 /nfs/dbraw/zinc/81/22/32/1122812232.db2.gz PNQPWWYAGKGMAB-ZWNOBZJWSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3CCC[C@H]32)c(Cl)c1 ZINC000426525044 1122814348 /nfs/dbraw/zinc/81/43/48/1122814348.db2.gz QCDTYULCFMMBKH-IINYFYTJSA-N 1 1 280.755 3.623 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000506751213 1122821721 /nfs/dbraw/zinc/82/17/21/1122821721.db2.gz IABYJZXORWKDHW-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1C(C)(C)C ZINC001195279151 1122860130 /nfs/dbraw/zinc/86/01/30/1122860130.db2.gz NAKHHFBUDJJEIB-UONOGXRCSA-N 1 1 291.395 3.636 20 5 CHBDMO CCCC[N@@H+](CC)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037403786 1123028457 /nfs/dbraw/zinc/02/84/57/1123028457.db2.gz BUUYRBXUZBFBRK-UHFFFAOYSA-N 1 1 270.760 3.870 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000035010714 1124022184 /nfs/dbraw/zinc/02/21/84/1124022184.db2.gz CSURDDIGLGYZOY-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000525309046 1124121987 /nfs/dbraw/zinc/12/19/87/1124121987.db2.gz RJFBFJQDVGUKMK-NSHDSACASA-N 1 1 268.382 3.524 20 5 CHBDMO Cc1csc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872075955 1124675689 /nfs/dbraw/zinc/67/56/89/1124675689.db2.gz GXJJCJDLEZUGNX-SNVBAGLBSA-N 1 1 294.351 3.955 20 5 CHBDMO Cc1cc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)ccc1F ZINC000449373647 1124704496 /nfs/dbraw/zinc/70/44/96/1124704496.db2.gz SYAKTFYFQRTNFQ-SNVBAGLBSA-N 1 1 294.351 3.955 20 5 CHBDMO CS[C@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000449446813 1124740896 /nfs/dbraw/zinc/74/08/96/1124740896.db2.gz UJXZGWGHKKGQNG-ZDUSSCGKSA-N 1 1 294.420 3.656 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000124847712 1124822180 /nfs/dbraw/zinc/82/21/80/1124822180.db2.gz BNWFIJBECUQGOX-ZDUSSCGKSA-N 1 1 280.343 3.889 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000441432669 1125011813 /nfs/dbraw/zinc/01/18/13/1125011813.db2.gz FBGVBRHDFBIHML-CJNGLKHVSA-N 1 1 274.364 3.668 20 5 CHBDMO C[C@H](c1ccccc1F)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000052074206 1125374463 /nfs/dbraw/zinc/37/44/63/1125374463.db2.gz RZFSRSWKCIPPQT-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1ccccc1F)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000052074206 1125374464 /nfs/dbraw/zinc/37/44/64/1125374464.db2.gz RZFSRSWKCIPPQT-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO CC(C)(C)C(=[NH2+])Nc1ccc2ccc([N+](=O)[O-])cc2n1 ZINC001155181767 1129444937 /nfs/dbraw/zinc/44/49/37/1129444937.db2.gz ZWVUSLHIBJIMKZ-UHFFFAOYSA-N 1 1 272.308 3.578 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303585910 1129547414 /nfs/dbraw/zinc/54/74/14/1129547414.db2.gz QKEONIOIVOHQCG-KRWDZBQOSA-N 1 1 286.375 3.917 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC001168859796 1129678142 /nfs/dbraw/zinc/67/81/42/1129678142.db2.gz RQQRVXBBFFULMV-UHFFFAOYSA-N 1 1 296.370 3.888 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC12CCC2 ZINC000801526345 1129924096 /nfs/dbraw/zinc/92/40/96/1129924096.db2.gz LFFBWQXLYCFMPY-LBPRGKRZSA-N 1 1 292.354 3.746 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCC12CCC2 ZINC000769984467 1129934871 /nfs/dbraw/zinc/93/48/71/1129934871.db2.gz OEJUVEPNUHXYSI-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746663603 1130141880 /nfs/dbraw/zinc/14/18/80/1130141880.db2.gz SHBOGSZUJBWDNZ-ZDUSSCGKSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746671307 1130145146 /nfs/dbraw/zinc/14/51/46/1130145146.db2.gz HVDUWEYMNOHRBV-SNVBAGLBSA-N 1 1 270.760 3.726 20 5 CHBDMO CC[C@@H]1CC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)[C@H]1C ZINC001462127893 1130205294 /nfs/dbraw/zinc/20/52/94/1130205294.db2.gz SYWQBVABMFILMF-UONOGXRCSA-N 1 1 276.380 3.832 20 5 CHBDMO COc1ccc(C[C@@H](C)[N@@H+](C)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC001170348563 1130486946 /nfs/dbraw/zinc/48/69/46/1130486946.db2.gz YMSUAOPMDHNZQO-GFCCVEGCSA-N 1 1 294.395 3.512 20 5 CHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000782107231 1130755598 /nfs/dbraw/zinc/75/55/98/1130755598.db2.gz LFQHECREIDQWIP-WBMJQRKESA-N 1 1 292.354 3.746 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+]([C@H]1CCc3ccccc31)C2 ZINC000782181902 1130757452 /nfs/dbraw/zinc/75/74/52/1130757452.db2.gz JMMJKVYXTNHYHC-KRWDZBQOSA-N 1 1 294.354 3.640 20 5 CHBDMO CC[N@@H+](CCC1CC1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783674785 1130847442 /nfs/dbraw/zinc/84/74/42/1130847442.db2.gz QDOBNUCEBCGAAO-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@@H](CCc1ccccc1)[N@@H+]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116330149 1131140869 /nfs/dbraw/zinc/14/08/69/1131140869.db2.gz WJIPSBBZHSHIKS-AWEZNQCLSA-N 1 1 296.370 3.932 20 5 CHBDMO C[C@@H](CCc1ccccc1)[N@H+]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116330149 1131140874 /nfs/dbraw/zinc/14/08/74/1131140874.db2.gz WJIPSBBZHSHIKS-AWEZNQCLSA-N 1 1 296.370 3.932 20 5 CHBDMO C[N@H+]1CCC[C@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001227764102 1131739230 /nfs/dbraw/zinc/73/92/30/1131739230.db2.gz KMXWEIWDHVGXDM-INIZCTEOSA-N 1 1 292.382 3.861 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036787259 1131974881 /nfs/dbraw/zinc/97/48/81/1131974881.db2.gz TXPGEZOTDITFFG-SNVBAGLBSA-N 1 1 270.760 3.725 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCC1 ZINC000037092741 1131994002 /nfs/dbraw/zinc/99/40/02/1131994002.db2.gz MNWABCHCCCCPKS-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccns1 ZINC000716015241 1132007636 /nfs/dbraw/zinc/00/76/36/1132007636.db2.gz PKSPOQWIRVBSIR-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H]3CCCC[C@H]32)c(Cl)c1 ZINC001171757116 1132090386 /nfs/dbraw/zinc/09/03/86/1132090386.db2.gz XGRPJIHTRPWOSX-BXUZGUMPSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H]3CCCC[C@H]32)c(Cl)c1 ZINC001171757116 1132090395 /nfs/dbraw/zinc/09/03/95/1132090395.db2.gz XGRPJIHTRPWOSX-BXUZGUMPSA-N 1 1 280.755 3.623 20 5 CHBDMO C[N@H+]1CCC[C@@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001230203231 1132159434 /nfs/dbraw/zinc/15/94/34/1132159434.db2.gz KBDRXYHHPJARIQ-OAHLLOKOSA-N 1 1 292.382 3.861 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCCC[C@H]1C ZINC001173227369 1132412420 /nfs/dbraw/zinc/41/24/20/1132412420.db2.gz QGMDUPPVNQFLSF-KGLIPLIRSA-N 1 1 276.380 3.790 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](C)(F)CC1 ZINC001173229113 1132412632 /nfs/dbraw/zinc/41/26/32/1132412632.db2.gz PZRCPOGRUSSVTJ-BBRMVZONSA-N 1 1 294.370 3.740 20 5 CHBDMO CCC[N@@H+](CC1CC1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173226580 1132412718 /nfs/dbraw/zinc/41/27/18/1132412718.db2.gz MRACCAAZZHIDLQ-CYBMUJFWSA-N 1 1 276.380 3.648 20 5 CHBDMO CCCC[N@@H+](CC)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225417 1132412875 /nfs/dbraw/zinc/41/28/75/1132412875.db2.gz JWHFLLGLFPQPJW-CYBMUJFWSA-N 1 1 264.369 3.648 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]1c1ccccc1 ZINC001173233763 1132413558 /nfs/dbraw/zinc/41/35/58/1132413558.db2.gz NETIMAOYHQFIIN-RDTXWAMCSA-N 1 1 296.370 3.973 20 5 CHBDMO CCC[N@@H+](CC(C)C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232429 1132413627 /nfs/dbraw/zinc/41/36/27/1132413627.db2.gz RFTWRTODIBQWAW-AWEZNQCLSA-N 1 1 278.396 3.894 20 5 CHBDMO c1cnc2c(c1)ccc1ccc(C[N@H+]3CCC4(CC4)C3)nc12 ZINC001232218695 1132439362 /nfs/dbraw/zinc/43/93/62/1132439362.db2.gz KACQYBQZIIJLRN-UHFFFAOYSA-N 1 1 289.382 3.769 20 5 CHBDMO C[NH+]1CC(Oc2c3ccccc3cc3ccccc32)C1 ZINC001233658222 1132658542 /nfs/dbraw/zinc/65/85/42/1132658542.db2.gz AGIIQYMWKSZEBB-UHFFFAOYSA-N 1 1 263.340 3.686 20 5 CHBDMO CC(C)(C)C(=[NH2+])Nc1ncc(F)c2cc([N+](=O)[O-])ccc12 ZINC001162662192 1133101436 /nfs/dbraw/zinc/10/14/36/1133101436.db2.gz QESKWVWPKFLFBS-UHFFFAOYSA-N 1 1 290.298 3.717 20 5 CHBDMO CCC[N@@H+](CC)C[C@@H](C)Nc1cc(C)c([N+](=O)[O-])cc1F ZINC001163419908 1133148902 /nfs/dbraw/zinc/14/89/02/1133148902.db2.gz UDUKDPORQGWTJI-GFCCVEGCSA-N 1 1 297.374 3.575 20 5 CHBDMO CC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000080263528 260178701 /nfs/dbraw/zinc/17/87/01/260178701.db2.gz PNJIGQGDUFZUGW-GXFFZTMASA-N 1 1 291.376 3.853 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394054091 260212768 /nfs/dbraw/zinc/21/27/68/260212768.db2.gz SIPUFCMWRJRHPW-LLVKDONJSA-N 1 1 268.332 3.744 20 5 CHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ccco2)o1 ZINC000102419385 261236770 /nfs/dbraw/zinc/23/67/70/261236770.db2.gz IBIMHGCALSZBGZ-UHFFFAOYSA-N 1 1 298.298 3.738 20 5 CHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000519001673 265289978 /nfs/dbraw/zinc/28/99/78/265289978.db2.gz MOAGPHGKKHPOTJ-JSGCOSHPSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC12CCC2 ZINC000357025720 266235600 /nfs/dbraw/zinc/23/56/00/266235600.db2.gz PMPDFEXBYJYGHX-GFCCVEGCSA-N 1 1 292.354 3.746 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@H](C)CC2)cccc1[N+](=O)[O-] ZINC000357117670 266250758 /nfs/dbraw/zinc/25/07/58/266250758.db2.gz OSBHDKHXJVQWAD-LBPRGKRZSA-N 1 1 262.353 3.525 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000531782314 328033697 /nfs/dbraw/zinc/03/36/97/328033697.db2.gz WSILSXWVKZEQLP-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO C[C@H]([N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000534349906 328047889 /nfs/dbraw/zinc/04/78/89/328047889.db2.gz AWADKSQPNUSLEK-KJJQSCHISA-N 1 1 276.380 3.974 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303681238 328357530 /nfs/dbraw/zinc/35/75/30/328357530.db2.gz JCMLRCIOENVNIA-KMFMINBZSA-N 1 1 288.391 3.790 20 5 CHBDMO Cc1ccc(C[N@@H+](Cc2ccccn2)C(C)C)cc1[N+](=O)[O-] ZINC000535081532 328385336 /nfs/dbraw/zinc/38/53/36/328385336.db2.gz BXFHJEMPTRMLEN-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO CCc1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])o1 ZINC000089512368 327170737 /nfs/dbraw/zinc/17/07/37/327170737.db2.gz MRKKKKLNMNDYHW-LLVKDONJSA-N 1 1 274.320 3.601 20 5 CHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C(C)(C)C ZINC000577507509 327263737 /nfs/dbraw/zinc/26/37/37/327263737.db2.gz FWKNLKKZFDFWLN-UHFFFAOYSA-N 1 1 290.285 3.844 20 5 CHBDMO CSCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000173565052 329149347 /nfs/dbraw/zinc/14/93/47/329149347.db2.gz DUHMCTLBBNZWGY-UHFFFAOYSA-N 1 1 282.409 3.558 20 5 CHBDMO Cc1occc1C[N@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182687810 329244076 /nfs/dbraw/zinc/24/40/76/329244076.db2.gz RSCGLWDQLQLRFV-GFCCVEGCSA-N 1 1 288.347 3.998 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[NH2+]C2(C(F)F)CCCCC2)cc1 ZINC000510155094 332895075 /nfs/dbraw/zinc/89/50/75/332895075.db2.gz VHPJMZHHURJPAH-UHFFFAOYSA-N 1 1 298.333 3.695 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H]1C(C)C ZINC000470175503 331044313 /nfs/dbraw/zinc/04/43/13/331044313.db2.gz ZBZHAUSLVKYSCM-RCBBPTIPSA-N 1 1 274.364 3.728 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC3(C2)CCCCC3)c(F)c1 ZINC000459601441 331290213 /nfs/dbraw/zinc/29/02/13/331290213.db2.gz XZQKTTBPFRPKDE-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000464772608 331367261 /nfs/dbraw/zinc/36/72/61/331367261.db2.gz IESLJUJPBWYMQW-OAHLLOKOSA-N 1 1 280.343 3.746 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000490084244 332080961 /nfs/dbraw/zinc/08/09/61/332080961.db2.gz IKPNQZUUPIJFJP-TUKIKUTGSA-N 1 1 274.364 3.552 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490551769 332091255 /nfs/dbraw/zinc/09/12/55/332091255.db2.gz ZJQKRJKTPPJZNU-HSMVNMDESA-N 1 1 292.354 3.887 20 5 CHBDMO Cc1c(C[N@@H+]2CCCC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000516994721 333089123 /nfs/dbraw/zinc/08/91/23/333089123.db2.gz TYJJRILJHLEZLK-OAHLLOKOSA-N 1 1 276.380 3.914 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCSC[C@H](C)C1 ZINC000190425426 333206770 /nfs/dbraw/zinc/20/67/70/333206770.db2.gz AEEIOIUADBJOLX-DGCLKSJQSA-N 1 1 294.420 3.649 20 5 CHBDMO CC[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522554082 333289815 /nfs/dbraw/zinc/28/98/15/333289815.db2.gz GLTNRTHBGSJTEJ-LBPRGKRZSA-N 1 1 268.744 3.623 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000524610298 333368707 /nfs/dbraw/zinc/36/87/07/333368707.db2.gz XRLISXNGBRSMOD-CQSZACIVSA-N 1 1 292.379 3.628 20 5 CHBDMO C[C@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422555 334191759 /nfs/dbraw/zinc/19/17/59/334191759.db2.gz IXUVUQQYJLEODE-SUMWQHHRSA-N 1 1 282.343 3.788 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422555 334191760 /nfs/dbraw/zinc/19/17/60/334191760.db2.gz IXUVUQQYJLEODE-SUMWQHHRSA-N 1 1 282.343 3.788 20 5 CHBDMO Cc1c(C[N@H+]2CC[C@H](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000550051469 334211992 /nfs/dbraw/zinc/21/19/92/334211992.db2.gz VGGSWVPSVIQAAR-CQSZACIVSA-N 1 1 274.364 3.525 20 5 CHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@@H]21 ZINC000550442913 334222648 /nfs/dbraw/zinc/22/26/48/334222648.db2.gz BTUXODZBHCEPIJ-HOTGVXAUSA-N 1 1 288.391 3.648 20 5 CHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)o1 ZINC000576314309 335188597 /nfs/dbraw/zinc/18/85/97/335188597.db2.gz NHJHWZYHCPXUSZ-UHFFFAOYSA-N 1 1 294.738 3.516 20 5 CHBDMO C[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000291489513 524919966 /nfs/dbraw/zinc/91/99/66/524919966.db2.gz GMCMBCZWTSJDFW-FVOPLDGLSA-N 1 1 296.317 3.585 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000037151289 525613918 /nfs/dbraw/zinc/61/39/18/525613918.db2.gz RSZZHWDHBLQZLS-NEPJUHHUSA-N 1 1 286.331 3.712 20 5 CHBDMO O=[N+]([O-])c1ccc(CNc2cccc(C3CC3)[nH+]2)c(F)c1 ZINC000339428929 527352741 /nfs/dbraw/zinc/35/27/41/527352741.db2.gz IOUXFFWFMYDWRB-UHFFFAOYSA-N 1 1 287.294 3.618 20 5 CHBDMO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2CF)cc1[N+](=O)[O-] ZINC000354519720 528092533 /nfs/dbraw/zinc/09/25/33/528092533.db2.gz HHSFPBLZEWRHAH-CYBMUJFWSA-N 1 1 280.343 3.652 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2CF)cc1[N+](=O)[O-] ZINC000354519720 528092537 /nfs/dbraw/zinc/09/25/37/528092537.db2.gz HHSFPBLZEWRHAH-CYBMUJFWSA-N 1 1 280.343 3.652 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1cccc([N+](=O)[O-])c1 ZINC000147771087 1125505311 /nfs/dbraw/zinc/50/53/11/1125505311.db2.gz REIORKNZLUNDLR-QWRGUYRKSA-N 1 1 289.310 3.541 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cn1)c1cccc([N+](=O)[O-])c1 ZINC000147771693 1125505770 /nfs/dbraw/zinc/50/57/70/1125505770.db2.gz REIORKNZLUNDLR-GHMZBOCLSA-N 1 1 289.310 3.541 20 5 CHBDMO CC[C@H](C)[N@@H+](Cc1ccccc1)Cc1cccnc1[N+](=O)[O-] ZINC000885944840 1125628763 /nfs/dbraw/zinc/62/87/63/1125628763.db2.gz VYJQQNMHHSYQOU-AWEZNQCLSA-N 1 1 299.374 3.791 20 5 CHBDMO Cc1ccccc1[C@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000885960569 1125630258 /nfs/dbraw/zinc/63/02/58/1125630258.db2.gz NBVCRXASJNZYCO-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO C[N@H+](CCCF)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000887142676 1125753507 /nfs/dbraw/zinc/75/35/07/1125753507.db2.gz VPOFVDVAFMUOIJ-UHFFFAOYSA-N 1 1 295.141 3.693 20 5 CHBDMO C[N@@H+](CCCF)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000887142676 1125753517 /nfs/dbraw/zinc/75/35/17/1125753517.db2.gz VPOFVDVAFMUOIJ-UHFFFAOYSA-N 1 1 295.141 3.693 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccncc1F)c1cccc([N+](=O)[O-])c1 ZINC000338020068 1126711493 /nfs/dbraw/zinc/71/14/93/1126711493.db2.gz PUBRDDPNKWNHHY-QWRGUYRKSA-N 1 1 289.310 3.541 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000138871905 1126747495 /nfs/dbraw/zinc/74/74/95/1126747495.db2.gz ZLGJRVIXJCIIKE-MRXNPFEDSA-N 1 1 298.342 3.638 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](CC2CC2)CC2CCC2)cc1 ZINC000483284691 1126778699 /nfs/dbraw/zinc/77/86/99/1126778699.db2.gz IKIKCCNAZMDCBJ-UHFFFAOYSA-N 1 1 288.391 3.649 20 5 CHBDMO CC1=C(C)C[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000483370595 1126783840 /nfs/dbraw/zinc/78/38/40/1126783840.db2.gz GUXAICZPRAMCNX-ZDUSSCGKSA-N 1 1 260.337 3.698 20 5 CHBDMO Cc1cc[nH+]c(N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000182638534 1126875097 /nfs/dbraw/zinc/87/50/97/1126875097.db2.gz DZFOJDTVKPCTFG-GFCCVEGCSA-N 1 1 271.320 3.780 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccnc1 ZINC000270552632 1127057855 /nfs/dbraw/zinc/05/78/55/1127057855.db2.gz BRIKLTGVUIJAFR-CYBMUJFWSA-N 1 1 285.347 3.573 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000029482277 1127123796 /nfs/dbraw/zinc/12/37/96/1127123796.db2.gz DGLKHFKSEQXVOB-KRWDZBQOSA-N 1 1 282.343 3.714 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000054993498 1127146985 /nfs/dbraw/zinc/14/69/85/1127146985.db2.gz SBRFAEADJJJXDL-MRXNPFEDSA-N 1 1 282.343 3.932 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@H]21 ZINC000590204436 1127251647 /nfs/dbraw/zinc/25/16/47/1127251647.db2.gz MMPXQBMFCIKLGR-CABCVRRESA-N 1 1 274.364 3.605 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCC[C@@H]21 ZINC000590204437 1127251734 /nfs/dbraw/zinc/25/17/34/1127251734.db2.gz MMPXQBMFCIKLGR-GJZGRUSLSA-N 1 1 274.364 3.605 20 5 CHBDMO CC(C)[C@@H]1[N@H+](Cc2csc([N+](=O)[O-])c2)CC12CC=CC2 ZINC000592529030 1127353546 /nfs/dbraw/zinc/35/35/46/1127353546.db2.gz WBMBXYNLECQLOX-AWEZNQCLSA-N 1 1 292.404 3.833 20 5 CHBDMO CC(C)[C@@H]1[N@@H+](Cc2csc([N+](=O)[O-])c2)CC12CC=CC2 ZINC000592529030 1127353551 /nfs/dbraw/zinc/35/35/51/1127353551.db2.gz WBMBXYNLECQLOX-AWEZNQCLSA-N 1 1 292.404 3.833 20 5 CHBDMO CCC[N@H+](Cc1onc(C)c1[N+](=O)[O-])CC1CCCCC1 ZINC000595295839 1127457430 /nfs/dbraw/zinc/45/74/30/1127457430.db2.gz UCONDCKYTLGHAO-UHFFFAOYSA-N 1 1 295.383 3.684 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000360701404 1127506687 /nfs/dbraw/zinc/50/66/87/1127506687.db2.gz FSYANFLWCGZGDI-UHFFFAOYSA-N 1 1 294.354 3.642 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000360701404 1127506689 /nfs/dbraw/zinc/50/66/89/1127506689.db2.gz FSYANFLWCGZGDI-UHFFFAOYSA-N 1 1 294.354 3.642 20 5 CHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)CC(C)(C)C ZINC000361018607 1127530037 /nfs/dbraw/zinc/53/00/37/1127530037.db2.gz SYBPILMHGSGWNA-UHFFFAOYSA-N 1 1 256.371 3.524 20 5 CHBDMO COc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000361396343 1127560811 /nfs/dbraw/zinc/56/08/11/1127560811.db2.gz GASDNYLTAQXVIZ-OAHLLOKOSA-N 1 1 298.342 3.550 20 5 CHBDMO COc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000361396343 1127560814 /nfs/dbraw/zinc/56/08/14/1127560814.db2.gz GASDNYLTAQXVIZ-OAHLLOKOSA-N 1 1 298.342 3.550 20 5 CHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CC(F)(F)C1 ZINC000295650176 1127649148 /nfs/dbraw/zinc/64/91/48/1127649148.db2.gz ZGMRCESWGVOMFP-UHFFFAOYSA-N 1 1 298.333 3.851 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000604013249 1127689405 /nfs/dbraw/zinc/68/94/05/1127689405.db2.gz YAPJRJYMNTWLTG-HNNXBMFYSA-N 1 1 274.364 3.749 20 5 CHBDMO C[C@H]([N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000604012214 1127689423 /nfs/dbraw/zinc/68/94/23/1127689423.db2.gz MBPUWGTVMJGFDV-ZDUSSCGKSA-N 1 1 294.395 3.730 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000604012897 1127689675 /nfs/dbraw/zinc/68/96/75/1127689675.db2.gz CNZMEIAHLGRYFB-INIZCTEOSA-N 1 1 274.364 3.749 20 5 CHBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccsc2[N+](=O)[O-])C1 ZINC000604433472 1127705384 /nfs/dbraw/zinc/70/53/84/1127705384.db2.gz JSAUWWVLFSUXJX-LBPRGKRZSA-N 1 1 297.424 3.580 20 5 CHBDMO CCC(CC)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000604434777 1127705810 /nfs/dbraw/zinc/70/58/10/1127705810.db2.gz GDJPXFHEZDKEJO-UHFFFAOYSA-N 1 1 262.353 3.748 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001168423485 1127829430 /nfs/dbraw/zinc/82/94/30/1127829430.db2.gz KWXJCPVZMSTGHR-LLVKDONJSA-N 1 1 280.343 3.602 20 5 CHBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2ccccc2[N+](=O)[O-])C1 ZINC000608856069 1127892534 /nfs/dbraw/zinc/89/25/34/1127892534.db2.gz BYCZOPKLGNVOEI-ZDUSSCGKSA-N 1 1 291.395 3.517 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000544610839 1127979385 /nfs/dbraw/zinc/97/93/85/1127979385.db2.gz AYARAMPNEKWKJS-KRWDZBQOSA-N 1 1 296.370 3.720 20 5 CHBDMO CC[C@]1(C)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468138132 1127995244 /nfs/dbraw/zinc/99/52/44/1127995244.db2.gz KHUBSAJGCZYWAD-SWLSCSKDSA-N 1 1 262.353 3.778 20 5 CHBDMO CC[N@@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1C ZINC000541776147 1128037318 /nfs/dbraw/zinc/03/73/18/1128037318.db2.gz MYVPRCNKOSJRQH-UHFFFAOYSA-N 1 1 290.388 3.987 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C)[C@@H]1C ZINC000470180545 1128065228 /nfs/dbraw/zinc/06/52/28/1128065228.db2.gz OQZOPUGEGPPXTC-ZJTSMVRJSA-N 1 1 274.364 3.728 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H](C)C1CC1 ZINC000470176947 1128065552 /nfs/dbraw/zinc/06/55/52/1128065552.db2.gz ZFZILGASWFLYQI-SRXBQZRASA-N 1 1 274.364 3.728 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492558016 1128103499 /nfs/dbraw/zinc/10/34/99/1128103499.db2.gz KCGUJSNWXBZEKV-LBPRGKRZSA-N 1 1 280.368 3.614 20 5 CHBDMO CC[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCC1 ZINC000493162141 1128126650 /nfs/dbraw/zinc/12/66/50/1128126650.db2.gz WANVMTVXTUMLQF-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCC1 ZINC000493162141 1128126651 /nfs/dbraw/zinc/12/66/51/1128126651.db2.gz WANVMTVXTUMLQF-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CCCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609193558 1128170652 /nfs/dbraw/zinc/17/06/52/1128170652.db2.gz RTPYNELKGFSTSW-UHFFFAOYSA-N 1 1 280.368 3.614 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1CCCC1 ZINC000609193331 1128170836 /nfs/dbraw/zinc/17/08/36/1128170836.db2.gz BCVLWLOUJRQJLL-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000609195400 1128170859 /nfs/dbraw/zinc/17/08/59/1128170859.db2.gz FUQLOWQATNIRJB-HNNXBMFYSA-N 1 1 276.380 3.914 20 5 CHBDMO CC(C)CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609193110 1128170919 /nfs/dbraw/zinc/17/09/19/1128170919.db2.gz HMEUTPFOJVWTLW-UHFFFAOYSA-N 1 1 294.395 3.860 20 5 CHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCSC1 ZINC000495079243 1128229309 /nfs/dbraw/zinc/22/93/09/1128229309.db2.gz MWJLEGKBGUJELX-AWEZNQCLSA-N 1 1 294.420 3.558 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccccc2)c1 ZINC000035368064 1128291863 /nfs/dbraw/zinc/29/18/63/1128291863.db2.gz ROFJCNFPLYKYCO-UHFFFAOYSA-N 1 1 276.723 3.538 20 5 CHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000915685328 1128334086 /nfs/dbraw/zinc/33/40/86/1128334086.db2.gz VEFPDVRKNMDXGB-BXUZGUMPSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[N@@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])cc2)c1 ZINC000301117380 1128389495 /nfs/dbraw/zinc/38/94/95/1128389495.db2.gz MNCGZORNUVMRIL-UHFFFAOYSA-N 1 1 299.374 3.659 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])C(C)(C)C ZINC000917099010 1128479346 /nfs/dbraw/zinc/47/93/46/1128479346.db2.gz ZYXGRPFQRXPGRB-JTQLQIEISA-N 1 1 268.332 3.600 20 5 CHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000917835793 1128521996 /nfs/dbraw/zinc/52/19/96/1128521996.db2.gz JLFQXDLKBWJPNQ-HNNXBMFYSA-N 1 1 292.354 3.889 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1cccs1 ZINC000075966854 1128696685 /nfs/dbraw/zinc/69/66/85/1128696685.db2.gz YBTAJPHISUZOHT-LBPRGKRZSA-N 1 1 290.388 3.892 20 5 CHBDMO CC[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609766692 1128725296 /nfs/dbraw/zinc/72/52/96/1128725296.db2.gz FCQPWLZMBGCANO-AWEZNQCLSA-N 1 1 276.380 3.649 20 5 CHBDMO CC(C)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000610133552 1128739513 /nfs/dbraw/zinc/73/95/13/1128739513.db2.gz QKKLSPCLDXRKSR-UHFFFAOYSA-N 1 1 292.379 3.627 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610080165 1128738196 /nfs/dbraw/zinc/73/81/96/1128738196.db2.gz KRQYUHWHDJCPKB-AWEZNQCLSA-N 1 1 292.379 3.628 20 5 CHBDMO CCC(CC)[N@@H+](CCOC)Cc1cccc([N+](=O)[O-])c1C ZINC000064806005 1117851047 /nfs/dbraw/zinc/85/10/47/1117851047.db2.gz RUZGZIKYFRSISY-UHFFFAOYSA-N 1 1 294.395 3.540 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)C[C@@H]1C ZINC000610133400 1128739130 /nfs/dbraw/zinc/73/91/30/1128739130.db2.gz MJQCNADJFPAFHX-OLZOCXBDSA-N 1 1 292.379 3.612 20 5 CHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000610215373 1117882253 /nfs/dbraw/zinc/88/22/53/1117882253.db2.gz JETLCCMMILJNBH-STQMWFEESA-N 1 1 262.353 3.605 20 5 CHBDMO CC(C)C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C(C)C ZINC000509388880 1117934401 /nfs/dbraw/zinc/93/44/01/1117934401.db2.gz SINNEDCIQVTCQN-VQHVLOKHSA-N 1 1 276.380 3.974 20 5 CHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000547747055 1117995904 /nfs/dbraw/zinc/99/59/04/1117995904.db2.gz AICDNNCFNFAFRM-JQWIXIFHSA-N 1 1 268.382 3.667 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609766693 1118008040 /nfs/dbraw/zinc/00/80/40/1118008040.db2.gz FCQPWLZMBGCANO-CQSZACIVSA-N 1 1 276.380 3.649 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000615837596 1128764501 /nfs/dbraw/zinc/76/45/01/1128764501.db2.gz IDVJVQCSLFEVIK-KXWHGCDGSA-N 1 1 292.354 3.678 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000615837596 1128764504 /nfs/dbraw/zinc/76/45/04/1128764504.db2.gz IDVJVQCSLFEVIK-KXWHGCDGSA-N 1 1 292.354 3.678 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000615837592 1128764574 /nfs/dbraw/zinc/76/45/74/1128764574.db2.gz IDVJVQCSLFEVIK-ARRLWOLASA-N 1 1 292.354 3.678 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000615837592 1128764577 /nfs/dbraw/zinc/76/45/77/1128764577.db2.gz IDVJVQCSLFEVIK-ARRLWOLASA-N 1 1 292.354 3.678 20 5 CHBDMO CC[N@@H+](Cc1cccs1)Cc1cccc([N+](=O)[O-])c1 ZINC000061785446 1118308326 /nfs/dbraw/zinc/30/83/26/1118308326.db2.gz FVNIQEBFGCATBK-UHFFFAOYSA-N 1 1 276.361 3.678 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000129725190 1118888952 /nfs/dbraw/zinc/88/89/52/1118888952.db2.gz DPQGGDZLHAZHML-MNOVXSKESA-N 1 1 282.771 3.726 20 5 CHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000479579257 1119125591 /nfs/dbraw/zinc/12/55/91/1119125591.db2.gz NTWFDMBBDZSRHX-SWLSCSKDSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000219701720 1119511309 /nfs/dbraw/zinc/51/13/09/1119511309.db2.gz GCPYBZDXSAHDSB-GXTWGEPZSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1cnc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000122938537 1120056592 /nfs/dbraw/zinc/05/65/92/1120056592.db2.gz ROAIENWFPKNABA-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO CC[C@H]([NH2+]Cc1ncc(C)s1)c1cccc([N+](=O)[O-])c1 ZINC000122981675 1120062829 /nfs/dbraw/zinc/06/28/29/1120062829.db2.gz XSUJCUUEYDUTLB-ZDUSSCGKSA-N 1 1 291.376 3.601 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000312122485 1120309185 /nfs/dbraw/zinc/30/91/85/1120309185.db2.gz WKNHKYVZEVXEKZ-LLVKDONJSA-N 1 1 268.332 3.744 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c(F)c1 ZINC000313853446 1120414032 /nfs/dbraw/zinc/41/40/32/1120414032.db2.gz SXSKYOGUPODDLC-WBMJQRKESA-N 1 1 292.354 3.889 20 5 CHBDMO C[C@@H](c1cccs1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000053428420 1120497018 /nfs/dbraw/zinc/49/70/18/1120497018.db2.gz BXKDSEYTSCZPHS-NSHDSACASA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000053428420 1120497020 /nfs/dbraw/zinc/49/70/20/1120497020.db2.gz BXKDSEYTSCZPHS-NSHDSACASA-N 1 1 276.361 3.849 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000182024674 1128922179 /nfs/dbraw/zinc/92/21/79/1128922179.db2.gz SAPDQHNLEJBWSU-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1ncc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000047258862 1120644751 /nfs/dbraw/zinc/64/47/51/1120644751.db2.gz WZZKSEQYKSVGOQ-JTQLQIEISA-N 1 1 291.376 3.553 20 5 CHBDMO Cc1ncc(C[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000047258862 1120644754 /nfs/dbraw/zinc/64/47/54/1120644754.db2.gz WZZKSEQYKSVGOQ-JTQLQIEISA-N 1 1 291.376 3.553 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000303016971 1120663196 /nfs/dbraw/zinc/66/31/96/1120663196.db2.gz SLJTUDAGUQMWTR-QGZVFWFLSA-N 1 1 296.370 3.627 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2c2ccccc2)cs1 ZINC000048609556 1120835621 /nfs/dbraw/zinc/83/56/21/1120835621.db2.gz ABQXHZOESHOWQT-AWEZNQCLSA-N 1 1 288.372 3.993 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2c2ccccc2)cs1 ZINC000048609556 1120835624 /nfs/dbraw/zinc/83/56/24/1120835624.db2.gz ABQXHZOESHOWQT-AWEZNQCLSA-N 1 1 288.372 3.993 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000511970115 1120946583 /nfs/dbraw/zinc/94/65/83/1120946583.db2.gz DYRDWXKGTJYSPO-LBPRGKRZSA-N 1 1 286.331 3.697 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)CC(C)(C)C ZINC000389108016 1120976625 /nfs/dbraw/zinc/97/66/25/1120976625.db2.gz KKCYIGGHWDTOSZ-UHFFFAOYSA-N 1 1 268.332 3.602 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@H]1CC1(C)C ZINC001174908298 1121087035 /nfs/dbraw/zinc/08/70/35/1121087035.db2.gz ZAACLRWAYGBKJU-CHWSQXEVSA-N 1 1 276.380 3.942 20 5 CHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3ccoc3)o2)c1 ZINC000171050654 1121088437 /nfs/dbraw/zinc/08/84/37/1121088437.db2.gz DLZMUNGNSWFVSN-UHFFFAOYSA-N 1 1 298.298 3.738 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC23CCCC3)c1 ZINC000707131382 1121450146 /nfs/dbraw/zinc/45/01/46/1121450146.db2.gz UHFNBCSUBYSABZ-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC23CCCC3)c1 ZINC000707131382 1121450149 /nfs/dbraw/zinc/45/01/49/1121450149.db2.gz UHFNBCSUBYSABZ-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO Cn1c2ccccc2[nH+]c1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175900092 1121493676 /nfs/dbraw/zinc/49/36/76/1121493676.db2.gz IGBWYAPUTUMDAX-ZHACJKMWSA-N 1 1 294.314 3.564 20 5 CHBDMO CC(C)C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)C ZINC000509292671 1121516634 /nfs/dbraw/zinc/51/66/34/1121516634.db2.gz AVDUADFZJQHEEK-UHFFFAOYSA-N 1 1 286.322 3.739 20 5 CHBDMO Cc1ccoc1C[N@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000429409173 1121567915 /nfs/dbraw/zinc/56/79/15/1121567915.db2.gz QYRZACOKYKCVKW-CYBMUJFWSA-N 1 1 288.347 3.998 20 5 CHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000466743438 1121595671 /nfs/dbraw/zinc/59/56/71/1121595671.db2.gz LPIPNJFNRIDCFM-LBPRGKRZSA-N 1 1 280.343 3.602 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC2(CC2)CC1 ZINC000611177443 1121629704 /nfs/dbraw/zinc/62/97/04/1121629704.db2.gz LBFLKKHVAFWLSO-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1C=CCCC1 ZINC000731210545 1121855360 /nfs/dbraw/zinc/85/53/60/1121855360.db2.gz QPBFGBOHDNMADI-GFCCVEGCSA-N 1 1 280.755 3.789 20 5 CHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1C=CCCC1 ZINC000731210545 1121855371 /nfs/dbraw/zinc/85/53/71/1121855371.db2.gz QPBFGBOHDNMADI-GFCCVEGCSA-N 1 1 280.755 3.789 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@H](C)[C@@H](C)C1 ZINC001180199380 1121965740 /nfs/dbraw/zinc/96/57/40/1121965740.db2.gz RNGSGNNNEAYHLT-AAEUAGOBSA-N 1 1 276.380 3.690 20 5 CHBDMO CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)CC1CC1 ZINC000435239420 1122447039 /nfs/dbraw/zinc/44/70/39/1122447039.db2.gz WEEMBQYLNHJFCS-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO Cc1ccc(Cn2c[nH+]c3c2C[C@@H](C)[C@H](C)C3)cc1[N+](=O)[O-] ZINC001189416761 1122501085 /nfs/dbraw/zinc/50/10/85/1122501085.db2.gz ZWKVKVLFIJMEBF-CHWSQXEVSA-N 1 1 299.374 3.519 20 5 CHBDMO Cc1ccc(C[N@H+](CCC(C)C)C2CC2)cc1[N+](=O)[O-] ZINC001190323924 1122533818 /nfs/dbraw/zinc/53/38/18/1122533818.db2.gz AZYWUMFSIUOMIL-UHFFFAOYSA-N 1 1 276.380 3.914 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)CCC[C@H]1C ZINC001191070295 1122568530 /nfs/dbraw/zinc/56/85/30/1122568530.db2.gz KCQGVHJGDCZCOV-CHWSQXEVSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000516558728 1122611486 /nfs/dbraw/zinc/61/14/86/1122611486.db2.gz DGGZWXNVNYJHMI-RYUDHWBXSA-N 1 1 298.333 3.941 20 5 CHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000506220218 1122698034 /nfs/dbraw/zinc/69/80/34/1122698034.db2.gz VAEDHLRDBZZDCI-OCCSQVGLSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000437820731 1122706159 /nfs/dbraw/zinc/70/61/59/1122706159.db2.gz HRNAVBZAWFDAPI-GDBMZVCRSA-N 1 1 296.370 3.973 20 5 CHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC[C@@H]1C[C@H]1C1CC1 ZINC001193743926 1122711873 /nfs/dbraw/zinc/71/18/73/1122711873.db2.gz WTEOMKXUTWGTTC-WBVHZDCISA-N 1 1 288.391 3.505 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H]1CC1(C)C ZINC000426569508 1122822850 /nfs/dbraw/zinc/82/28/50/1122822850.db2.gz AVTREXFKFFIJSA-PINLSGDHSA-N 1 1 274.364 3.728 20 5 CHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000543556613 1122885457 /nfs/dbraw/zinc/88/54/57/1122885457.db2.gz GKJRGRMBXOIPOK-GFCCVEGCSA-N 1 1 268.382 3.811 20 5 CHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000507184392 1122935613 /nfs/dbraw/zinc/93/56/13/1122935613.db2.gz UYRTWTJYGVKNKJ-OAHLLOKOSA-N 1 1 296.370 3.893 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000441432667 1123116683 /nfs/dbraw/zinc/11/66/83/1123116683.db2.gz FBGVBRHDFBIHML-BBRMVZONSA-N 1 1 274.364 3.668 20 5 CHBDMO CC(C)C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000507999218 1123253891 /nfs/dbraw/zinc/25/38/91/1123253891.db2.gz NLAFSGBSZYOYPB-ALCCZGGFSA-N 1 1 274.364 3.728 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccns1 ZINC000862539922 1123817831 /nfs/dbraw/zinc/81/78/31/1123817831.db2.gz UPYGQWOTNMZOQH-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000444665978 1124050757 /nfs/dbraw/zinc/05/07/57/1124050757.db2.gz QJQVGBUHZXBIHD-GXTWGEPZSA-N 1 1 292.379 3.614 20 5 CHBDMO CCc1ccccc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000445797457 1124103170 /nfs/dbraw/zinc/10/31/70/1124103170.db2.gz AHSJQAYGRJHREK-UHFFFAOYSA-N 1 1 284.359 3.789 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000525273842 1124119877 /nfs/dbraw/zinc/11/98/77/1124119877.db2.gz ZKALKBJZKFXEEQ-XPKDYRNWSA-N 1 1 274.364 3.748 20 5 CHBDMO C[C@H](CC(F)(F)F)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872064012 1124671162 /nfs/dbraw/zinc/67/11/62/1124671162.db2.gz VIJBJFUMGWVRLA-HTQZYQBOSA-N 1 1 294.248 3.725 20 5 CHBDMO Cc1cscc1C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872066134 1124672275 /nfs/dbraw/zinc/67/22/75/1124672275.db2.gz FJMXPJLWJMXHCS-SNVBAGLBSA-N 1 1 294.351 3.955 20 5 CHBDMO C[C@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000530902746 1125185582 /nfs/dbraw/zinc/18/55/82/1125185582.db2.gz ZYRZRRBTLHDHLS-GUYCJALGSA-N 1 1 282.343 3.788 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000530902746 1125185585 /nfs/dbraw/zinc/18/55/85/1125185585.db2.gz ZYRZRRBTLHDHLS-GUYCJALGSA-N 1 1 282.343 3.788 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC(F)(F)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000879053808 1125193898 /nfs/dbraw/zinc/19/38/98/1125193898.db2.gz YHWBQEXRLXGEAL-NSHDSACASA-N 1 1 284.306 3.523 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC(F)(F)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000879053808 1125193901 /nfs/dbraw/zinc/19/39/01/1125193901.db2.gz YHWBQEXRLXGEAL-NSHDSACASA-N 1 1 284.306 3.523 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C2CC2)C2CCCC2)c(F)c1 ZINC000531348104 1125212080 /nfs/dbraw/zinc/21/20/80/1125212080.db2.gz REGFEARTWOQVRX-UHFFFAOYSA-N 1 1 278.327 3.641 20 5 CHBDMO CC(C)[N@@H+]1CC=C(c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000138943298 1125244011 /nfs/dbraw/zinc/24/40/11/1125244011.db2.gz ULCXWNOYBKALNO-UHFFFAOYSA-N 1 1 285.347 3.574 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532292737 1125246598 /nfs/dbraw/zinc/24/65/98/1125246598.db2.gz AFQXCCCFUSWZIA-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532326595 1125249153 /nfs/dbraw/zinc/24/91/53/1125249153.db2.gz LDHFUSZSSGRDEK-CYBMUJFWSA-N 1 1 262.353 3.607 20 5 CHBDMO CC[N@H+](Cc1ccoc1)Cc1cccc([N+](=O)[O-])c1C ZINC000102407710 1125277538 /nfs/dbraw/zinc/27/75/38/1125277538.db2.gz RUTKPWOQUYGLAV-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO CC[N@@H+](Cc1ccoc1)Cc1cccc([N+](=O)[O-])c1C ZINC000102407710 1125277545 /nfs/dbraw/zinc/27/75/45/1125277545.db2.gz RUTKPWOQUYGLAV-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO CC(C)(C)[N@@H+](Cc1ccccc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169005754 1129689306 /nfs/dbraw/zinc/68/93/06/1129689306.db2.gz CSMCRMXTEJMECB-HZPDHXFCSA-N 1 1 290.407 3.733 20 5 CHBDMO CCCC[N@@H+](Cc1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169030253 1129690850 /nfs/dbraw/zinc/69/08/50/1129690850.db2.gz XJUBTDQGFYXXBO-IRXDYDNUSA-N 1 1 290.407 3.734 20 5 CHBDMO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC001169242950 1129712336 /nfs/dbraw/zinc/71/23/36/1129712336.db2.gz DZURMRYUJCDVAW-SDNWHVSQSA-N 1 1 297.358 3.525 20 5 CHBDMO C/C(=C\c1ccccc1)C[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC001169242950 1129712339 /nfs/dbraw/zinc/71/23/39/1129712339.db2.gz DZURMRYUJCDVAW-SDNWHVSQSA-N 1 1 297.358 3.525 20 5 CHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CC1CC1)CC1CCC1 ZINC000796579166 1129785913 /nfs/dbraw/zinc/78/59/13/1129785913.db2.gz DDPQEZBIIYCTQC-UHFFFAOYSA-N 1 1 292.354 3.746 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCC(C)(C)C1 ZINC000801554990 1129926612 /nfs/dbraw/zinc/92/66/12/1129926612.db2.gz CDCZWNROPQBTNA-GFCCVEGCSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746671306 1129978535 /nfs/dbraw/zinc/97/85/35/1129978535.db2.gz HVDUWEYMNOHRBV-JTQLQIEISA-N 1 1 270.760 3.726 20 5 CHBDMO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@@H]1C1CC1 ZINC000811513701 1130619856 /nfs/dbraw/zinc/61/98/56/1130619856.db2.gz MOHHJQQXQNRCLY-CQSZACIVSA-N 1 1 294.782 3.869 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@@H]1C1CC1 ZINC000811513701 1130619860 /nfs/dbraw/zinc/61/98/60/1130619860.db2.gz MOHHJQQXQNRCLY-CQSZACIVSA-N 1 1 294.782 3.869 20 5 CHBDMO CC1(C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1C1CC1 ZINC000811513765 1130620582 /nfs/dbraw/zinc/62/05/82/1130620582.db2.gz PLCUPYINFZXQRG-AWEZNQCLSA-N 1 1 294.782 3.869 20 5 CHBDMO CC1(C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1C1CC1 ZINC000811513765 1130620584 /nfs/dbraw/zinc/62/05/84/1130620584.db2.gz PLCUPYINFZXQRG-AWEZNQCLSA-N 1 1 294.782 3.869 20 5 CHBDMO CC[N@@H+](CCN)Cc1c2ccccc2cc2ccccc21 ZINC001236145333 1130875907 /nfs/dbraw/zinc/87/59/07/1130875907.db2.gz ZBEMLYVBGTZFTO-UHFFFAOYSA-N 1 1 278.399 3.774 20 5 CHBDMO CCN(CC[NH3+])Cc1c2ccccc2cc2ccccc21 ZINC001236145333 1130875927 /nfs/dbraw/zinc/87/59/27/1130875927.db2.gz ZBEMLYVBGTZFTO-UHFFFAOYSA-N 1 1 278.399 3.774 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000797525693 1130990745 /nfs/dbraw/zinc/99/07/45/1130990745.db2.gz COFSAYBBHNRYRQ-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@@H](C)C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000797525693 1130990750 /nfs/dbraw/zinc/99/07/50/1130990750.db2.gz COFSAYBBHNRYRQ-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO CC1(C)CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172915911 1132360764 /nfs/dbraw/zinc/36/07/64/1132360764.db2.gz PNQCJTPNDNRQMD-OAHLLOKOSA-N 1 1 288.391 3.574 20 5 CHBDMO C[C@H]1CCCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909941 1132371437 /nfs/dbraw/zinc/37/14/37/1132371437.db2.gz VWLBNXCXZGKCPF-XJKSGUPXSA-N 1 1 288.391 3.717 20 5 CHBDMO Cc1ccccc1C[N@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225518 1132412614 /nfs/dbraw/zinc/41/26/14/1132412614.db2.gz CYOMSKJWNZWAHK-HNNXBMFYSA-N 1 1 298.386 3.966 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)[C@H]1C ZINC001173227900 1132412856 /nfs/dbraw/zinc/41/28/56/1132412856.db2.gz SHVXPKZHKMITSG-MGPQQGTHSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001173233717 1132413779 /nfs/dbraw/zinc/41/37/79/1132413779.db2.gz MLBDIBLCQIOCAQ-UKPHBRMFSA-N 1 1 288.391 3.790 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1CC(F)(F)C1 ZINC001173235019 1132414365 /nfs/dbraw/zinc/41/43/65/1132414365.db2.gz VSUYXOSJUUQLQQ-LLVKDONJSA-N 1 1 298.333 3.503 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]1c1ccccc1 ZINC001173233758 1132414412 /nfs/dbraw/zinc/41/44/12/1132414412.db2.gz NETIMAOYHQFIIN-KDOFPFPSSA-N 1 1 296.370 3.973 20 5 CHBDMO F[C@H]1CCC[N@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232221570 1132439454 /nfs/dbraw/zinc/43/94/54/1132439454.db2.gz IUDCQMPESBMDJS-HNNXBMFYSA-N 1 1 295.361 3.717 20 5 CHBDMO F[C@H]1CCC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232221570 1132439457 /nfs/dbraw/zinc/43/94/57/1132439457.db2.gz IUDCQMPESBMDJS-HNNXBMFYSA-N 1 1 295.361 3.717 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1 ZINC001162152895 1133054917 /nfs/dbraw/zinc/05/49/17/1133054917.db2.gz JKJVHHQQVCEHAL-UONOGXRCSA-N 1 1 291.395 3.578 20 5 CHBDMO O=[N+]([O-])c1ccc(CCNc2ccc(C3CCC3)c[nH+]2)cc1 ZINC001206056554 1133650586 /nfs/dbraw/zinc/65/05/86/1133650586.db2.gz TXKMRSOQGLWARR-UHFFFAOYSA-N 1 1 297.358 3.912 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](C3CCC3)C2)cc1Cl ZINC001206288965 1133683653 /nfs/dbraw/zinc/68/36/53/1133683653.db2.gz YIFDPLKSFIWYQO-ZDUSSCGKSA-N 1 1 294.782 3.870 20 5 CHBDMO Cc1ccc(Nc2cccc3[nH+]cn(C)c32)c([N+](=O)[O-])c1 ZINC001214173636 1134516186 /nfs/dbraw/zinc/51/61/86/1134516186.db2.gz AOJAPKLLKKZEBG-UHFFFAOYSA-N 1 1 282.303 3.534 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000035738496 172391398 /nfs/dbraw/zinc/39/13/98/172391398.db2.gz ZOBZJSRJXXTNPU-WDEREUQCSA-N 1 1 260.293 3.600 20 5 CHBDMO Cc1sccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000353452590 228105176 /nfs/dbraw/zinc/10/51/76/228105176.db2.gz CMXNUBLPQSVLEU-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000080274738 260179490 /nfs/dbraw/zinc/17/94/90/260179490.db2.gz GLYCHHWZHSBVKF-QWRGUYRKSA-N 1 1 291.376 3.772 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525786410 262236349 /nfs/dbraw/zinc/23/63/49/262236349.db2.gz FTWMCLALEGCUAT-IPYPFGDCSA-N 1 1 274.364 3.748 20 5 CHBDMO Cc1ccnc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000285496540 263093475 /nfs/dbraw/zinc/09/34/75/263093475.db2.gz APIMMMTZXDQPJQ-OLZOCXBDSA-N 1 1 285.347 3.710 20 5 CHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000359541041 266599149 /nfs/dbraw/zinc/59/91/49/266599149.db2.gz CYVQNYJDXHYYAS-WBMJQRKESA-N 1 1 292.354 3.746 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000172018690 335088807 /nfs/dbraw/zinc/08/88/07/335088807.db2.gz XKQSEVJLPGBMTG-UHFFFAOYSA-N 1 1 268.744 3.621 20 5 CHBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000571398740 328118916 /nfs/dbraw/zinc/11/89/16/328118916.db2.gz UVGVHONTXVWGKN-LBPRGKRZSA-N 1 1 294.395 3.860 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303681235 328357607 /nfs/dbraw/zinc/35/76/07/328357607.db2.gz JCMLRCIOENVNIA-FRFSOERESA-N 1 1 288.391 3.790 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC2(C1)CCCCC2 ZINC000303861670 328361910 /nfs/dbraw/zinc/36/19/10/328361910.db2.gz GPMRYYNOCZTCJC-UHFFFAOYSA-N 1 1 274.364 3.751 20 5 CHBDMO CC[C@@H]1C[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])C[C@@H](CC)O1 ZINC000420955970 329791264 /nfs/dbraw/zinc/79/12/64/329791264.db2.gz MKOHIPMKTKSGPT-BFHYXJOUSA-N 1 1 292.379 3.545 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C2CC2)C2CCCC2)cc1 ZINC000057619649 330377040 /nfs/dbraw/zinc/37/70/40/330377040.db2.gz BQBIEXTYRABUPS-UHFFFAOYSA-N 1 1 260.337 3.502 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000442888903 330790659 /nfs/dbraw/zinc/79/06/59/330790659.db2.gz CFLYBXBJXFRKIG-GFCCVEGCSA-N 1 1 292.379 3.545 20 5 CHBDMO CC[C@@H](F)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543736 331033411 /nfs/dbraw/zinc/03/34/11/331033411.db2.gz CJRZNEFMMCGMPM-UONOGXRCSA-N 1 1 280.343 3.522 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H]1C(C)C ZINC000470175502 331044198 /nfs/dbraw/zinc/04/41/98/331044198.db2.gz ZBZHAUSLVKYSCM-OVHOFWQVSA-N 1 1 274.364 3.728 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC000463363031 331346712 /nfs/dbraw/zinc/34/67/12/331346712.db2.gz YGFDSMLRZCWGGD-UHFFFAOYSA-N 1 1 264.369 3.505 20 5 CHBDMO C[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000464822212 331369843 /nfs/dbraw/zinc/36/98/43/331369843.db2.gz KXGIUFYLDKHJPN-GHMZBOCLSA-N 1 1 282.771 3.869 20 5 CHBDMO CCc1cccc(F)c1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000474473143 331588595 /nfs/dbraw/zinc/58/85/95/331588595.db2.gz PTDQPMXZAOVGII-UHFFFAOYSA-N 1 1 288.322 3.586 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489228743 332043758 /nfs/dbraw/zinc/04/37/58/332043758.db2.gz XAWCAEGLPCFWAU-AAEUAGOBSA-N 1 1 264.369 3.942 20 5 CHBDMO Cc1ccoc1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000491482977 332219281 /nfs/dbraw/zinc/21/92/81/332219281.db2.gz DQYZSSOUEOOFGK-UHFFFAOYSA-N 1 1 288.347 3.909 20 5 CHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000513753312 333037565 /nfs/dbraw/zinc/03/75/65/333037565.db2.gz BYDVEHBZTXCMTC-OAHLLOKOSA-N 1 1 292.379 3.614 20 5 CHBDMO C[N@@H+](Cc1cc2ccccc2o1)Cc1cccc([N+](=O)[O-])c1 ZINC000195676030 333260428 /nfs/dbraw/zinc/26/04/28/333260428.db2.gz LGRPERCSJLELFY-UHFFFAOYSA-N 1 1 296.326 3.973 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1C(C)C ZINC000303695039 333345465 /nfs/dbraw/zinc/34/54/65/333345465.db2.gz QMRDZEVTDXWACF-OAHLLOKOSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000524811128 333389028 /nfs/dbraw/zinc/38/90/28/333389028.db2.gz AHTCGYFVQFODLB-BBRMVZONSA-N 1 1 276.380 3.995 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000077211393 334098956 /nfs/dbraw/zinc/09/89/56/334098956.db2.gz PESNSMXRMDOPGJ-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO C[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000081574988 334197623 /nfs/dbraw/zinc/19/76/23/334197623.db2.gz IXUVUQQYJLEODE-DYVFJYSZSA-N 1 1 282.343 3.788 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000081574988 334197624 /nfs/dbraw/zinc/19/76/24/334197624.db2.gz IXUVUQQYJLEODE-DYVFJYSZSA-N 1 1 282.343 3.788 20 5 CHBDMO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCC[C@@H]21 ZINC000550444432 334222593 /nfs/dbraw/zinc/22/25/93/334222593.db2.gz VKFSCVIINCJXFI-LSDHHAIUSA-N 1 1 274.364 3.605 20 5 CHBDMO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCC[C@@H]21 ZINC000550444430 334222795 /nfs/dbraw/zinc/22/27/95/334222795.db2.gz VKFSCVIINCJXFI-GJZGRUSLSA-N 1 1 274.364 3.605 20 5 CHBDMO C[N@H+]1CCCC[C@@H]1CCSCc1ccc([N+](=O)[O-])cc1 ZINC000551460864 334250984 /nfs/dbraw/zinc/25/09/84/334250984.db2.gz ALMCSGRFTNWNQF-CQSZACIVSA-N 1 1 294.420 3.702 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CCCCCC1 ZINC000248022578 334293413 /nfs/dbraw/zinc/29/34/13/334293413.db2.gz FSVPXXDEMZELCU-UHFFFAOYSA-N 1 1 262.353 3.749 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000576392588 335197781 /nfs/dbraw/zinc/19/77/81/335197781.db2.gz SCUTUDVEYGPBDG-GPCFVJJQSA-N 1 1 298.386 3.873 20 5 CHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cccc(F)c1F ZINC000181989886 518183288 /nfs/dbraw/zinc/18/32/88/518183288.db2.gz OXNFZKFCZIUYFJ-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000037668275 525341517 /nfs/dbraw/zinc/34/15/17/525341517.db2.gz KBACBOLSOSDTFR-ABAIWWIYSA-N 1 1 286.331 3.601 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000036960137 525746485 /nfs/dbraw/zinc/74/64/85/525746485.db2.gz GEBKUPPVOLANAG-VXGBXAGGSA-N 1 1 274.320 3.908 20 5 CHBDMO Cc1sccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000339354117 526916024 /nfs/dbraw/zinc/91/60/24/526916024.db2.gz CNPPMYHBBHRYDA-UHFFFAOYSA-N 1 1 296.779 3.908 20 5 CHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000353584529 529206657 /nfs/dbraw/zinc/20/66/57/529206657.db2.gz HTZWLYKVTRUXNW-CQSZACIVSA-N 1 1 294.420 3.702 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CC2CCCC2)cc1[N+](=O)[O-] ZINC000512679058 1121525401 /nfs/dbraw/zinc/52/54/01/1121525401.db2.gz UTLDDFGAXSMMIR-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037403697 1122959731 /nfs/dbraw/zinc/95/97/31/1122959731.db2.gz MDCNSXKNECJEFX-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037403697 1122959735 /nfs/dbraw/zinc/95/97/35/1122959735.db2.gz MDCNSXKNECJEFX-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cscc1Cl ZINC000776097344 1123056916 /nfs/dbraw/zinc/05/69/16/1123056916.db2.gz LNDQDWPQVWOYQE-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO Cc1ccc(C[N@@H+](C2CC2)C2CCCC2)cc1[N+](=O)[O-] ZINC000536632155 1125537480 /nfs/dbraw/zinc/53/74/80/1125537480.db2.gz SJCMBENSYQSVNN-UHFFFAOYSA-N 1 1 274.364 3.810 20 5 CHBDMO CC(C)CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CC1 ZINC000135333379 1125586750 /nfs/dbraw/zinc/58/67/50/1125586750.db2.gz WSRROYQRUQVDCO-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccncc1F)c1cccc([N+](=O)[O-])c1 ZINC000338020065 1126711632 /nfs/dbraw/zinc/71/16/32/1126711632.db2.gz PUBRDDPNKWNHHY-GHMZBOCLSA-N 1 1 289.310 3.541 20 5 CHBDMO Cc1ccc2c(c1)C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000482458166 1126757635 /nfs/dbraw/zinc/75/76/35/1126757635.db2.gz SDGLGJHTEBYTBA-XQRVVYSFSA-N 1 1 294.354 3.932 20 5 CHBDMO Cc1ccc2c(c1)C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000482458166 1126757641 /nfs/dbraw/zinc/75/76/41/1126757641.db2.gz SDGLGJHTEBYTBA-XQRVVYSFSA-N 1 1 294.354 3.932 20 5 CHBDMO Cc1c(C[N@@H+](CC2CC2)C2CCC2)cccc1[N+](=O)[O-] ZINC000483308704 1126780667 /nfs/dbraw/zinc/78/06/67/1126780667.db2.gz ZNVFQVBIGLFMMQ-UHFFFAOYSA-N 1 1 274.364 3.668 20 5 CHBDMO CC1=C(C)C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000483371978 1126783763 /nfs/dbraw/zinc/78/37/63/1126783763.db2.gz SPAZVFNCVZDPDH-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO CC1=C(C)C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000483371978 1126783764 /nfs/dbraw/zinc/78/37/64/1126783764.db2.gz SPAZVFNCVZDPDH-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000037173075 1126922558 /nfs/dbraw/zinc/92/25/58/1126922558.db2.gz AOPWGAMCQLBOTG-JTQLQIEISA-N 1 1 270.760 3.726 20 5 CHBDMO COc1cc(C[N@@H+](C)CC2CCCCC2)ccc1[N+](=O)[O-] ZINC000485746882 1126950255 /nfs/dbraw/zinc/95/02/55/1126950255.db2.gz TZHGHNMTOQPEQB-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1cccs1 ZINC000266460991 1126982445 /nfs/dbraw/zinc/98/24/45/1126982445.db2.gz MDKZOEXPBLFMGN-LLVKDONJSA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccs1 ZINC000266460991 1126982446 /nfs/dbraw/zinc/98/24/46/1126982446.db2.gz MDKZOEXPBLFMGN-LLVKDONJSA-N 1 1 276.361 3.849 20 5 CHBDMO Cc1occc1C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000266514578 1126983079 /nfs/dbraw/zinc/98/30/79/1126983079.db2.gz FTVFBAVNUIFXPT-NSHDSACASA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1occc1C[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000266514578 1126983081 /nfs/dbraw/zinc/98/30/81/1126983081.db2.gz FTVFBAVNUIFXPT-NSHDSACASA-N 1 1 274.320 3.689 20 5 CHBDMO CC1=C[C@H](C)C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000797526556 1130990525 /nfs/dbraw/zinc/99/05/25/1130990525.db2.gz UMYUHOHRSMNEPZ-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C2CC2)C1 ZINC000588977947 1127209091 /nfs/dbraw/zinc/20/90/91/1127209091.db2.gz DZMAALWBHWEIQM-OCCSQVGLSA-N 1 1 274.364 3.778 20 5 CHBDMO CC[C@@H](CSC)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589206623 1127216248 /nfs/dbraw/zinc/21/62/48/1127216248.db2.gz YBHGOOWJDCYQKO-LEJCZOIISA-N 1 1 294.420 3.681 20 5 CHBDMO CC1(C)C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCC[C@H]21 ZINC000590204418 1127251393 /nfs/dbraw/zinc/25/13/93/1127251393.db2.gz IEXOXACGTIRLIE-IUODEOHRSA-N 1 1 292.354 3.744 20 5 CHBDMO CCC(CC)C[N@@H+](CC)Cc1ccc([N+](=O)[O-])cc1 ZINC000058579947 1127362220 /nfs/dbraw/zinc/36/22/20/1127362220.db2.gz JXCHYMVPYZKTTE-UHFFFAOYSA-N 1 1 264.369 3.853 20 5 CHBDMO CCCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000058933975 1127400070 /nfs/dbraw/zinc/40/00/70/1127400070.db2.gz ZRXVAWODLNIBDJ-UHFFFAOYSA-N 1 1 264.369 3.995 20 5 CHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359293515 1127456611 /nfs/dbraw/zinc/45/66/11/1127456611.db2.gz FPFTUFGXWWVTIJ-CZUORRHYSA-N 1 1 274.364 3.607 20 5 CHBDMO CCC1(CC)CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595455423 1127463441 /nfs/dbraw/zinc/46/34/41/1127463441.db2.gz NGKPXVASMUVXRZ-UHFFFAOYSA-N 1 1 295.383 3.684 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595858277 1127477975 /nfs/dbraw/zinc/47/79/75/1127477975.db2.gz VLHPEJIMYNFGPL-CPIKKWJDSA-N 1 1 274.364 3.919 20 5 CHBDMO COc1cc(C[N@H+]2[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000362325993 1127628180 /nfs/dbraw/zinc/62/81/80/1127628180.db2.gz UODABRWXYGUYBC-PHIMTYICSA-N 1 1 296.342 3.505 20 5 CHBDMO COc1cc(C[N@@H+]2[C@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000362325993 1127628182 /nfs/dbraw/zinc/62/81/82/1127628182.db2.gz UODABRWXYGUYBC-PHIMTYICSA-N 1 1 296.342 3.505 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000603843507 1127675417 /nfs/dbraw/zinc/67/54/17/1127675417.db2.gz GFRCSGVYCPTQHQ-CYBMUJFWSA-N 1 1 262.353 3.525 20 5 CHBDMO CCC(CC)C[N@@H+](CC)Cc1cc([N+](=O)[O-])ccc1OC ZINC000603849893 1127676812 /nfs/dbraw/zinc/67/68/12/1127676812.db2.gz ZNVOGNZGOQZRGU-UHFFFAOYSA-N 1 1 294.395 3.862 20 5 CHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccsc2[N+](=O)[O-])C1 ZINC000604433471 1127705495 /nfs/dbraw/zinc/70/54/95/1127705495.db2.gz JSAUWWVLFSUXJX-GFCCVEGCSA-N 1 1 297.424 3.580 20 5 CHBDMO C[N@H+](Cc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000061781400 1127716857 /nfs/dbraw/zinc/71/68/57/1127716857.db2.gz LHFQWTSXZKTPAH-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000298250254 1127716855 /nfs/dbraw/zinc/71/68/55/1127716855.db2.gz KLFYCNRCRXPKSR-HONMWMINSA-N 1 1 296.317 3.633 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000061781400 1127716860 /nfs/dbraw/zinc/71/68/60/1127716860.db2.gz LHFQWTSXZKTPAH-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO CC1CCC([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000061799066 1127718494 /nfs/dbraw/zinc/71/84/94/1127718494.db2.gz UQJKUQSJGIHUFM-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO CC[N@H+](Cc1occc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000412047044 1127891917 /nfs/dbraw/zinc/89/19/17/1127891917.db2.gz UGBGTHBBFUOPBF-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO CC[N@@H+](Cc1occc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC000412047044 1127891922 /nfs/dbraw/zinc/89/19/22/1127891922.db2.gz UGBGTHBBFUOPBF-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1occc1C ZINC000412029391 1127892104 /nfs/dbraw/zinc/89/21/04/1127892104.db2.gz UNQZKYWKDMHPOI-UHFFFAOYSA-N 1 1 288.347 3.561 20 5 CHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539827559 1127944012 /nfs/dbraw/zinc/94/40/12/1127944012.db2.gz IKYAZRWARYTEQS-SMDDNHRTSA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1cccc([C@H]2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000544187840 1127961973 /nfs/dbraw/zinc/96/19/73/1127961973.db2.gz XVQAICMHSHKMFL-INIZCTEOSA-N 1 1 296.370 3.893 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC(C)(C)C1 ZINC000467283491 1127963230 /nfs/dbraw/zinc/96/32/30/1127963230.db2.gz WALBVOBYRNBQLV-GFCCVEGCSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000471022907 1127982803 /nfs/dbraw/zinc/98/28/03/1127982803.db2.gz QRSIAWROHQMFIE-KBXCAEBGSA-N 1 1 296.370 3.830 20 5 CHBDMO CCC[C@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000541701396 1128034521 /nfs/dbraw/zinc/03/45/21/1128034521.db2.gz RCMAGTIBXMYOKE-AWEZNQCLSA-N 1 1 262.353 3.749 20 5 CHBDMO CC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C1CCC1 ZINC000470174893 1128064926 /nfs/dbraw/zinc/06/49/26/1128064926.db2.gz NPNJJMILDPMEMX-RAXLEYEMSA-N 1 1 274.364 3.873 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CC1CCC1 ZINC000470176958 1128065107 /nfs/dbraw/zinc/06/51/07/1128065107.db2.gz ZHGLYWOYPBQLDB-UKTHLTGXSA-N 1 1 274.364 3.730 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000470178432 1128065491 /nfs/dbraw/zinc/06/54/91/1128065491.db2.gz YKNZYUDJEYOEDW-UKUVYACNSA-N 1 1 286.375 3.730 20 5 CHBDMO CCOc1cc(C[N@H+]2CCCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000492633264 1128107411 /nfs/dbraw/zinc/10/74/11/1128107411.db2.gz UWXLCGLNNJIKJD-CYBMUJFWSA-N 1 1 292.379 3.758 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000492543309 1128102245 /nfs/dbraw/zinc/10/22/45/1128102245.db2.gz ZCCQPXOMLZKPCL-CQSZACIVSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H](c1cccs1)[N@H+](CC[N+](=O)[O-])Cc1ccccc1 ZINC000929401929 1128273025 /nfs/dbraw/zinc/27/30/25/1128273025.db2.gz LKBIIXGKQUHPSA-ZDUSSCGKSA-N 1 1 290.388 3.588 20 5 CHBDMO C[C@@H](c1cccs1)[N@@H+](CC[N+](=O)[O-])Cc1ccccc1 ZINC000929401929 1128273028 /nfs/dbraw/zinc/27/30/28/1128273028.db2.gz LKBIIXGKQUHPSA-ZDUSSCGKSA-N 1 1 290.388 3.588 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])cc1 ZINC000301090966 1128332989 /nfs/dbraw/zinc/33/29/89/1128332989.db2.gz KPZCUVJPVRVVRZ-CQSZACIVSA-N 1 1 291.395 3.661 20 5 CHBDMO C[N@H+]1CCCC[C@@H]1CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000915666824 1128333052 /nfs/dbraw/zinc/33/30/52/1128333052.db2.gz IZDSWOITWDYXGE-GFCCVEGCSA-N 1 1 298.770 3.501 20 5 CHBDMO CCCCC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000153734600 1128338838 /nfs/dbraw/zinc/33/88/38/1128338838.db2.gz CANMCKGFEJAUKW-MRXNPFEDSA-N 1 1 294.395 3.529 20 5 CHBDMO CC(C)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccccn1 ZINC000932444088 1128410180 /nfs/dbraw/zinc/41/01/80/1128410180.db2.gz ZSVGYQNFIJVWCM-UHFFFAOYSA-N 1 1 299.374 3.648 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)O[NH+]=C(N)C1CCCC1 ZINC000778592283 1128565726 /nfs/dbraw/zinc/56/57/26/1128565726.db2.gz YKSXJVIMVZUGOB-NSHDSACASA-N 1 1 291.351 3.653 20 5 CHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000556901448 1128636823 /nfs/dbraw/zinc/63/68/23/1128636823.db2.gz NMNOLZNUDUCBLB-ZDUSSCGKSA-N 1 1 296.436 3.867 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2ccsc2)cc1 ZINC000046089182 1128658376 /nfs/dbraw/zinc/65/83/76/1128658376.db2.gz BTURIXHEKRAKOW-OAHLLOKOSA-N 1 1 288.372 3.993 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000609766746 1128725709 /nfs/dbraw/zinc/72/57/09/1128725709.db2.gz MSMSSJXQGAEQKW-CYBMUJFWSA-N 1 1 262.353 3.607 20 5 CHBDMO CC[C@H]1CC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000430203220 1117859979 /nfs/dbraw/zinc/85/99/79/1117859979.db2.gz IVZPDLMUOLOYIN-ZDUSSCGKSA-N 1 1 286.331 3.839 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC2(C1)CCCCC2 ZINC000610216199 1117880775 /nfs/dbraw/zinc/88/07/75/1117880775.db2.gz YYHCGEBRZARDTE-UHFFFAOYSA-N 1 1 292.354 3.890 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000430265391 1117956810 /nfs/dbraw/zinc/95/68/10/1117956810.db2.gz DSFAAZINVCMNGW-RISCZKNCSA-N 1 1 274.364 3.862 20 5 CHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705296 1118000813 /nfs/dbraw/zinc/00/08/13/1118000813.db2.gz RUCVNQXHBJLFSO-ZDUSSCGKSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000253060988 1118287361 /nfs/dbraw/zinc/28/73/61/1118287361.db2.gz DPQGGDZLHAZHML-GHMZBOCLSA-N 1 1 282.771 3.726 20 5 CHBDMO CC[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000341204778 1118620547 /nfs/dbraw/zinc/62/05/47/1118620547.db2.gz FTOQKFUHSBIPJH-OAHLLOKOSA-N 1 1 288.322 3.975 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580679 1118778369 /nfs/dbraw/zinc/77/83/69/1118778369.db2.gz BTRKVVWQOQEGHJ-LLVKDONJSA-N 1 1 289.335 3.501 20 5 CHBDMO C[C@H]1C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[C@@H]1C ZINC000129724107 1118888806 /nfs/dbraw/zinc/88/88/06/1118888806.db2.gz NHHIOFMDTWPWQK-QWRGUYRKSA-N 1 1 282.771 3.726 20 5 CHBDMO C[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1cncs1 ZINC000934197164 1118963045 /nfs/dbraw/zinc/96/30/45/1118963045.db2.gz BADUZQZJHGBUMP-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO Cc1c(C[N@@H+]2C[C@@H](C)CC2(C)C)cccc1[N+](=O)[O-] ZINC000472276874 1119280356 /nfs/dbraw/zinc/28/03/56/1119280356.db2.gz LOLLRCXQBLCTRK-NSHDSACASA-N 1 1 262.353 3.524 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCCCCC1 ZINC000248018166 1119302339 /nfs/dbraw/zinc/30/23/39/1119302339.db2.gz DSGYXICUKWBAHY-UHFFFAOYSA-N 1 1 262.353 3.749 20 5 CHBDMO C[N@@H+](Cc1cccc2[nH]ccc21)Cc1ccccc1[N+](=O)[O-] ZINC000179316724 1119710296 /nfs/dbraw/zinc/71/02/96/1119710296.db2.gz NKSPBBGMHSAWMQ-UHFFFAOYSA-N 1 1 295.342 3.708 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)cc1 ZINC000065967585 1119797054 /nfs/dbraw/zinc/79/70/54/1119797054.db2.gz UJWHOHROVPHOMF-KWOWKCNFSA-N 1 1 286.375 3.605 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1cccc([N+](=O)[O-])c1 ZINC000580856025 1119890071 /nfs/dbraw/zinc/89/00/71/1119890071.db2.gz BISMHVQKMQMFBM-UHFFFAOYSA-N 1 1 250.342 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCCc1ccccc1)CC2 ZINC000472592287 1119992000 /nfs/dbraw/zinc/99/20/00/1119992000.db2.gz YUMHHZISXKDTOD-UHFFFAOYSA-N 1 1 296.370 3.586 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@@H]21 ZINC000541111790 1120148577 /nfs/dbraw/zinc/14/85/77/1120148577.db2.gz SLLAIUKFRXSVJR-DAXOMENPSA-N 1 1 274.364 3.605 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@@H]2CCCC[C@H]21 ZINC000541108996 1120149147 /nfs/dbraw/zinc/14/91/47/1120149147.db2.gz FUAOUBMWBDYHRF-DIOULYMOSA-N 1 1 292.354 3.744 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000584543427 1120233033 /nfs/dbraw/zinc/23/30/33/1120233033.db2.gz JYUWKJMSSVPAGX-LBPRGKRZSA-N 1 1 294.782 3.870 20 5 CHBDMO COc1ccc(C[N@@H+](C2CC2)C2CCCC2)cc1[N+](=O)[O-] ZINC000103466177 1120252470 /nfs/dbraw/zinc/25/24/70/1120252470.db2.gz DDWIFOUVUOWGPB-UHFFFAOYSA-N 1 1 290.363 3.510 20 5 CHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522714116 1120310593 /nfs/dbraw/zinc/31/05/93/1120310593.db2.gz CEPVBELLHXDZJX-HNNXBMFYSA-N 1 1 262.353 3.605 20 5 CHBDMO CCc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000922537235 1120547878 /nfs/dbraw/zinc/54/78/78/1120547878.db2.gz CHBDQODUYDMEAT-LLVKDONJSA-N 1 1 274.320 3.601 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(Cl)ccc2F)cc1 ZINC000125224610 1120601853 /nfs/dbraw/zinc/60/18/53/1120601853.db2.gz YTUBHRDPZODZGZ-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO CC[C@H](C)[N@@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470179138 1120605937 /nfs/dbraw/zinc/60/59/37/1120605937.db2.gz SSXREKYQKCHKEE-SUIFULHWSA-N 1 1 262.353 3.728 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC3(CC3)C2)ccc1Cl ZINC000186618348 1120624475 /nfs/dbraw/zinc/62/44/75/1120624475.db2.gz XCQPCMALYDHBFH-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC3(CC3)C2)ccc1Cl ZINC000186618348 1120624476 /nfs/dbraw/zinc/62/44/76/1120624476.db2.gz XCQPCMALYDHBFH-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO CC[C@H](C)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000215664323 1120661022 /nfs/dbraw/zinc/66/10/22/1120661022.db2.gz LADPTGRPFOEBKT-LBPRGKRZSA-N 1 1 262.353 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000303016968 1120662970 /nfs/dbraw/zinc/66/29/70/1120662970.db2.gz SLJTUDAGUQMWTR-KRWDZBQOSA-N 1 1 296.370 3.627 20 5 CHBDMO CC[C@]1(C)CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001307582550 1120686129 /nfs/dbraw/zinc/68/61/29/1120686129.db2.gz HHIGDCLIZWUZAR-CQSZACIVSA-N 1 1 282.771 3.870 20 5 CHBDMO Cc1c(C[N@@H+](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000051377682 1120817892 /nfs/dbraw/zinc/81/78/92/1120817892.db2.gz YNMJBOGVIPMMDI-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000048609564 1120835478 /nfs/dbraw/zinc/83/54/78/1120835478.db2.gz QENCSOZKDOGELA-CQSZACIVSA-N 1 1 288.372 3.776 20 5 CHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000048609564 1120835480 /nfs/dbraw/zinc/83/54/80/1120835480.db2.gz QENCSOZKDOGELA-CQSZACIVSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000512178394 1121141846 /nfs/dbraw/zinc/14/18/46/1121141846.db2.gz ILQNTWSNVKUJGR-LHRNQBEKSA-N 1 1 274.364 3.730 20 5 CHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000512230855 1121212958 /nfs/dbraw/zinc/21/29/58/1121212958.db2.gz VJLNWKNJRNKMRF-PLWJUESGSA-N 1 1 276.380 3.974 20 5 CHBDMO CC1(C[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000432774475 1121336512 /nfs/dbraw/zinc/33/65/12/1121336512.db2.gz CHFWEPRAWRLZLA-UHFFFAOYSA-N 1 1 274.364 3.749 20 5 CHBDMO C[C@H]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000429583662 1121340647 /nfs/dbraw/zinc/34/06/47/1121340647.db2.gz KYVKCWABYDOPKX-GWCFXTLKSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]1CC[C@@H]([N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000433037401 1121532748 /nfs/dbraw/zinc/53/27/48/1121532748.db2.gz FACAXIAXFLZVDJ-RLWBPUTGSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000543631500 1121538739 /nfs/dbraw/zinc/53/87/39/1121538739.db2.gz NNLZYKUZOCVZCK-XJKSGUPXSA-N 1 1 274.364 3.668 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000509377977 1121559170 /nfs/dbraw/zinc/55/91/70/1121559170.db2.gz GZKWOTGRBCCWCN-BUUCAEBMSA-N 1 1 262.353 3.586 20 5 CHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccoc1 ZINC000611267949 1121633715 /nfs/dbraw/zinc/63/37/15/1121633715.db2.gz QTTNXHRXATXSAQ-ALCCZGGFSA-N 1 1 286.331 3.723 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000611516960 1121654210 /nfs/dbraw/zinc/65/42/10/1121654210.db2.gz ZQNJLFAZZUVHSP-NSHDSACASA-N 1 1 296.317 3.695 20 5 CHBDMO Cc1ccccc1C[N@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000054152750 1121724065 /nfs/dbraw/zinc/72/40/65/1121724065.db2.gz PHRFBPQSBNJXJP-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000054152750 1121724071 /nfs/dbraw/zinc/72/40/71/1121724071.db2.gz PHRFBPQSBNJXJP-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccsc2)c(Cl)c1 ZINC000063152684 1121921025 /nfs/dbraw/zinc/92/10/25/1121921025.db2.gz XNMMYPSBDIPEOI-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO CC(C)[C@H]1[N@H+](Cc2csc([N+](=O)[O-])c2)CC12CCC2 ZINC000430100334 1122404129 /nfs/dbraw/zinc/40/41/29/1122404129.db2.gz AWQANZUUCBJCDB-CYBMUJFWSA-N 1 1 280.393 3.667 20 5 CHBDMO CC(C)[C@H]1[N@@H+](Cc2csc([N+](=O)[O-])c2)CC12CCC2 ZINC000430100334 1122404131 /nfs/dbraw/zinc/40/41/31/1122404131.db2.gz AWQANZUUCBJCDB-CYBMUJFWSA-N 1 1 280.393 3.667 20 5 CHBDMO CC(C)[C@@H]1[N@@H+](Cc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000430100953 1122404365 /nfs/dbraw/zinc/40/43/65/1122404365.db2.gz BPUWXLIXIYWCPZ-HNNXBMFYSA-N 1 1 274.364 3.605 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@@H]12 ZINC000515548296 1122509585 /nfs/dbraw/zinc/50/95/85/1122509585.db2.gz RHIXYHKHOLELLH-XOKHGSTOSA-N 1 1 288.391 3.995 20 5 CHBDMO CC1=CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000436257120 1122528216 /nfs/dbraw/zinc/52/82/16/1122528216.db2.gz CTPXHXQQGDXYKS-UHFFFAOYSA-N 1 1 290.363 3.534 20 5 CHBDMO CC1=CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000436257120 1122528219 /nfs/dbraw/zinc/52/82/19/1122528219.db2.gz CTPXHXQQGDXYKS-UHFFFAOYSA-N 1 1 290.363 3.534 20 5 CHBDMO CC[N@@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505848325 1122561989 /nfs/dbraw/zinc/56/19/89/1122561989.db2.gz QFCIIFBHRQJKOL-UHFFFAOYSA-N 1 1 284.359 3.925 20 5 CHBDMO CC[N@@H+](Cc1cccs1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506017829 1122626101 /nfs/dbraw/zinc/62/61/01/1122626101.db2.gz VMMNCCOOHVWFIP-UHFFFAOYSA-N 1 1 290.388 3.987 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001192481314 1122649327 /nfs/dbraw/zinc/64/93/27/1122649327.db2.gz LKLWKALARQQGME-CQSZACIVSA-N 1 1 276.380 3.771 20 5 CHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000506220216 1122698105 /nfs/dbraw/zinc/69/81/05/1122698105.db2.gz VAEDHLRDBZZDCI-GXTWGEPZSA-N 1 1 262.353 3.605 20 5 CHBDMO CCC[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000506498177 1122756859 /nfs/dbraw/zinc/75/68/59/1122756859.db2.gz BRJIAJFHEYETRP-UHFFFAOYSA-N 1 1 250.342 3.560 20 5 CHBDMO CC(C)C[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000506500916 1122758410 /nfs/dbraw/zinc/75/84/10/1122758410.db2.gz YBQXRPPERBNQPH-UHFFFAOYSA-N 1 1 288.347 3.943 20 5 CHBDMO CCCCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194466965 1122776493 /nfs/dbraw/zinc/77/64/93/1122776493.db2.gz MIFZRDSAPFCRGM-OAHLLOKOSA-N 1 1 276.380 3.964 20 5 CHBDMO CC(C)[C@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507187519 1122845752 /nfs/dbraw/zinc/84/57/52/1122845752.db2.gz KUCUGMFMZULRPZ-GTBONMDNSA-N 1 1 274.364 3.728 20 5 CHBDMO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@H]1CC1(C)C ZINC001196458562 1122923708 /nfs/dbraw/zinc/92/37/08/1122923708.db2.gz NDEWDHTYMKJCAE-LLVKDONJSA-N 1 1 282.771 3.726 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)C(C)C ZINC000520564846 1123176033 /nfs/dbraw/zinc/17/60/33/1123176033.db2.gz YLFGGMNFNQKQTE-CYBMUJFWSA-N 1 1 294.395 3.858 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000525273841 1124119609 /nfs/dbraw/zinc/11/96/09/1124119609.db2.gz ZKALKBJZKFXEEQ-XNRPHZJLSA-N 1 1 274.364 3.748 20 5 CHBDMO CCC(C)(C)OCC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872078916 1124677149 /nfs/dbraw/zinc/67/71/49/1124677149.db2.gz UJCBOCASPMEQKV-NSHDSACASA-N 1 1 298.358 3.590 20 5 CHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]3C3CC3)o2)cc1 ZINC000449425035 1124732339 /nfs/dbraw/zinc/73/23/39/1124732339.db2.gz MAZCNTRRUWOAHP-MRXNPFEDSA-N 1 1 298.342 3.839 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC2CC2)CC2CCC2)cc1 ZINC000475677765 1125210027 /nfs/dbraw/zinc/21/00/27/1125210027.db2.gz NENAZBOXMZJILQ-UHFFFAOYSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000531441469 1125218918 /nfs/dbraw/zinc/21/89/18/1125218918.db2.gz NOXYHJJFFXODIL-KSSFIOAISA-N 1 1 296.370 3.973 20 5 CHBDMO C[C@@H]([N@@H+](C)CCc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000532491070 1125408035 /nfs/dbraw/zinc/40/80/35/1125408035.db2.gz WQMXURBVVLFVNA-GFCCVEGCSA-N 1 1 264.369 3.504 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774883 1129452024 /nfs/dbraw/zinc/45/20/24/1129452024.db2.gz HIBFUSRWNQRCMK-GFCCVEGCSA-N 1 1 280.343 3.746 20 5 CHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC2(C1)CCCCC2 ZINC000741806279 1129454790 /nfs/dbraw/zinc/45/47/90/1129454790.db2.gz DZPMIZCWPHRANT-UHFFFAOYSA-N 1 1 292.354 3.890 20 5 CHBDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000303755045 1129557453 /nfs/dbraw/zinc/55/74/53/1129557453.db2.gz MUKMBMWHXWWOQF-HNNXBMFYSA-N 1 1 298.386 3.966 20 5 CHBDMO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCC[C@@H]2c2ccccc2)C1 ZINC001169006017 1129689194 /nfs/dbraw/zinc/68/91/94/1129689194.db2.gz FIPBYULVNOJYAP-DJIMGWMZSA-N 1 1 288.391 3.659 20 5 CHBDMO C[N@@H+](Cc1cccc2ccccc21)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169023258 1129691156 /nfs/dbraw/zinc/69/11/56/1129691156.db2.gz DVLVVPWEWHUEEV-PBHICJAKSA-N 1 1 298.386 3.717 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC001460192359 1129851888 /nfs/dbraw/zinc/85/18/88/1129851888.db2.gz FCAJKUNRHMLBEN-LBPRGKRZSA-N 1 1 264.369 3.914 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]2CCCC[C@H]12 ZINC000801539204 1129925846 /nfs/dbraw/zinc/92/58/46/1129925846.db2.gz CXSQAJBAXYGXFR-KYOSRNDESA-N 1 1 292.354 3.744 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746657358 1130136564 /nfs/dbraw/zinc/13/65/64/1130136564.db2.gz GOUDJNJHNCVYOG-SNVBAGLBSA-N 1 1 270.760 3.869 20 5 CHBDMO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000903341292 1130163003 /nfs/dbraw/zinc/16/30/03/1130163003.db2.gz XIOLEYCTMIPTMR-YVEFUNNKSA-N 1 1 297.358 3.792 20 5 CHBDMO CC[C@H](C)C[N@@H+](CC)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748829458 1130249305 /nfs/dbraw/zinc/24/93/05/1130249305.db2.gz ZNJQKUONKMUAJH-NSHDSACASA-N 1 1 268.332 3.602 20 5 CHBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000784515366 1130908227 /nfs/dbraw/zinc/90/82/27/1130908227.db2.gz IXYWBDZUENTPON-GFCCVEGCSA-N 1 1 280.343 3.602 20 5 CHBDMO CC1=C[C@H](C)C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000797526556 1130990519 /nfs/dbraw/zinc/99/05/19/1130990519.db2.gz UMYUHOHRSMNEPZ-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799196888 1131075488 /nfs/dbraw/zinc/07/54/88/1131075488.db2.gz ZDHHDDIRPLAPKS-HIFRSBDPSA-N 1 1 297.358 3.540 20 5 CHBDMO CC[N@H+]1CC[C@@H](Oc2cccc3ccc4cccnc4c32)C1 ZINC001227764359 1131740377 /nfs/dbraw/zinc/74/03/77/1131740377.db2.gz NSQOLWSGTUIROC-MRXNPFEDSA-N 1 1 292.382 3.861 20 5 CHBDMO CC[N@H+]1CC[C@@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001228176774 1131823223 /nfs/dbraw/zinc/82/32/23/1131823223.db2.gz RMBHEBNKBPEYAQ-MRXNPFEDSA-N 1 1 292.382 3.861 20 5 CHBDMO Cc1c(C[N@H+]2CCCC3(CCC3)C2)cccc1[N+](=O)[O-] ZINC000348168968 1131898086 /nfs/dbraw/zinc/89/80/86/1131898086.db2.gz NTEPXRYFBZMARM-UHFFFAOYSA-N 1 1 274.364 3.669 20 5 CHBDMO CCC(CC)[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172920990 1132362287 /nfs/dbraw/zinc/36/22/87/1132362287.db2.gz NGGWUMRTWLJPMZ-MRXNPFEDSA-N 1 1 290.407 3.963 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909940 1132372245 /nfs/dbraw/zinc/37/22/45/1132372245.db2.gz VWLBNXCXZGKCPF-CZUORRHYSA-N 1 1 288.391 3.717 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001173222503 1132411405 /nfs/dbraw/zinc/41/14/05/1132411405.db2.gz SMLROWCUTQZBTF-BMFZPTHFSA-N 1 1 288.391 3.648 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233455 1132413845 /nfs/dbraw/zinc/41/38/45/1132413845.db2.gz WSAJJNBAMKFIAF-HIFRSBDPSA-N 1 1 276.380 3.790 20 5 CHBDMO CCC(CC)[N@@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233996 1132413966 /nfs/dbraw/zinc/41/39/66/1132413966.db2.gz NTHYSCWDRDCIIV-GFCCVEGCSA-N 1 1 264.369 3.646 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccsc1 ZINC001173233727 1132414027 /nfs/dbraw/zinc/41/40/27/1132414027.db2.gz MSTYIOOFCUXUNV-GFCCVEGCSA-N 1 1 290.388 3.719 20 5 CHBDMO c1cnc2c(c1)ccc1ccc(C[N@H+]3C[C@H]4CC[C@@H]3C4)nc12 ZINC001232223520 1132438800 /nfs/dbraw/zinc/43/88/00/1132438800.db2.gz PMYKFZUEERNKMN-SUMWQHHRSA-N 1 1 289.382 3.767 20 5 CHBDMO CC(C)(C)C(=[NH2+])Nc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC001162657935 1133102189 /nfs/dbraw/zinc/10/21/89/1133102189.db2.gz WLVOAEYXLLVAFU-UHFFFAOYSA-N 1 1 272.308 3.578 20 5 CHBDMO O=[N+]([O-])c1cccc(Nc2cccc3cc[nH+]cc32)c1 ZINC001204468891 1133451039 /nfs/dbraw/zinc/45/10/39/1133451039.db2.gz LUTWVARYLKUUFS-UHFFFAOYSA-N 1 1 265.272 3.887 20 5 CHBDMO Cc1c(C[N@H+]2CC(C)(C)[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001206117076 1133660389 /nfs/dbraw/zinc/66/03/89/1133660389.db2.gz XSFWAGLTDDSJQH-OAHLLOKOSA-N 1 1 274.364 3.524 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)CCN1 ZINC001206389388 1133697260 /nfs/dbraw/zinc/69/72/60/1133697260.db2.gz RVAAPSUHRFLCEE-HNNXBMFYSA-N 1 1 290.410 3.787 20 5 CHBDMO C[C@H]1CN(Cc2c3ccccc3cc3ccccc32)CC[NH2+]1 ZINC001206389388 1133697263 /nfs/dbraw/zinc/69/72/63/1133697263.db2.gz RVAAPSUHRFLCEE-HNNXBMFYSA-N 1 1 290.410 3.787 20 5 CHBDMO Cc1ccc(Nc2ccc3c(c2)C[N@@H+](C)CC3)cc1[N+](=O)[O-] ZINC001213672410 1134476994 /nfs/dbraw/zinc/47/69/94/1134476994.db2.gz CUQMZVZWRWTPKV-UHFFFAOYSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(Nc2c[nH+]c3cccc(C)n23)c([N+](=O)[O-])c1 ZINC001214169642 1134515757 /nfs/dbraw/zinc/51/57/57/1134515757.db2.gz WVYVXCSYFRUHGD-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO CC[N@H+]1CC[C@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001226991569 1135771933 /nfs/dbraw/zinc/77/19/33/1135771933.db2.gz BMUXKRTZSUHHLU-AWEZNQCLSA-N 1 1 292.382 3.861 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccco2)cc1[N+](=O)[O-] ZINC000035738645 172392798 /nfs/dbraw/zinc/39/27/98/172392798.db2.gz ZCEOUOYASHCEBI-NWDGAFQWSA-N 1 1 274.320 3.908 20 5 CHBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000037403646 173180039 /nfs/dbraw/zinc/18/00/39/173180039.db2.gz FYBDOAZIZPKZET-PHIMTYICSA-N 1 1 282.771 3.726 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCc2occc2C1 ZINC000344313827 225024418 /nfs/dbraw/zinc/02/44/18/225024418.db2.gz YILIBNHGSWTGNE-GFCCVEGCSA-N 1 1 286.331 3.697 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCc2occc2C1 ZINC000344313827 225024420 /nfs/dbraw/zinc/02/44/20/225024420.db2.gz YILIBNHGSWTGNE-GFCCVEGCSA-N 1 1 286.331 3.697 20 5 CHBDMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000080273528 260179946 /nfs/dbraw/zinc/17/99/46/260179946.db2.gz MOWNQRYNIYURAD-GHMZBOCLSA-N 1 1 291.376 3.772 20 5 CHBDMO CC(C)[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000158701642 261169433 /nfs/dbraw/zinc/16/94/33/261169433.db2.gz QBFKJNPJYVFKJI-UHFFFAOYSA-N 1 1 291.376 3.559 20 5 CHBDMO Cc1cnc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000177959811 261373300 /nfs/dbraw/zinc/37/33/00/261373300.db2.gz GEPUDIGRQBNGBH-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1ccncc1 ZINC000289751787 263111902 /nfs/dbraw/zinc/11/19/02/263111902.db2.gz JECKEZZDGHNIJH-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO O=[N+]([O-])c1cc(CNc2cc(C3CC3)cc[nH+]2)cs1 ZINC000289890211 263112735 /nfs/dbraw/zinc/11/27/35/263112735.db2.gz SOGAHFAPJJUWRB-UHFFFAOYSA-N 1 1 275.333 3.541 20 5 CHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000519001674 265289170 /nfs/dbraw/zinc/28/91/70/265289170.db2.gz MOAGPHGKKHPOTJ-OCCSQVGLSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cn1 ZINC000271805521 328197412 /nfs/dbraw/zinc/19/74/12/328197412.db2.gz PZXASVDDQNRHRR-WDEREUQCSA-N 1 1 289.310 3.541 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C1CCC(F)(F)CC1 ZINC000558423452 327093038 /nfs/dbraw/zinc/09/30/38/327093038.db2.gz KENCZLMPRQVYSE-UHFFFAOYSA-N 1 1 298.333 3.913 20 5 CHBDMO CC(C)C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000089512367 327170851 /nfs/dbraw/zinc/17/08/51/327170851.db2.gz MBTWARCTMNGXSF-MRXNPFEDSA-N 1 1 299.374 3.867 20 5 CHBDMO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000175139814 329163451 /nfs/dbraw/zinc/16/34/51/329163451.db2.gz LSJMLBNGCIBNKJ-QGZVFWFLSA-N 1 1 299.374 3.661 20 5 CHBDMO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000175139814 329163452 /nfs/dbraw/zinc/16/34/52/329163452.db2.gz LSJMLBNGCIBNKJ-QGZVFWFLSA-N 1 1 299.374 3.661 20 5 CHBDMO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CO2 ZINC000130747647 329627694 /nfs/dbraw/zinc/62/76/94/329627694.db2.gz QENKVXICCJCTAM-MLGOLLRUSA-N 1 1 298.342 3.688 20 5 CHBDMO CC(C)[C@@H]1CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000445428460 330216093 /nfs/dbraw/zinc/21/60/93/330216093.db2.gz WJGOQIDUDYUYKD-TZMCWYRMSA-N 1 1 262.353 3.634 20 5 CHBDMO CC(C)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000533243808 330355018 /nfs/dbraw/zinc/35/50/18/330355018.db2.gz BSBNZIFFHADYRD-UHFFFAOYSA-N 1 1 264.369 3.504 20 5 CHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]Cc3ccco3)o2)c1 ZINC000171048711 330846400 /nfs/dbraw/zinc/84/64/00/330846400.db2.gz TYFLFMAEWXQHCF-UHFFFAOYSA-N 1 1 298.298 3.738 20 5 CHBDMO CC[C@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])C(F)F ZINC000449360122 330918517 /nfs/dbraw/zinc/91/85/17/330918517.db2.gz IWCQPUCDLBNTIZ-PWSUYJOCSA-N 1 1 286.322 3.549 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463483690 331348433 /nfs/dbraw/zinc/34/84/33/331348433.db2.gz ZJSNLCGEBLJGKP-GFCCVEGCSA-N 1 1 296.342 3.507 20 5 CHBDMO C[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000464822213 331369697 /nfs/dbraw/zinc/36/96/97/331369697.db2.gz KXGIUFYLDKHJPN-MNOVXSKESA-N 1 1 282.771 3.869 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)C(C)C ZINC000491090291 332147794 /nfs/dbraw/zinc/14/77/94/332147794.db2.gz OJEMHNRJMYWXCI-NSHDSACASA-N 1 1 268.332 3.600 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)C(C)C ZINC000491090290 332147842 /nfs/dbraw/zinc/14/78/42/332147842.db2.gz OJEMHNRJMYWXCI-LLVKDONJSA-N 1 1 268.332 3.600 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492278553 332390146 /nfs/dbraw/zinc/39/01/46/332390146.db2.gz WMIKGBCDNYFBQP-JTQLQIEISA-N 1 1 270.760 3.726 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000575790861 335115256 /nfs/dbraw/zinc/11/52/56/335115256.db2.gz SXXAANNGXMSNOE-GFCCVEGCSA-N 1 1 250.342 3.605 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000182842707 333117788 /nfs/dbraw/zinc/11/77/88/333117788.db2.gz LCKGTBWBHRWFFD-MELADBBJSA-N 1 1 274.364 3.696 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000523701358 333339911 /nfs/dbraw/zinc/33/99/11/333339911.db2.gz GRUKMUTUIHUDSL-QGZVFWFLSA-N 1 1 296.370 3.584 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 ZINC000523701357 333340068 /nfs/dbraw/zinc/34/00/68/333340068.db2.gz GRUKMUTUIHUDSL-KRWDZBQOSA-N 1 1 296.370 3.584 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000524766732 333387294 /nfs/dbraw/zinc/38/72/94/333387294.db2.gz NKOAZLPAOGNKJN-OAHLLOKOSA-N 1 1 262.353 3.607 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000524766830 333387312 /nfs/dbraw/zinc/38/73/12/333387312.db2.gz PXHLPEOQKNFTAX-OAHLLOKOSA-N 1 1 262.353 3.607 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000037775677 333539235 /nfs/dbraw/zinc/53/92/35/333539235.db2.gz NYQZEJGEHWCCPV-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@@H]1CCCCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000547931336 334129783 /nfs/dbraw/zinc/12/97/83/334129783.db2.gz JZHYRYDFUNLXLB-DNGMOHDESA-N 1 1 274.364 3.873 20 5 CHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549169003 334186889 /nfs/dbraw/zinc/18/68/89/334186889.db2.gz RHAQRJOAGARZML-AWEZNQCLSA-N 1 1 284.359 3.830 20 5 CHBDMO C[N@H+]1CCCC[C@@H]1CCSc1cccc([N+](=O)[O-])c1 ZINC000551462279 334250988 /nfs/dbraw/zinc/25/09/88/334250988.db2.gz ZZSSFOJSBSTPHH-GFCCVEGCSA-N 1 1 280.393 3.561 20 5 CHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000551825325 334263678 /nfs/dbraw/zinc/26/36/78/334263678.db2.gz FBRMESFVOCPZFW-VQHVLOKHSA-N 1 1 274.364 3.873 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCSC[C@@H](C)C1 ZINC000248943687 334322267 /nfs/dbraw/zinc/32/22/67/334322267.db2.gz AEEIOIUADBJOLX-WCQYABFASA-N 1 1 294.420 3.649 20 5 CHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353878479 533823589 /nfs/dbraw/zinc/82/35/89/533823589.db2.gz DEXKCVKVDVTXOY-WDEREUQCSA-N 1 1 268.382 3.667 20 5 CHBDMO CC(C)([NH2+]Cc1ccccc1F)c1ccccc1[N+](=O)[O-] ZINC000291630675 519325092 /nfs/dbraw/zinc/32/50/92/519325092.db2.gz AMAINUCTAODBIR-UHFFFAOYSA-N 1 1 288.322 3.759 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H](C)c1cccnc1 ZINC000290535798 521304513 /nfs/dbraw/zinc/30/45/13/521304513.db2.gz QWUDSMCHOUCRLM-CQSZACIVSA-N 1 1 299.374 3.881 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000357006221 524295399 /nfs/dbraw/zinc/29/53/99/524295399.db2.gz AHFBUULOSYVOJV-ZDUSSCGKSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000357006219 524512960 /nfs/dbraw/zinc/51/29/60/524512960.db2.gz AHFBUULOSYVOJV-CYBMUJFWSA-N 1 1 274.364 3.607 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1CNc1cccc(C2CC2)[nH+]1 ZINC000339427990 525565096 /nfs/dbraw/zinc/56/50/96/525565096.db2.gz IGDZKTFAYXXACE-UHFFFAOYSA-N 1 1 283.331 3.788 20 5 CHBDMO CSC[C@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000292453505 525708435 /nfs/dbraw/zinc/70/84/35/525708435.db2.gz PQTBXNRCVVKRHP-OLZOCXBDSA-N 1 1 294.420 3.731 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccccn1 ZINC000347382315 527529334 /nfs/dbraw/zinc/52/93/34/527529334.db2.gz UYVHGUYXPAFLBP-GXDHUFHOSA-N 1 1 297.358 3.525 20 5 CHBDMO Cc1c(C[N@@H+]2C[C@H](C)CC2(C)C)cccc1[N+](=O)[O-] ZINC000472276854 1119280282 /nfs/dbraw/zinc/28/02/82/1119280282.db2.gz LOLLRCXQBLCTRK-LLVKDONJSA-N 1 1 262.353 3.524 20 5 CHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000542320753 1121566917 /nfs/dbraw/zinc/56/69/17/1121566917.db2.gz UUEOBMUBNARSEZ-NSHDSACASA-N 1 1 268.382 3.524 20 5 CHBDMO Cc1ccc(C[N@H+](CC(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000509403386 1121573417 /nfs/dbraw/zinc/57/34/17/1121573417.db2.gz ZUTAJNOIBOGASM-UHFFFAOYSA-N 1 1 264.369 3.770 20 5 CHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000482489457 1126760748 /nfs/dbraw/zinc/76/07/48/1126760748.db2.gz KJWJYVJZIUHWQI-IAQYHMDHSA-N 1 1 262.353 3.524 20 5 CHBDMO COc1cc(C[N@@H+](C)C2CCCCCC2)ccc1[N+](=O)[O-] ZINC000485788825 1126953394 /nfs/dbraw/zinc/95/33/94/1126953394.db2.gz GPZLQFWYJVWWPP-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO CCc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000271679790 1127096642 /nfs/dbraw/zinc/09/66/42/1127096642.db2.gz OQSGOVFGAMGGEK-NSHDSACASA-N 1 1 274.320 3.601 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1c1cccnc1 ZINC000348927316 1127134555 /nfs/dbraw/zinc/13/45/55/1127134555.db2.gz ZXDFKHFBSSWZDA-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2C[C@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000816646776 1131118490 /nfs/dbraw/zinc/11/84/90/1131118490.db2.gz IYCGQDQGAPHAPP-NWDGAFQWSA-N 1 1 262.353 3.558 20 5 CHBDMO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H]1C1CC1 ZINC000589517713 1127226089 /nfs/dbraw/zinc/22/60/89/1127226089.db2.gz ZQBRREGNYKMNIJ-CQSZACIVSA-N 1 1 294.782 3.869 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H]1C1CC1 ZINC000589517713 1127226092 /nfs/dbraw/zinc/22/60/92/1127226092.db2.gz ZQBRREGNYKMNIJ-CQSZACIVSA-N 1 1 294.782 3.869 20 5 CHBDMO CC(C)O[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000593056117 1127370369 /nfs/dbraw/zinc/37/03/69/1127370369.db2.gz YHKSOAUMOWQJOS-KBPBESRZSA-N 1 1 292.379 3.545 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761045774 1127408209 /nfs/dbraw/zinc/40/82/09/1127408209.db2.gz QZLYSMHFCFWEBS-ZJUUUORDSA-N 1 1 288.269 3.540 20 5 CHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000359303805 1127457540 /nfs/dbraw/zinc/45/75/40/1127457540.db2.gz PTNWVJMWCGBYRL-BXUZGUMPSA-N 1 1 280.393 3.668 20 5 CHBDMO CCCC[N@@H+](Cc1onc(C)c1[N+](=O)[O-])C1CCCCC1 ZINC000595296470 1127457457 /nfs/dbraw/zinc/45/74/57/1127457457.db2.gz DOROTCBJPBVEOP-UHFFFAOYSA-N 1 1 295.383 3.826 20 5 CHBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000359541038 1127467011 /nfs/dbraw/zinc/46/70/11/1127467011.db2.gz CYVQNYJDXHYYAS-LRDDRELGSA-N 1 1 292.354 3.746 20 5 CHBDMO C[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C(F)F ZINC000603428622 1127649420 /nfs/dbraw/zinc/64/94/20/1127649420.db2.gz KOHQTEYGOVHEJR-LOWVWBTDSA-N 1 1 298.333 3.549 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000603582122 1127660734 /nfs/dbraw/zinc/66/07/34/1127660734.db2.gz UMHVGIFGUIUMGN-JSGCOSHPSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000603662028 1127664925 /nfs/dbraw/zinc/66/49/25/1127664925.db2.gz BDADJFSWWDQPBG-COXVUDFISA-N 1 1 288.391 3.995 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000603860173 1127679915 /nfs/dbraw/zinc/67/99/15/1127679915.db2.gz YIEKFXJMQJHSHF-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2C2CCCC2)cc1 ZINC000604013222 1127689573 /nfs/dbraw/zinc/68/95/73/1127689573.db2.gz SVKDGXINSYSIRK-MRXNPFEDSA-N 1 1 274.364 3.749 20 5 CHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000076068575 1127933124 /nfs/dbraw/zinc/93/31/24/1127933124.db2.gz GTAYCWJYTPOKQW-HIFRSBDPSA-N 1 1 294.420 3.701 20 5 CHBDMO Cc1cc(NCCC[N@@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000035277334 1127934839 /nfs/dbraw/zinc/93/48/39/1127934839.db2.gz YTVTVJUGBOSUPZ-CQSZACIVSA-N 1 1 291.395 3.580 20 5 CHBDMO Cc1ccc(C[N@H+]2C[C@H](C)CC[C@H]2C)cc1[N+](=O)[O-] ZINC000539824826 1127940761 /nfs/dbraw/zinc/94/07/61/1127940761.db2.gz LGHUFINXMASNRK-DGCLKSJQSA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1c(C[N@@H+]2[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000466924113 1127950140 /nfs/dbraw/zinc/95/01/40/1127950140.db2.gz OVSNFMIKUPJWHI-TXEJJXNPSA-N 1 1 262.353 3.666 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H]1CC=CCC1 ZINC000544116846 1127959320 /nfs/dbraw/zinc/95/93/20/1127959320.db2.gz KKGCFDFTKBKRJQ-KBPBESRZSA-N 1 1 274.364 3.944 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000544610840 1127978656 /nfs/dbraw/zinc/97/86/56/1127978656.db2.gz AYARAMPNEKWKJS-QGZVFWFLSA-N 1 1 296.370 3.720 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H](C)C(C)C ZINC000470169060 1128064445 /nfs/dbraw/zinc/06/44/45/1128064445.db2.gz BCJHJOKMTWWYTF-RNQWEJQRSA-N 1 1 276.380 3.974 20 5 CHBDMO CC[C@H](C)[N@@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470179137 1128064770 /nfs/dbraw/zinc/06/47/70/1128064770.db2.gz SSXREKYQKCHKEE-SRXBQZRASA-N 1 1 262.353 3.728 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000492785040 1128113066 /nfs/dbraw/zinc/11/30/66/1128113066.db2.gz RWKPQAQALHQXDJ-TZMCWYRMSA-N 1 1 274.364 3.696 20 5 CHBDMO CCOc1cc(C[N@@H+](C)[C@H](C)C2(C)CC2)ccc1[N+](=O)[O-] ZINC000492793593 1128113808 /nfs/dbraw/zinc/11/38/08/1128113808.db2.gz VSQWVWFOFXTAPR-GFCCVEGCSA-N 1 1 292.379 3.614 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC1CCCC1 ZINC000761506018 1128132260 /nfs/dbraw/zinc/13/22/60/1128132260.db2.gz MBYWNDOWEOMQQV-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC1CCCC1 ZINC000493704223 1128147263 /nfs/dbraw/zinc/14/72/63/1128147263.db2.gz GGRLDLXWXILNOZ-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO Cc1cc(NCCC[N@@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000035277331 1128276637 /nfs/dbraw/zinc/27/66/37/1128276637.db2.gz YTVTVJUGBOSUPZ-AWEZNQCLSA-N 1 1 291.395 3.580 20 5 CHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000915683661 1128334068 /nfs/dbraw/zinc/33/40/68/1128334068.db2.gz XRYNHKZQHKXUPB-UHFFFAOYSA-N 1 1 280.343 3.889 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000562058753 1128374605 /nfs/dbraw/zinc/37/46/05/1128374605.db2.gz QFFGWLMOZZKLGK-LBPRGKRZSA-N 1 1 280.368 3.614 20 5 CHBDMO Cc1cccc(C[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917073707 1128473941 /nfs/dbraw/zinc/47/39/41/1128473941.db2.gz QKCZYLQHGUPHCK-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917073707 1128473943 /nfs/dbraw/zinc/47/39/43/1128473943.db2.gz QKCZYLQHGUPHCK-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000609766777 1128724277 /nfs/dbraw/zinc/72/42/77/1128724277.db2.gz PWDOEMJEMXGKRA-CYBMUJFWSA-N 1 1 262.353 3.607 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609766668 1128725495 /nfs/dbraw/zinc/72/54/95/1128725495.db2.gz AEJKBDZHCUQNDT-GFCCVEGCSA-N 1 1 280.343 3.746 20 5 CHBDMO Cc1c(C[N@H+](C)Cc2ccccc2F)cccc1[N+](=O)[O-] ZINC000051213059 1118690115 /nfs/dbraw/zinc/69/01/15/1118690115.db2.gz FELCOZDYCJJTDY-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1c(C[N@@H+](C)Cc2ccccc2F)cccc1[N+](=O)[O-] ZINC000051213059 1118690116 /nfs/dbraw/zinc/69/01/16/1118690116.db2.gz FELCOZDYCJJTDY-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO COc1ccc(C[N@@H+](CCC(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000047911833 1118708209 /nfs/dbraw/zinc/70/82/09/1118708209.db2.gz CXSLOTJRXJZPIA-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO CC1=C[C@@H](C)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000430882975 1118783352 /nfs/dbraw/zinc/78/33/52/1118783352.db2.gz NXZXLMZVOCNBNB-SCXUMTSISA-N 1 1 272.348 3.506 20 5 CHBDMO CC(C)c1ccc(C[N@H+](C)C(C)C)cc1[N+](=O)[O-] ZINC000158722988 1119152711 /nfs/dbraw/zinc/15/27/11/1119152711.db2.gz ROLGBYNFBUECBP-UHFFFAOYSA-N 1 1 250.342 3.558 20 5 CHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000219697842 1119511288 /nfs/dbraw/zinc/51/12/88/1119511288.db2.gz GMUQKTQWFUGXJU-IUODEOHRSA-N 1 1 262.353 3.605 20 5 CHBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000612177724 1119744342 /nfs/dbraw/zinc/74/43/42/1119744342.db2.gz WOECVAQDCSOWES-LLVKDONJSA-N 1 1 280.343 3.602 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC)C1CCCC1 ZINC000580720294 1119884789 /nfs/dbraw/zinc/88/47/89/1119884789.db2.gz XOVJLXJUSNYTRP-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000313825454 1120412666 /nfs/dbraw/zinc/41/26/66/1120412666.db2.gz MAXMEPHVSISWIG-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000313825454 1120412669 /nfs/dbraw/zinc/41/26/69/1120412669.db2.gz MAXMEPHVSISWIG-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3CCC[C@H]32)c(Cl)c1 ZINC000426525046 1120472718 /nfs/dbraw/zinc/47/27/18/1120472718.db2.gz QCDTYULCFMMBKH-QMTHXVAHSA-N 1 1 280.755 3.623 20 5 CHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2sccc2[N+](=O)[O-])C1 ZINC000301984653 1120523964 /nfs/dbraw/zinc/52/39/64/1120523964.db2.gz IZHSLCCVUDMPLD-GFCCVEGCSA-N 1 1 297.424 3.580 20 5 CHBDMO C[C@@H]1C[C@H](C)C[N@H+](CCSc2cccc([N+](=O)[O-])c2)C1 ZINC001307342106 1120537782 /nfs/dbraw/zinc/53/77/82/1120537782.db2.gz RRIMPGWSFHUFGF-BETUJISGSA-N 1 1 294.420 3.665 20 5 CHBDMO CC[N@@H+](CCC(F)(F)F)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000092737706 1120562032 /nfs/dbraw/zinc/56/20/32/1120562032.db2.gz SHEJDUDJTNCSMV-UHFFFAOYSA-N 1 1 290.285 3.678 20 5 CHBDMO Cc1c(C[N@H+](Cc2cccnc2)C(C)C)cccc1[N+](=O)[O-] ZINC000125681821 1120621914 /nfs/dbraw/zinc/62/19/14/1120621914.db2.gz OJVVWXPVKPLHJW-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO C[N@H+]1CCCC[C@H]1CCSc1ccc([N+](=O)[O-])cc1F ZINC000585732541 1121022029 /nfs/dbraw/zinc/02/20/29/1121022029.db2.gz SSMPMHUHPNPPHS-NSHDSACASA-N 1 1 298.383 3.700 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000585754374 1121029641 /nfs/dbraw/zinc/02/96/41/1121029641.db2.gz KNXKXEBNFNNXHZ-UHFFFAOYSA-N 1 1 284.359 3.962 20 5 CHBDMO CS[C@@H]1CCCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246577416 1121310926 /nfs/dbraw/zinc/31/09/26/1121310926.db2.gz LUTILWQSUCVTOI-IUODEOHRSA-N 1 1 294.420 3.873 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2C2CC2)ccc1Cl ZINC000706685038 1121434288 /nfs/dbraw/zinc/43/42/88/1121434288.db2.gz PBMMDCXTXADJEV-CYBMUJFWSA-N 1 1 280.755 3.623 20 5 CHBDMO CC[C@H]1CCCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509277337 1121509312 /nfs/dbraw/zinc/50/93/12/1121509312.db2.gz AROFDHMYZSJSLS-JTQLQIEISA-N 1 1 284.306 3.638 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509277337 1121509317 /nfs/dbraw/zinc/50/93/17/1121509317.db2.gz AROFDHMYZSJSLS-JTQLQIEISA-N 1 1 284.306 3.638 20 5 CHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC1CCCC1 ZINC000512672049 1121522855 /nfs/dbraw/zinc/52/28/55/1121522855.db2.gz FNCOXQVVTJOFJW-UXBLZVDNSA-N 1 1 274.364 3.730 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CC[C@@H](C)C1 ZINC000433038369 1121528259 /nfs/dbraw/zinc/52/82/59/1121528259.db2.gz JRPPGAYJAUCADH-RISCZKNCSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C(C)(C)C(F)F ZINC000619432094 1128991763 /nfs/dbraw/zinc/99/17/63/1128991763.db2.gz SBDXULOOPXCTAK-SNVBAGLBSA-N 1 1 286.322 3.549 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CC(C)C)C(C)C ZINC000543631557 1121538334 /nfs/dbraw/zinc/53/83/34/1121538334.db2.gz KTGZEXCBNMYUAT-UHFFFAOYSA-N 1 1 264.369 3.770 20 5 CHBDMO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000611395311 1121643535 /nfs/dbraw/zinc/64/35/35/1121643535.db2.gz MWXSGBWEDPQCHA-VHSXEESVSA-N 1 1 291.376 3.772 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000501788000 1122008767 /nfs/dbraw/zinc/00/87/67/1122008767.db2.gz BWMXTCVJPCFJPS-JHJVBQTASA-N 1 1 262.353 3.634 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000501792208 1122010306 /nfs/dbraw/zinc/01/03/06/1122010306.db2.gz CWLNPQCGLYWFAN-FRRDWIJNSA-N 1 1 262.353 3.634 20 5 CHBDMO CC[N@@H+](Cc1c(C)ccc([N+](=O)[O-])c1C)C1CCCC1 ZINC001181657237 1122067718 /nfs/dbraw/zinc/06/77/18/1122067718.db2.gz XPQMYCBZGVDTEW-UHFFFAOYSA-N 1 1 276.380 3.976 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)C1(C)CC1 ZINC000183391773 1129051958 /nfs/dbraw/zinc/05/19/58/1129051958.db2.gz DHYPFHWFRPOHND-GFCCVEGCSA-N 1 1 262.353 3.524 20 5 CHBDMO CC(C)[C@H]1[N@@H+](Cc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000430100954 1122404454 /nfs/dbraw/zinc/40/44/54/1122404454.db2.gz BPUWXLIXIYWCPZ-OAHLLOKOSA-N 1 1 274.364 3.605 20 5 CHBDMO CC1CCC([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000505585377 1122425495 /nfs/dbraw/zinc/42/54/95/1122425495.db2.gz MTYLHMWMMQTWRY-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)CC[N+](=O)[O-] ZINC001191290032 1122589484 /nfs/dbraw/zinc/58/94/84/1122589484.db2.gz YLBGXTRMBSNWNE-AWEZNQCLSA-N 1 1 284.359 3.623 20 5 CHBDMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429600739 1122726593 /nfs/dbraw/zinc/72/65/93/1122726593.db2.gz WTRKEGVAQLQQQM-MNOVXSKESA-N 1 1 282.771 3.869 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000426488823 1122804937 /nfs/dbraw/zinc/80/49/37/1122804937.db2.gz XYWRPEXWKYCUAJ-GWCFXTLKSA-N 1 1 280.755 3.623 20 5 CHBDMO Cc1cc(F)ccc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000507145164 1122929902 /nfs/dbraw/zinc/92/99/02/1122929902.db2.gz REZFHOKSRDSQCM-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)[C@@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000507439652 1122955049 /nfs/dbraw/zinc/95/50/49/1122955049.db2.gz DXAJTHWYSFHUOQ-LBPRGKRZSA-N 1 1 276.380 3.949 20 5 CHBDMO Cc1nc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)sc1C ZINC000173456399 1123805921 /nfs/dbraw/zinc/80/59/21/1123805921.db2.gz XWQACEJHKJWPDS-JTQLQIEISA-N 1 1 291.376 3.519 20 5 CHBDMO Cc1nc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)sc1C ZINC000173456407 1123806022 /nfs/dbraw/zinc/80/60/22/1123806022.db2.gz XWQACEJHKJWPDS-SNVBAGLBSA-N 1 1 291.376 3.519 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2C2CC2)cc1Cl ZINC000783560387 1123819923 /nfs/dbraw/zinc/81/99/23/1123819923.db2.gz ZAYGZXRQSLWHRF-ZDUSSCGKSA-N 1 1 280.755 3.623 20 5 CHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000525637136 1124450537 /nfs/dbraw/zinc/45/05/37/1124450537.db2.gz ZVKMQFGYLFLHPB-QWHCGFSZSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1ccncc1C[N@@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000877491170 1125035191 /nfs/dbraw/zinc/03/51/91/1125035191.db2.gz GWFMHAWJZRGLAO-UHFFFAOYSA-N 1 1 299.374 3.547 20 5 CHBDMO Cc1ccncc1C[N@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000877491170 1125035198 /nfs/dbraw/zinc/03/51/98/1125035198.db2.gz GWFMHAWJZRGLAO-UHFFFAOYSA-N 1 1 299.374 3.547 20 5 CHBDMO C[C@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000531202531 1125200331 /nfs/dbraw/zinc/20/03/31/1125200331.db2.gz QSGLMCHWFXHFGL-KSSFIOAISA-N 1 1 296.370 3.973 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532326596 1125249241 /nfs/dbraw/zinc/24/92/41/1125249241.db2.gz LDHFUSZSSGRDEK-ZDUSSCGKSA-N 1 1 262.353 3.607 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1)C(C)(C)C ZINC000094774686 1129451608 /nfs/dbraw/zinc/45/16/08/1129451608.db2.gz XYZKWOVZBDANSF-SNVBAGLBSA-N 1 1 268.332 3.600 20 5 CHBDMO CC1=C(C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000796019424 1129463156 /nfs/dbraw/zinc/46/31/56/1129463156.db2.gz AQCAHCKYVMOOQD-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO CC1=C(C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000796019424 1129463157 /nfs/dbraw/zinc/46/31/57/1129463157.db2.gz AQCAHCKYVMOOQD-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO Cc1cccc([C@@H]2CCC[N@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001169006248 1129689398 /nfs/dbraw/zinc/68/93/98/1129689398.db2.gz GJVDZTSIKNPVIS-OIISXLGYSA-N 1 1 288.391 3.577 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011217 1129690106 /nfs/dbraw/zinc/69/01/06/1129690106.db2.gz ILVYCMZQMZDTIA-IRXDYDNUSA-N 1 1 290.407 3.590 20 5 CHBDMO C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C1CCC(C(C)(C)C)CC1 ZINC001169036359 1129690610 /nfs/dbraw/zinc/69/06/10/1129690610.db2.gz FRBHNRGECUFPBK-SLTXQBBLSA-N 1 1 296.455 3.969 20 5 CHBDMO CC[C@H](c1ccccc1)[N@@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169040123 1129690749 /nfs/dbraw/zinc/69/07/49/1129690749.db2.gz YAXHZEHYVCNEAN-FVQBIDKESA-N 1 1 276.380 3.515 20 5 CHBDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035131 1129690811 /nfs/dbraw/zinc/69/08/11/1129690811.db2.gz AJWRXJWHXMXWQL-TYNCELHUSA-N 1 1 296.798 3.778 20 5 CHBDMO Cc1ccc([C@@H]2CCC[N@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169025018 1129691395 /nfs/dbraw/zinc/69/13/95/1129691395.db2.gz ILURVVJBSNOLED-UAGQMJEPSA-N 1 1 288.391 3.577 20 5 CHBDMO CC[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001169334340 1129719014 /nfs/dbraw/zinc/71/90/14/1129719014.db2.gz XTJLEUXQTPSSMD-ZBFHGGJFSA-N 1 1 276.380 3.995 20 5 CHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)CC1CCC1 ZINC000801551662 1129926636 /nfs/dbraw/zinc/92/66/36/1129926636.db2.gz WZXMFXJBTIZHBT-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO NC(=[NH+]OCc1ccccc1[N+](=O)[O-])C1CCCCCC1 ZINC000746564415 1130066613 /nfs/dbraw/zinc/06/66/13/1130066613.db2.gz IMEXTLLJBHKWEZ-UHFFFAOYSA-N 1 1 291.351 3.564 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746657356 1130136012 /nfs/dbraw/zinc/13/60/12/1130136012.db2.gz GOUDJNJHNCVYOG-JTQLQIEISA-N 1 1 270.760 3.869 20 5 CHBDMO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC1CCCC1 ZINC000746662488 1130138040 /nfs/dbraw/zinc/13/80/40/1130138040.db2.gz AWVGQPLEROJVMG-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC(C)(C)C ZINC000746666808 1130143381 /nfs/dbraw/zinc/14/33/81/1130143381.db2.gz RASOYSIWVDLRSX-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000903341291 1130162834 /nfs/dbraw/zinc/16/28/34/1130162834.db2.gz XIOLEYCTMIPTMR-SJKOYZFVSA-N 1 1 297.358 3.792 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000781982670 1130750778 /nfs/dbraw/zinc/75/07/78/1130750778.db2.gz PQWDDMHULVXSIT-GFCCVEGCSA-N 1 1 280.343 3.602 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC000782502356 1130779779 /nfs/dbraw/zinc/77/97/79/1130779779.db2.gz FQYSQQLOPCQYIP-DIOULYMOSA-N 1 1 292.354 3.744 20 5 CHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783569075 1130839099 /nfs/dbraw/zinc/83/90/99/1130839099.db2.gz AZCDDLPPHGBXDZ-JQWIXIFHSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H](C[N@H+]1Cc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC001116823613 1131165484 /nfs/dbraw/zinc/16/54/84/1131165484.db2.gz GPSNCCRYIPTFRZ-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C/C=C\Cl)C2)cc1 ZINC000831534532 1131489400 /nfs/dbraw/zinc/48/94/00/1131489400.db2.gz PCRWKCZFSMNRGS-ZUNOPDERSA-N 1 1 280.755 3.527 20 5 CHBDMO CC1CC([N@@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172908783 1132349674 /nfs/dbraw/zinc/34/96/74/1132349674.db2.gz OEISUUWBPLMLAG-YAJUMTOWSA-N 1 1 288.391 3.573 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)CC1 ZINC001173221561 1132411639 /nfs/dbraw/zinc/41/16/39/1132411639.db2.gz KHHGTMAHLPDEOL-KGLIPLIRSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2ccccc2C1 ZINC001173226047 1132412467 /nfs/dbraw/zinc/41/24/67/1132412467.db2.gz KWCVOGBIKPLOLL-CQSZACIVSA-N 1 1 296.370 3.584 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC001173224441 1132412936 /nfs/dbraw/zinc/41/29/36/1132412936.db2.gz FVQKGZHDZZNVPK-MJBXVCDLSA-N 1 1 276.380 3.789 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@](C)(F)CC1 ZINC001173229116 1132413636 /nfs/dbraw/zinc/41/36/36/1132413636.db2.gz PZRCPOGRUSSVTJ-XJKSGUPXSA-N 1 1 294.370 3.740 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232218688 1132438851 /nfs/dbraw/zinc/43/88/51/1132438851.db2.gz JYSKWHCTAVUUQV-ZDUSSCGKSA-N 1 1 277.371 3.625 20 5 CHBDMO CC1(C[NH3+])CN(Cc2c3ccccc3cc3ccccc32)C1 ZINC001206722415 1133735151 /nfs/dbraw/zinc/73/51/51/1133735151.db2.gz AMUSGYUVRFKQTR-UHFFFAOYSA-N 1 1 290.410 3.774 20 5 CHBDMO CC(C)(F)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001207057365 1133763258 /nfs/dbraw/zinc/76/32/58/1133763258.db2.gz FQWDRKVSRKVDNQ-UHFFFAOYSA-N 1 1 295.141 3.739 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1Nc1ccc2c(c1)C[N@@H+](C)CC2 ZINC001211290416 1134404824 /nfs/dbraw/zinc/40/48/24/1134404824.db2.gz DZEPYGWYGBIAJM-UHFFFAOYSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(Nc2ccc3c(c2)C[N@@H+](C)CC3)c([N+](=O)[O-])c1 ZINC001214175803 1134517661 /nfs/dbraw/zinc/51/76/61/1134517661.db2.gz JRGITHCYYGUACQ-UHFFFAOYSA-N 1 1 297.358 3.635 20 5 CHBDMO C[C@@H]([NH2+]CC=C(Cl)Cl)c1ccc([N+](=O)[O-])cc1 ZINC000407058761 1135089762 /nfs/dbraw/zinc/08/97/62/1135089762.db2.gz MZCFBJSKEQFMIY-MRVPVSSYSA-N 1 1 275.135 3.564 20 5 CHBDMO C[C@@H]([NH2+]CC=C(Cl)Cl)c1cccc([N+](=O)[O-])c1 ZINC000407069227 1135091496 /nfs/dbraw/zinc/09/14/96/1135091496.db2.gz SHYGYYWJBZDWPB-MRVPVSSYSA-N 1 1 275.135 3.564 20 5 CHBDMO C[C@H]([NH2+]CC=C(Cl)Cl)c1ccccc1[N+](=O)[O-] ZINC000407074427 1135091746 /nfs/dbraw/zinc/09/17/46/1135091746.db2.gz VSJNXRYYWSNJNS-QMMMGPOBSA-N 1 1 275.135 3.564 20 5 CHBDMO CC(C)[N@H+]1CCC[C@@H](O[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001224024713 1135411981 /nfs/dbraw/zinc/41/19/81/1135411981.db2.gz KTKVZOWWGQXVPR-XJKSGUPXSA-N 1 1 292.379 3.545 20 5 CHBDMO CC[N@H+]1CC[C@@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001226991570 1135772135 /nfs/dbraw/zinc/77/21/35/1135772135.db2.gz BMUXKRTZSUHHLU-CQSZACIVSA-N 1 1 292.382 3.861 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525784842 262234898 /nfs/dbraw/zinc/23/48/98/262234898.db2.gz XOLCVEQWIZTOIR-CQSZACIVSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000035140403 172008430 /nfs/dbraw/zinc/00/84/30/172008430.db2.gz IKGVWSFUTIZWCN-MNOVXSKESA-N 1 1 260.293 3.600 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000346978217 226003332 /nfs/dbraw/zinc/00/33/32/226003332.db2.gz IQHMAMPRQZPNGC-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO COc1cccc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)c1 ZINC000037771518 260116378 /nfs/dbraw/zinc/11/63/78/260116378.db2.gz YJQPNTJMRPTAGM-SNVBAGLBSA-N 1 1 292.360 3.516 20 5 CHBDMO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000169130147 260918702 /nfs/dbraw/zinc/91/87/02/260918702.db2.gz GLNDZFNKWHEGNZ-HNNXBMFYSA-N 1 1 288.322 3.975 20 5 CHBDMO CC(C)[C@@H]1C[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CCS1 ZINC000464779746 261226968 /nfs/dbraw/zinc/22/69/68/261226968.db2.gz ZJZHMMDEWFFGRY-WFASDCNBSA-N 1 1 294.420 3.729 20 5 CHBDMO CCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000172020680 335088945 /nfs/dbraw/zinc/08/89/45/335088945.db2.gz SHNDKHWTPXIIMT-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CC(C)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000110789463 328319087 /nfs/dbraw/zinc/31/90/87/328319087.db2.gz RDPDQSIWXGTLEW-UHFFFAOYSA-N 1 1 276.380 3.790 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000559418269 327244602 /nfs/dbraw/zinc/24/46/02/327244602.db2.gz PQXHUHAVCRLIRI-TZMCWYRMSA-N 1 1 274.364 3.778 20 5 CHBDMO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])o1 ZINC000048068855 327277297 /nfs/dbraw/zinc/27/72/97/327277297.db2.gz FHKHCQPBJKHZBB-FZMZJTMJSA-N 1 1 286.331 3.601 20 5 CHBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000175115619 329162997 /nfs/dbraw/zinc/16/29/97/329162997.db2.gz FVCFDDZCYPKKFK-KRWDZBQOSA-N 1 1 299.374 3.661 20 5 CHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@H]1c1ccccc1 ZINC000463074644 331339534 /nfs/dbraw/zinc/33/95/34/331339534.db2.gz UANIIZGPPHEXKL-IRXDYDNUSA-N 1 1 296.370 3.830 20 5 CHBDMO CCC1(CC)C[N@@H+](Cc2ccccc2[N+](=O)[O-])CCS1 ZINC000464588293 331363389 /nfs/dbraw/zinc/36/33/89/331363389.db2.gz OKFHHZRWBZMHKN-UHFFFAOYSA-N 1 1 294.420 3.702 20 5 CHBDMO CCC[C@H]1[C@@H](C)CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000464743418 331365815 /nfs/dbraw/zinc/36/58/15/331365815.db2.gz YJGBKONLDFYXLW-ZFWWWQNUSA-N 1 1 276.380 3.995 20 5 CHBDMO CC(C)[C@H]1C[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CCS1 ZINC000464779745 331367860 /nfs/dbraw/zinc/36/78/60/331367860.db2.gz ZJZHMMDEWFFGRY-SWLSCSKDSA-N 1 1 294.420 3.729 20 5 CHBDMO CC/C=C\CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000466235019 331391372 /nfs/dbraw/zinc/39/13/72/331391372.db2.gz KKOAAYZJGFUAIW-ARJAWSKDSA-N 1 1 274.364 3.916 20 5 CHBDMO Cc1ccccc1C[C@@H](C)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000489073901 332040453 /nfs/dbraw/zinc/04/04/53/332040453.db2.gz LRLYYCIBOBXYSC-OAHLLOKOSA-N 1 1 298.386 3.966 20 5 CHBDMO C[C@@H](C1CCC1)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492174176 332385776 /nfs/dbraw/zinc/38/57/76/332385776.db2.gz AEPZBBXFRNSXGQ-JTQLQIEISA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@H]1c2ccccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000513682575 333032036 /nfs/dbraw/zinc/03/20/36/333032036.db2.gz APUVQHIPPBOCKB-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000522046691 333231558 /nfs/dbraw/zinc/23/15/58/333231558.db2.gz DWXOHDHFIUCIPT-YPMHNXCESA-N 1 1 262.353 3.524 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000523841154 333347729 /nfs/dbraw/zinc/34/77/29/333347729.db2.gz OPEJOOKXMAGDLK-SNVBAGLBSA-N 1 1 270.760 3.725 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccoc1 ZINC000539297341 333664481 /nfs/dbraw/zinc/66/44/81/333664481.db2.gz RFRRTENBJIGJHJ-QWRGUYRKSA-N 1 1 260.293 3.600 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccoc1 ZINC000539297339 333664546 /nfs/dbraw/zinc/66/45/46/333664546.db2.gz RFRRTENBJIGJHJ-GHMZBOCLSA-N 1 1 260.293 3.600 20 5 CHBDMO CC[N@@H+](CCC1CC1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000546227425 334020889 /nfs/dbraw/zinc/02/08/89/334020889.db2.gz WWDYSRBNMFDMFQ-GFCCVEGCSA-N 1 1 262.353 3.778 20 5 CHBDMO Cc1c(C[N@@H+](C)CCc2cccs2)cccc1[N+](=O)[O-] ZINC000075966657 334063409 /nfs/dbraw/zinc/06/34/09/334063409.db2.gz PVKYBXULKRUQDF-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000581100412 336008096 /nfs/dbraw/zinc/00/80/96/336008096.db2.gz MWCFWRKFDYNUJZ-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@H](c1ccccc1)[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000581100412 336008098 /nfs/dbraw/zinc/00/80/98/336008098.db2.gz MWCFWRKFDYNUJZ-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@H](c1cccc(F)c1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000194198949 336009048 /nfs/dbraw/zinc/00/90/48/336009048.db2.gz PARXDMUMHVIRID-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1cccc(F)c1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000194198949 336009049 /nfs/dbraw/zinc/00/90/49/336009049.db2.gz PARXDMUMHVIRID-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000381386862 336061059 /nfs/dbraw/zinc/06/10/59/336061059.db2.gz LVAUVDLMQIQQPN-IAQYHMDHSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1c(C[N@H+]2CCC=C(c3ccco3)C2)cccc1[N+](=O)[O-] ZINC000352550547 533843955 /nfs/dbraw/zinc/84/39/55/533843955.db2.gz OOCRRCLSZRMMPR-UHFFFAOYSA-N 1 1 298.342 3.786 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000127437515 524448612 /nfs/dbraw/zinc/44/86/12/524448612.db2.gz FBYAVEHKJRJDKX-OAHLLOKOSA-N 1 1 285.347 3.568 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000127437515 524448619 /nfs/dbraw/zinc/44/86/19/524448619.db2.gz FBYAVEHKJRJDKX-OAHLLOKOSA-N 1 1 285.347 3.568 20 5 CHBDMO CSC[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000292353683 525652660 /nfs/dbraw/zinc/65/26/60/525652660.db2.gz HONKQYYCTMDVFB-QWHCGFSZSA-N 1 1 294.420 3.731 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000125460112 525704785 /nfs/dbraw/zinc/70/47/85/525704785.db2.gz BLFULHNQTSYILY-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@@H]2c2ccncc2)cccc1[N+](=O)[O-] ZINC000125459918 525705632 /nfs/dbraw/zinc/70/56/32/525705632.db2.gz BLFULHNQTSYILY-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289647972 526107440 /nfs/dbraw/zinc/10/74/40/526107440.db2.gz DPNWYLLAMMMXHU-QWRGUYRKSA-N 1 1 284.306 3.633 20 5 CHBDMO C[C@@H]([NH2+]Cc1scnc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000713482107 1131964490 /nfs/dbraw/zinc/96/44/90/1131964490.db2.gz XNDUOPNCJKNERL-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000885962919 1125631761 /nfs/dbraw/zinc/63/17/61/1125631761.db2.gz IPZUBCPQVJVRQM-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO C[C@]1(C2CCCCC2)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886312164 1125669142 /nfs/dbraw/zinc/66/91/42/1125669142.db2.gz VIPAVMSPVARUGN-MRXNPFEDSA-N 1 1 289.379 3.535 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCc1ccccc1)C2 ZINC000533801095 1125784478 /nfs/dbraw/zinc/78/44/78/1125784478.db2.gz RDAPYTFTWDJHME-UHFFFAOYSA-N 1 1 296.370 3.586 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccncc1F)c1ccc([N+](=O)[O-])cc1 ZINC000338015396 1126710944 /nfs/dbraw/zinc/71/09/44/1126710944.db2.gz SAMVRRDXEHPAQN-QWRGUYRKSA-N 1 1 289.310 3.541 20 5 CHBDMO C[C@@H]1CCCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000482314367 1126750816 /nfs/dbraw/zinc/75/08/16/1126750816.db2.gz WIIWIRSVNUCTJB-DEBLGDTFSA-N 1 1 274.364 3.730 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000485733616 1126948579 /nfs/dbraw/zinc/94/85/79/1126948579.db2.gz BMBCJBQFKPEEOI-OCCSQVGLSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)C2CC2)cc1 ZINC000043643050 1127005397 /nfs/dbraw/zinc/00/53/97/1127005397.db2.gz ZHENJUSDTBBNRF-UHFFFAOYSA-N 1 1 282.343 3.759 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1 ZINC000487235835 1127026856 /nfs/dbraw/zinc/02/68/56/1127026856.db2.gz UYCMCJMQXOEEIX-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000487291787 1127030791 /nfs/dbraw/zinc/03/07/91/1127030791.db2.gz RZMRUPQBBCPLQX-VXGBXAGGSA-N 1 1 250.342 3.634 20 5 CHBDMO Cc1ccncc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000269539815 1127041554 /nfs/dbraw/zinc/04/15/54/1127041554.db2.gz AJVGATXVKMVGDC-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cncs1 ZINC000271516714 1127088620 /nfs/dbraw/zinc/08/86/20/1127088620.db2.gz PRNSEWFNGSUZOO-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO Cc1ccc(C[N@H+](Cc2ccco2)C(C)C)cc1[N+](=O)[O-] ZINC000349840164 1127164851 /nfs/dbraw/zinc/16/48/51/1127164851.db2.gz OZCFWLGKCNMPBG-UHFFFAOYSA-N 1 1 288.347 3.907 20 5 CHBDMO Cc1sccc1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000351568803 1127194258 /nfs/dbraw/zinc/19/42/58/1127194258.db2.gz PIWCWZZNBFPFDJ-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1sccc1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000351568803 1127194259 /nfs/dbraw/zinc/19/42/59/1127194259.db2.gz PIWCWZZNBFPFDJ-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO CC/C=C/CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000466813193 1127269388 /nfs/dbraw/zinc/26/93/88/1127269388.db2.gz OXZMPPLQIZKADO-ONEGZZNKSA-N 1 1 274.364 3.916 20 5 CHBDMO Cc1ccc(C[N@H+]2CCCC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000355216007 1127326179 /nfs/dbraw/zinc/32/61/79/1127326179.db2.gz IQZPKXUUGSHHFB-UHFFFAOYSA-N 1 1 274.364 3.669 20 5 CHBDMO CC[N@@H+](CCc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000058506493 1127355841 /nfs/dbraw/zinc/35/58/41/1127355841.db2.gz QXRSERJIDYWTGQ-UHFFFAOYSA-N 1 1 284.359 3.659 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC23CCCC3)ccc1[N+](=O)[O-] ZINC000593037887 1127369341 /nfs/dbraw/zinc/36/93/41/1127369341.db2.gz DJVZIFVETOOUGB-UHFFFAOYSA-N 1 1 290.363 3.512 20 5 CHBDMO CC1(CC(F)F)C[NH+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000592523370 1127395417 /nfs/dbraw/zinc/39/54/17/1127395417.db2.gz LFGKWVQRYFWMCO-XQRVVYSFSA-N 1 1 296.317 3.585 20 5 CHBDMO C[N@@H+](CCCc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000046784017 1127459943 /nfs/dbraw/zinc/45/99/43/1127459943.db2.gz DMZPOOURZHNJLY-UHFFFAOYSA-N 1 1 284.359 3.659 20 5 CHBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000229394863 1127679839 /nfs/dbraw/zinc/67/98/39/1127679839.db2.gz GIAQQCOBQCJSQC-GRYCIOLGSA-N 1 1 280.343 3.600 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccsc1[N+](=O)[O-] ZINC000604433515 1127705895 /nfs/dbraw/zinc/70/58/95/1127705895.db2.gz SWXRDDQBUULGPO-GFCCVEGCSA-N 1 1 297.424 3.723 20 5 CHBDMO Cc1ccc(C[N@@H+](C)C[C@@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000544368200 1127970658 /nfs/dbraw/zinc/97/06/58/1127970658.db2.gz IZOFTHMRDMUWNE-CQSZACIVSA-N 1 1 274.364 3.691 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1C(C)C ZINC000544603739 1127978013 /nfs/dbraw/zinc/97/80/13/1127978013.db2.gz DCGSPJJOCHFKTB-HNNXBMFYSA-N 1 1 262.353 3.524 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC)CCC1CC1 ZINC000545559142 1128021301 /nfs/dbraw/zinc/02/13/01/1128021301.db2.gz AXODQFABNYFILJ-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO CC[C@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000541773664 1128038235 /nfs/dbraw/zinc/03/82/35/1128038235.db2.gz HSMJCVFDTBCAFY-OAHLLOKOSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@H]2CCCC[C@H]12 ZINC000542040500 1128049006 /nfs/dbraw/zinc/04/90/06/1128049006.db2.gz LCIRLVLNHXGBGD-RTXFEEFZSA-N 1 1 280.393 3.667 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H](C)C(C)C ZINC000470169061 1128064321 /nfs/dbraw/zinc/06/43/21/1128064321.db2.gz BCJHJOKMTWWYTF-SSUFTNFISA-N 1 1 276.380 3.974 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)C[C@H]1C ZINC000470178877 1128064651 /nfs/dbraw/zinc/06/46/51/1128064651.db2.gz PDVKLXBYYFDULY-ZMCCTTKHSA-N 1 1 274.364 3.728 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)C1CCCC1 ZINC000470176211 1128064778 /nfs/dbraw/zinc/06/47/78/1128064778.db2.gz JHOLCZZHTBWPNP-RAXLEYEMSA-N 1 1 274.364 3.873 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C)[C@H]1C ZINC000470180544 1128065347 /nfs/dbraw/zinc/06/53/47/1128065347.db2.gz OQZOPUGEGPPXTC-UYEGUDHTSA-N 1 1 274.364 3.728 20 5 CHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000471022909 1128085456 /nfs/dbraw/zinc/08/54/56/1128085456.db2.gz QRSIAWROHQMFIE-KSSFIOAISA-N 1 1 296.370 3.830 20 5 CHBDMO CCc1ccc[nH+]c1NCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000777499361 1128094542 /nfs/dbraw/zinc/09/45/42/1128094542.db2.gz DITIMTBXJCDOPQ-UHFFFAOYSA-N 1 1 291.738 3.818 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761507757 1128131962 /nfs/dbraw/zinc/13/19/62/1128131962.db2.gz VXKFNMQSBFABNS-SNVBAGLBSA-N 1 1 270.760 3.725 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCCC2(CC2)C1 ZINC000494671712 1128185189 /nfs/dbraw/zinc/18/51/89/1128185189.db2.gz WPTPYBPAMTWQGQ-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCC2(CC2)C1 ZINC000494671712 1128185190 /nfs/dbraw/zinc/18/51/90/1128185190.db2.gz WPTPYBPAMTWQGQ-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO Cc1ccc(NCc2ccc([N+](=O)[O-])cc2Cl)[nH+]c1 ZINC000784530514 1128256386 /nfs/dbraw/zinc/25/63/86/1128256386.db2.gz YPGGTHHFJJFQFB-UHFFFAOYSA-N 1 1 277.711 3.564 20 5 CHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])cc1 ZINC000301090964 1128332948 /nfs/dbraw/zinc/33/29/48/1128332948.db2.gz KPZCUVJPVRVVRZ-AWEZNQCLSA-N 1 1 291.395 3.661 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1cncs1 ZINC000934196125 1128454593 /nfs/dbraw/zinc/45/45/93/1128454593.db2.gz NSTQMSFUEUVCMO-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO Cc1c(C[N@H+](C)[C@@H]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000917096888 1128480987 /nfs/dbraw/zinc/48/09/87/1128480987.db2.gz HKIPXWYTNBDCGR-SWLSCSKDSA-N 1 1 276.380 3.914 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC3(CCC3)C2)ccc1Cl ZINC000154313193 1128490915 /nfs/dbraw/zinc/49/09/15/1128490915.db2.gz JPBBXEZGLYEAEV-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000556958663 1128651844 /nfs/dbraw/zinc/65/18/44/1128651844.db2.gz JZJFWKVQMFEKTO-QTLSWZBMSA-N 1 1 286.375 3.730 20 5 CHBDMO CC(C)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350011 1128713970 /nfs/dbraw/zinc/71/39/70/1128713970.db2.gz XZNAQXRKXGMLMD-UHFFFAOYSA-N 1 1 264.369 3.851 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705380 1128723071 /nfs/dbraw/zinc/72/30/71/1128723071.db2.gz XTALTLVWLRGYFA-LLVKDONJSA-N 1 1 282.771 3.870 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H]1C1CC1 ZINC000609705066 1128723242 /nfs/dbraw/zinc/72/32/42/1128723242.db2.gz MOXUZTWYHLEEOT-ZDUSSCGKSA-N 1 1 280.755 3.623 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000609766760 1128724605 /nfs/dbraw/zinc/72/46/05/1128724605.db2.gz OGRRFVRODVCYKG-CQSZACIVSA-N 1 1 276.380 3.915 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccc(F)cc1 ZINC000072556271 1117762650 /nfs/dbraw/zinc/76/26/50/1117762650.db2.gz OUTBSGZVTZNTCF-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccc(F)cc1 ZINC000072556271 1117762653 /nfs/dbraw/zinc/76/26/53/1117762653.db2.gz OUTBSGZVTZNTCF-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000430193998 1117840410 /nfs/dbraw/zinc/84/04/10/1117840410.db2.gz HSARYLYYBFSMDN-GXTWGEPZSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610215372 1117881839 /nfs/dbraw/zinc/88/18/39/1117881839.db2.gz JETLCCMMILJNBH-QWHCGFSZSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1cc(NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000510096001 1117882299 /nfs/dbraw/zinc/88/22/99/1117882299.db2.gz VQUJWRPEDIFWKW-UONOGXRCSA-N 1 1 291.395 3.578 20 5 CHBDMO COc1cc(C[N@@H+](CC2CCC2)C(C)C)ccc1[N+](=O)[O-] ZINC000444776569 1117930355 /nfs/dbraw/zinc/93/03/55/1117930355.db2.gz MEPLSSQCVZBSED-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1ccc(CNc2cc[nH+]c3ccsc32)cc1 ZINC000301360304 1118196881 /nfs/dbraw/zinc/19/68/81/1118196881.db2.gz LSDQNFYALBWATR-UHFFFAOYSA-N 1 1 285.328 3.817 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000610369520 1118362105 /nfs/dbraw/zinc/36/21/05/1118362105.db2.gz KUFNWEVDXSFLNZ-CHWSQXEVSA-N 1 1 286.331 3.738 20 5 CHBDMO Cc1c(C[N@H+]2CC[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000477222125 1118655786 /nfs/dbraw/zinc/65/57/86/1118655786.db2.gz MKTMLIHRTNBVQB-KRWDZBQOSA-N 1 1 296.370 3.893 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC1CC1)C(C)C ZINC000535786477 1118886451 /nfs/dbraw/zinc/88/64/51/1118886451.db2.gz CSFDJUVFPSMSPV-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CCC1 ZINC000127456148 1119055951 /nfs/dbraw/zinc/05/59/51/1119055951.db2.gz IEOHCZKDZNLFPW-UHFFFAOYSA-N 1 1 286.331 3.839 20 5 CHBDMO C[C@@H](C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511105280 1119062611 /nfs/dbraw/zinc/06/26/11/1119062611.db2.gz IPWOJOIHKJRQOX-HNNXBMFYSA-N 1 1 298.386 3.873 20 5 CHBDMO CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000052873204 1119486235 /nfs/dbraw/zinc/48/62/35/1119486235.db2.gz RVHKJJGTMCQIGO-UHFFFAOYSA-N 1 1 262.353 3.749 20 5 CHBDMO CC[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000341204777 1120245492 /nfs/dbraw/zinc/24/54/92/1120245492.db2.gz FTOQKFUHSBIPJH-HNNXBMFYSA-N 1 1 288.322 3.975 20 5 CHBDMO Cc1ccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])o1 ZINC000255325030 1120352371 /nfs/dbraw/zinc/35/23/71/1120352371.db2.gz XQMWEIIHRAMQAW-ALCCZGGFSA-N 1 1 286.331 3.641 20 5 CHBDMO Cc1c(C[NH2+]Cc2cscc2Cl)cccc1[N+](=O)[O-] ZINC000616483545 1120389915 /nfs/dbraw/zinc/38/99/15/1120389915.db2.gz GEWVDULIHDWGOT-UHFFFAOYSA-N 1 1 296.779 3.908 20 5 CHBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2sccc2[N+](=O)[O-])C1 ZINC000301994866 1120528274 /nfs/dbraw/zinc/52/82/74/1120528274.db2.gz PAJNPQNZDPYOMI-LLVKDONJSA-N 1 1 297.424 3.579 20 5 CHBDMO CSc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000922537198 1120548238 /nfs/dbraw/zinc/54/82/38/1120548238.db2.gz ASMAMQTZEDZFPY-SNVBAGLBSA-N 1 1 292.360 3.761 20 5 CHBDMO Cc1cc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)c(C)o1 ZINC000044729996 1120730871 /nfs/dbraw/zinc/73/08/71/1120730871.db2.gz WZGGWKNKAYVBEY-VIFPVBQESA-N 1 1 280.349 3.717 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2)cs1 ZINC000048609558 1120835242 /nfs/dbraw/zinc/83/52/42/1120835242.db2.gz ABQXHZOESHOWQT-CQSZACIVSA-N 1 1 288.372 3.993 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2c2ccccc2)cs1 ZINC000048609558 1120835245 /nfs/dbraw/zinc/83/52/45/1120835245.db2.gz ABQXHZOESHOWQT-CQSZACIVSA-N 1 1 288.372 3.993 20 5 CHBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000038880779 1121132875 /nfs/dbraw/zinc/13/28/75/1121132875.db2.gz RQSUTDPWEMFQFD-UHFFFAOYSA-N 1 1 299.374 3.529 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCC(F)(F)F ZINC000342682353 1121147892 /nfs/dbraw/zinc/14/78/92/1121147892.db2.gz WYZBRSQWYXUDDM-VIFPVBQESA-N 1 1 276.258 3.540 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCC(F)(F)F ZINC000342682353 1121147894 /nfs/dbraw/zinc/14/78/94/1121147894.db2.gz WYZBRSQWYXUDDM-VIFPVBQESA-N 1 1 276.258 3.540 20 5 CHBDMO Cc1c(C[N@@H+]2CCCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000512203218 1121197982 /nfs/dbraw/zinc/19/79/82/1121197982.db2.gz PFGWYKPZFZOQFS-LBPRGKRZSA-N 1 1 262.353 3.668 20 5 CHBDMO CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCC1 ZINC000706761981 1121439505 /nfs/dbraw/zinc/43/95/05/1121439505.db2.gz LLBOWXACIQSLLN-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000408428001 1121457735 /nfs/dbraw/zinc/45/77/35/1121457735.db2.gz BATFAYUFYWKFDM-LBPRGKRZSA-N 1 1 292.379 3.545 20 5 CHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccsc1 ZINC000120456216 1121531748 /nfs/dbraw/zinc/53/17/48/1121531748.db2.gz VTFPOTMVDXNZCL-GQCTYLIASA-N 1 1 288.372 3.802 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]2CCC[C@@H]21 ZINC000543631497 1121539186 /nfs/dbraw/zinc/53/91/86/1121539186.db2.gz NNLZYKUZOCVZCK-CJNGLKHVSA-N 1 1 274.364 3.668 20 5 CHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC=CCC3)o2)c1 ZINC000611521154 1121653942 /nfs/dbraw/zinc/65/39/42/1121653942.db2.gz ITLJLSLFFRRCMM-UHFFFAOYSA-N 1 1 284.315 3.617 20 5 CHBDMO C[N@@H+](CCCCNc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000413349434 1122014982 /nfs/dbraw/zinc/01/49/82/1122014982.db2.gz RSGWLOKNKJQVJU-UHFFFAOYSA-N 1 1 297.786 3.535 20 5 CHBDMO C[C@H]1c2ccsc2CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000016420706 1122120583 /nfs/dbraw/zinc/12/05/83/1122120583.db2.gz FJJPZLHARLDDPE-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000016420706 1122120586 /nfs/dbraw/zinc/12/05/86/1122120586.db2.gz FJJPZLHARLDDPE-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000035010718 1122148066 /nfs/dbraw/zinc/14/80/66/1122148066.db2.gz XXVDLISQOXCOFE-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505307359 1122356569 /nfs/dbraw/zinc/35/65/69/1122356569.db2.gz DSTJLOULXXIYCO-AWEZNQCLSA-N 1 1 262.353 3.668 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCSC(C)(C)CC1 ZINC000434715201 1122396392 /nfs/dbraw/zinc/39/63/92/1122396392.db2.gz WWKIYCKGSZOSQM-GFCCVEGCSA-N 1 1 294.420 3.873 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCSC(C)(C)CC1 ZINC000434715202 1122396427 /nfs/dbraw/zinc/39/64/27/1122396427.db2.gz WWKIYCKGSZOSQM-LBPRGKRZSA-N 1 1 294.420 3.873 20 5 CHBDMO CC(C)[C@@H]1[N@H+](Cc2csc([N+](=O)[O-])c2)CC12CCC2 ZINC000430100335 1122404227 /nfs/dbraw/zinc/40/42/27/1122404227.db2.gz AWQANZUUCBJCDB-ZDUSSCGKSA-N 1 1 280.393 3.667 20 5 CHBDMO CC(C)[C@@H]1[N@@H+](Cc2csc([N+](=O)[O-])c2)CC12CCC2 ZINC000430100335 1122404229 /nfs/dbraw/zinc/40/42/29/1122404229.db2.gz AWQANZUUCBJCDB-ZDUSSCGKSA-N 1 1 280.393 3.667 20 5 CHBDMO CC(C)[C@@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC12CCC2 ZINC000430101273 1122404406 /nfs/dbraw/zinc/40/44/06/1122404406.db2.gz NHMRFANLSXVVCP-HNNXBMFYSA-N 1 1 274.364 3.605 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000505607849 1122434741 /nfs/dbraw/zinc/43/47/41/1122434741.db2.gz KNYHQQGIUWACKG-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505629600 1122442658 /nfs/dbraw/zinc/44/26/58/1122442658.db2.gz BGZQURSKWCLZKL-FZMZJTMJSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1ccc(Cn2c[nH+]c3c2C[C@@H](C)[C@@H](C)C3)cc1[N+](=O)[O-] ZINC001189416763 1122500871 /nfs/dbraw/zinc/50/08/71/1122500871.db2.gz ZWKVKVLFIJMEBF-QWHCGFSZSA-N 1 1 299.374 3.519 20 5 CHBDMO Cc1ccc(Cn2c[nH+]c3c2C[C@H](C)[C@@H](C)C3)cc1[N+](=O)[O-] ZINC001189416764 1122501191 /nfs/dbraw/zinc/50/11/91/1122501191.db2.gz ZWKVKVLFIJMEBF-STQMWFEESA-N 1 1 299.374 3.519 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000516558723 1122611674 /nfs/dbraw/zinc/61/16/74/1122611674.db2.gz DGGZWXNVNYJHMI-NEPJUHHUSA-N 1 1 298.333 3.941 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@@H]1C ZINC001193413277 1122690702 /nfs/dbraw/zinc/69/07/02/1122690702.db2.gz MJIUBKZDGMADSN-XJKSGUPXSA-N 1 1 276.380 3.995 20 5 CHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000506220219 1122697926 /nfs/dbraw/zinc/69/79/26/1122697926.db2.gz VAEDHLRDBZZDCI-TZMCWYRMSA-N 1 1 262.353 3.605 20 5 CHBDMO CC(C)C[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000506477987 1122750417 /nfs/dbraw/zinc/75/04/17/1122750417.db2.gz RJCMSWAKBKMGRC-UHFFFAOYSA-N 1 1 288.347 3.943 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1cccc([N+](=O)[O-])c1C ZINC001194782936 1122799045 /nfs/dbraw/zinc/79/90/45/1122799045.db2.gz YJPQOPFZCRKAGS-UHFFFAOYSA-N 1 1 264.369 3.914 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000015301337 1122800753 /nfs/dbraw/zinc/80/07/53/1122800753.db2.gz PNJTZRKGMVUFIE-CQSZACIVSA-N 1 1 288.372 3.993 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H]1CC1(C)C ZINC000426569505 1122823959 /nfs/dbraw/zinc/82/39/59/1122823959.db2.gz AVTREXFKFFIJSA-INDWDQIESA-N 1 1 274.364 3.728 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](C3CCC3)C2)cc1 ZINC001196255109 1122912918 /nfs/dbraw/zinc/91/29/18/1122912918.db2.gz QWIHQBHYQFEXCW-MRXNPFEDSA-N 1 1 288.391 3.649 20 5 CHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1C[C@H]1c1ccccc1 ZINC000507162061 1122932868 /nfs/dbraw/zinc/93/28/68/1122932868.db2.gz UANIIZGPPHEXKL-SJORKVTESA-N 1 1 296.370 3.830 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507227179 1122941368 /nfs/dbraw/zinc/94/13/68/1122941368.db2.gz DNXCDEOHKKKZBO-BUUCAEBMSA-N 1 1 262.353 3.584 20 5 CHBDMO C[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037403699 1122960038 /nfs/dbraw/zinc/96/00/38/1122960038.db2.gz MDCNSXKNECJEFX-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037403699 1122960039 /nfs/dbraw/zinc/96/00/39/1122960039.db2.gz MDCNSXKNECJEFX-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H](c1ccncc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183715020 1129089814 /nfs/dbraw/zinc/08/98/14/1129089814.db2.gz OZYXHTYTCBKHLD-DYLGSBMWSA-N 1 1 297.358 3.696 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC000507672310 1122982979 /nfs/dbraw/zinc/98/29/79/1122982979.db2.gz JZCWEZKCBMAHOO-QGZVFWFLSA-N 1 1 296.370 3.659 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCC2(CCC2)C1 ZINC000475269058 1123832493 /nfs/dbraw/zinc/83/24/93/1123832493.db2.gz JYBVTSWXMWRCSL-XVNBXDOJSA-N 1 1 286.375 3.874 20 5 CHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC1CCC1 ZINC000475581807 1124019294 /nfs/dbraw/zinc/01/92/94/1124019294.db2.gz HLEKZYXGMJTWOA-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO CC(C)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC1CCC1 ZINC000444776522 1124064444 /nfs/dbraw/zinc/06/44/44/1124064444.db2.gz LOMOQSNMLWHOKL-UHFFFAOYSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000525637134 1124451144 /nfs/dbraw/zinc/45/11/44/1124451144.db2.gz ZVKMQFGYLFLHPB-CHWSQXEVSA-N 1 1 262.353 3.605 20 5 CHBDMO CCC(C)(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000441234800 1124461751 /nfs/dbraw/zinc/46/17/51/1124461751.db2.gz RERZBYOJIIYAQO-UHFFFAOYSA-N 1 1 264.369 3.853 20 5 CHBDMO Cc1cc(C)c(CNc2ccc(F)c([N+](=O)[O-])c2)c(C)[nH+]1 ZINC000871803814 1124639150 /nfs/dbraw/zinc/63/91/50/1124639150.db2.gz UDSRBRGULXSIBG-UHFFFAOYSA-N 1 1 289.310 3.666 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CC(C)(C)C ZINC000532550727 1125410904 /nfs/dbraw/zinc/41/09/04/1125410904.db2.gz AQEISARNYOVATF-NSHDSACASA-N 1 1 250.342 3.634 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CC1CCC1 ZINC000348245762 1125429312 /nfs/dbraw/zinc/42/93/12/1125429312.db2.gz QMTIXQAVWJNWQB-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@H]1c2ccccc2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000139501759 1129202779 /nfs/dbraw/zinc/20/27/79/1129202779.db2.gz XQKISUJOPZCWJJ-AWEZNQCLSA-N 1 1 296.370 3.757 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000735311476 1129340633 /nfs/dbraw/zinc/34/06/33/1129340633.db2.gz QRPQBFYANHBHJQ-GFCCVEGCSA-N 1 1 280.343 3.746 20 5 CHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094774537 1129451728 /nfs/dbraw/zinc/45/17/28/1129451728.db2.gz JTDHEEBWYRQVLH-AAEUAGOBSA-N 1 1 280.343 3.744 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303585911 1129547681 /nfs/dbraw/zinc/54/76/81/1129547681.db2.gz QKEONIOIVOHQCG-QGZVFWFLSA-N 1 1 286.375 3.917 20 5 CHBDMO C[C@H](c1ccccc1Cl)[N@@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169049591 1129692134 /nfs/dbraw/zinc/69/21/34/1129692134.db2.gz WQKLLLDQLUOGOR-FRRDWIJNSA-N 1 1 296.798 3.778 20 5 CHBDMO C[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC001169090986 1129699857 /nfs/dbraw/zinc/69/98/57/1129699857.db2.gz KMUWVQVTKNEMIC-CYBMUJFWSA-N 1 1 276.380 3.505 20 5 CHBDMO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC001169242949 1129712366 /nfs/dbraw/zinc/71/23/66/1129712366.db2.gz DZURMRYUJCDVAW-KAMYIIQDSA-N 1 1 297.358 3.525 20 5 CHBDMO C/C(=C/c1ccccc1)C[N@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC001169242949 1129712369 /nfs/dbraw/zinc/71/23/69/1129712369.db2.gz DZURMRYUJCDVAW-KAMYIIQDSA-N 1 1 297.358 3.525 20 5 CHBDMO C[C@@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC001169665666 1129745048 /nfs/dbraw/zinc/74/50/48/1129745048.db2.gz DIVJUTRPXNDKDJ-ZDUSSCGKSA-N 1 1 278.396 3.751 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccc(F)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000903288595 1130146500 /nfs/dbraw/zinc/14/65/00/1130146500.db2.gz ZYIUHVNBBXQEBX-GHMZBOCLSA-N 1 1 289.310 3.541 20 5 CHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748807351 1130248419 /nfs/dbraw/zinc/24/84/19/1130248419.db2.gz MWRQJDQOPRDQOB-CQSZACIVSA-N 1 1 280.343 3.744 20 5 CHBDMO CC(C)c1ccc(C[NH+]2CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000793359365 1130545144 /nfs/dbraw/zinc/54/51/44/1130545144.db2.gz KIYCKQCKMNOUBM-UHFFFAOYSA-N 1 1 298.333 3.949 20 5 CHBDMO C[C@H]([NH3+])CN(C)Cc1c2ccccc2cc2ccccc21 ZINC001235963174 1130818440 /nfs/dbraw/zinc/81/84/40/1130818440.db2.gz QBGMJIFJCVTXTO-AWEZNQCLSA-N 1 1 278.399 3.772 20 5 CHBDMO C[C@H](N)C[N@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC001235963174 1130818447 /nfs/dbraw/zinc/81/84/47/1130818447.db2.gz QBGMJIFJCVTXTO-AWEZNQCLSA-N 1 1 278.399 3.772 20 5 CHBDMO C[C@H](N)C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC001235963174 1130818456 /nfs/dbraw/zinc/81/84/56/1130818456.db2.gz QBGMJIFJCVTXTO-AWEZNQCLSA-N 1 1 278.399 3.772 20 5 CHBDMO NC[C@H]1CCC[N@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001236247704 1130904260 /nfs/dbraw/zinc/90/42/60/1130904260.db2.gz XEVRJOUZPPGXAT-QGZVFWFLSA-N 1 1 290.410 3.916 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000816646319 1131117481 /nfs/dbraw/zinc/11/74/81/1131117481.db2.gz BTWORNNSSHVNIU-RYUDHWBXSA-N 1 1 286.331 3.695 20 5 CHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001171087125 1131510697 /nfs/dbraw/zinc/51/06/97/1131510697.db2.gz LKNJDBMHDQRJAT-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC23CCCC3)cc1Cl ZINC000845998975 1131677085 /nfs/dbraw/zinc/67/70/85/1131677085.db2.gz FWKLLIIKYNLQQY-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccns1 ZINC000715957023 1131998631 /nfs/dbraw/zinc/99/86/31/1131998631.db2.gz ZIIZZEFALDQPIE-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCO[C@H]2C[C@H]21 ZINC001141728141 1132242129 /nfs/dbraw/zinc/24/21/29/1132242129.db2.gz NHASEEKMGNJMMH-UXHICEINSA-N 1 1 289.378 3.966 20 5 CHBDMO CC1(C)CCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172904952 1132346985 /nfs/dbraw/zinc/34/69/85/1132346985.db2.gz BNJQLJKHROIINF-OAHLLOKOSA-N 1 1 288.391 3.717 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1[C@H](C)CCC[C@@H]1C ZINC001173224438 1132412868 /nfs/dbraw/zinc/41/28/68/1132412868.db2.gz FVQKGZHDZZNVPK-HZSPNIEDSA-N 1 1 276.380 3.789 20 5 CHBDMO CC(C)[N@@H+](CC1CC1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173228472 1132412978 /nfs/dbraw/zinc/41/29/78/1132412978.db2.gz XIQKDAIRTKLURD-CYBMUJFWSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC2(CCC2)C1 ZINC001173230195 1132413908 /nfs/dbraw/zinc/41/39/08/1132413908.db2.gz COQVRXXHZHMBSC-AWEZNQCLSA-N 1 1 288.391 3.792 20 5 CHBDMO CC(C)[C@@H]1CCC[N@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230994 1132414213 /nfs/dbraw/zinc/41/42/13/1132414213.db2.gz IBGJWAJHBUDISM-BBRMVZONSA-N 1 1 276.380 3.646 20 5 CHBDMO Cc1cc(NC(=[NH2+])C(C)(C)C)nc2ccc([N+](=O)[O-])cc12 ZINC001155181537 1132646938 /nfs/dbraw/zinc/64/69/38/1132646938.db2.gz SZSARGSSQSDILE-UHFFFAOYSA-N 1 1 286.335 3.887 20 5 CHBDMO Cc1ccc2[nH]c(NCc3ccc(C)c([N+](=O)[O-])c3)[nH+]c2c1 ZINC001203478817 1133332292 /nfs/dbraw/zinc/33/22/92/1133332292.db2.gz JPSXRTDJTDODOL-UHFFFAOYSA-N 1 1 296.330 3.700 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000342077864 535021484 /nfs/dbraw/zinc/02/14/84/535021484.db2.gz SWJHHLMFDNFNJH-BETUJISGSA-N 1 1 292.379 3.755 20 5 CHBDMO Cc1cccc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000352784891 227221296 /nfs/dbraw/zinc/22/12/96/227221296.db2.gz SDPDIRWRRCJNIN-AWEZNQCLSA-N 1 1 299.374 3.800 20 5 CHBDMO Cc1cccc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000352784891 227221299 /nfs/dbraw/zinc/22/12/99/227221299.db2.gz SDPDIRWRRCJNIN-AWEZNQCLSA-N 1 1 299.374 3.800 20 5 CHBDMO Cc1csc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000080310599 260179648 /nfs/dbraw/zinc/17/96/48/260179648.db2.gz LBXGHHJESGVJNG-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO CC(C)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000313600214 260303632 /nfs/dbraw/zinc/30/36/32/260303632.db2.gz AYNNAUHUQFUHTE-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000534349895 328047616 /nfs/dbraw/zinc/04/76/16/328047616.db2.gz TYRYPIPPVLYICI-GFCCVEGCSA-N 1 1 264.369 3.770 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C/C=C/c1ccccc1)C2 ZINC000534511746 328304939 /nfs/dbraw/zinc/30/49/39/328304939.db2.gz KMDIQVROMDTSJS-VMPITWQZSA-N 1 1 294.354 3.666 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C/C=C/c1ccccc1)C2 ZINC000534511746 328304940 /nfs/dbraw/zinc/30/49/40/328304940.db2.gz KMDIQVROMDTSJS-VMPITWQZSA-N 1 1 294.354 3.666 20 5 CHBDMO C[C@@H](C1CC1)[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000255713865 327007011 /nfs/dbraw/zinc/00/70/11/327007011.db2.gz PCIALLMDNUDLTL-AGLBCWCQSA-N 1 1 286.375 3.871 20 5 CHBDMO CCc1cccnc1[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000507520977 332812153 /nfs/dbraw/zinc/81/21/53/332812153.db2.gz UVAXBLAKOPLPIJ-STQMWFEESA-N 1 1 299.374 3.964 20 5 CHBDMO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CO2 ZINC000130747861 329627641 /nfs/dbraw/zinc/62/76/41/329627641.db2.gz QENKVXICCJCTAM-WBMJQRKESA-N 1 1 298.342 3.688 20 5 CHBDMO COc1cc(C[N@@H+](CC(C)C)C(C)C)c([N+](=O)[O-])cc1F ZINC000463480676 331348377 /nfs/dbraw/zinc/34/83/77/331348377.db2.gz HQPUBUACQBDGEG-UHFFFAOYSA-N 1 1 298.358 3.609 20 5 CHBDMO CC(C)[C@@H]1C[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CCS1 ZINC000464774709 331367426 /nfs/dbraw/zinc/36/74/26/331367426.db2.gz PZZIPVWKMKMHTI-DOMZBBRYSA-N 1 1 294.420 3.729 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CC(C)C ZINC000489101408 332041594 /nfs/dbraw/zinc/04/15/94/332041594.db2.gz HBMUWTPYLQEDCI-GFCCVEGCSA-N 1 1 250.342 3.552 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCC(F)(F)F ZINC000489135641 332042240 /nfs/dbraw/zinc/04/22/40/332042240.db2.gz HNXIATWHSNMTJB-SNVBAGLBSA-N 1 1 290.285 3.848 20 5 CHBDMO COc1cc(C[N@H+]2C[C@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000490029443 332077237 /nfs/dbraw/zinc/07/72/37/332077237.db2.gz KIMCXNCUPXRCHA-OLZOCXBDSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C)[C@@H]1C ZINC000490067157 332079823 /nfs/dbraw/zinc/07/98/23/332079823.db2.gz MGHMCNSXHMFOMY-DRZSPHRISA-N 1 1 262.353 3.695 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CC2CCCC2)C2CC2)cc1 ZINC000490823354 332118030 /nfs/dbraw/zinc/11/80/30/332118030.db2.gz FNBZEIFMMZMENB-UHFFFAOYSA-N 1 1 274.364 3.749 20 5 CHBDMO C[C@H](C1CCC1)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492174177 332385753 /nfs/dbraw/zinc/38/57/53/332385753.db2.gz AEPZBBXFRNSXGQ-SNVBAGLBSA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000513430411 333018703 /nfs/dbraw/zinc/01/87/03/333018703.db2.gz RJLPRQWFAIXIGX-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2c2ccccc2)cc1 ZINC000522269144 333277200 /nfs/dbraw/zinc/27/72/00/333277200.db2.gz DOOYNEHBLFJBHS-SFHVURJKSA-N 1 1 296.370 3.974 20 5 CHBDMO C[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522536293 333289312 /nfs/dbraw/zinc/28/93/12/333289312.db2.gz HJIXMRUAVDRPNI-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522536293 333289314 /nfs/dbraw/zinc/28/93/14/333289314.db2.gz HJIXMRUAVDRPNI-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000523610477 333333961 /nfs/dbraw/zinc/33/39/61/333333961.db2.gz WUIUUCUBMQNNLT-CYBMUJFWSA-N 1 1 294.395 3.860 20 5 CHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000303671711 333345317 /nfs/dbraw/zinc/34/53/17/333345317.db2.gz JVYIHFPOAMEJKP-OAHLLOKOSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000134910307 334108129 /nfs/dbraw/zinc/10/81/29/334108129.db2.gz HWMKHCPGNVJAAM-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO CCC(C)(C)[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548099642 334139931 /nfs/dbraw/zinc/13/99/31/334139931.db2.gz QZQBCZWMOWDUFI-UHFFFAOYSA-N 1 1 270.760 3.869 20 5 CHBDMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CCC1CCCC1 ZINC000549171127 334186976 /nfs/dbraw/zinc/18/69/76/334186976.db2.gz NDUYLCJBLKKPBB-UHFFFAOYSA-N 1 1 276.380 3.649 20 5 CHBDMO Cc1cc[nH+]c(N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000182636422 335832667 /nfs/dbraw/zinc/83/26/67/335832667.db2.gz VOWHKQKDBLUJJP-LBPRGKRZSA-N 1 1 271.320 3.780 20 5 CHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000383626630 336115929 /nfs/dbraw/zinc/11/59/29/336115929.db2.gz UIFHWZUPYNSXFD-DGCLKSJQSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[C@H]([NH2+]Cc1csc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000041010490 522666478 /nfs/dbraw/zinc/66/64/78/522666478.db2.gz FRNYULRSJNWFAA-AWEZNQCLSA-N 1 1 291.376 3.601 20 5 CHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000130172226 523122650 /nfs/dbraw/zinc/12/26/50/523122650.db2.gz NUKYCZJRQWGDDU-INIZCTEOSA-N 1 1 299.374 3.881 20 5 CHBDMO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000053036116 524605312 /nfs/dbraw/zinc/60/53/12/524605312.db2.gz YLUNTZOUPUJEJJ-GFCCVEGCSA-N 1 1 274.320 3.655 20 5 CHBDMO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000037668278 524971269 /nfs/dbraw/zinc/97/12/69/524971269.db2.gz KBACBOLSOSDTFR-XHDPSFHLSA-N 1 1 286.331 3.601 20 5 CHBDMO CC(C)CC[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000611254178 1121632255 /nfs/dbraw/zinc/63/22/55/1121632255.db2.gz HBDHMYUXORMLBU-SOFGYWHQSA-N 1 1 262.353 3.586 20 5 CHBDMO CC[C@@H](C)[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000507190268 1122937589 /nfs/dbraw/zinc/93/75/89/1122937589.db2.gz YKQLSVKDGJOFOP-GFCCVEGCSA-N 1 1 264.369 3.949 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCc3c2cccc3F)cs1 ZINC000886362992 1125673177 /nfs/dbraw/zinc/67/31/77/1125673177.db2.gz WDULWDKNUFOBDN-ZDUSSCGKSA-N 1 1 292.335 3.573 20 5 CHBDMO CC1=C(c2ccco2)C[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000338337641 1126734575 /nfs/dbraw/zinc/73/45/75/1126734575.db2.gz AKFOXWKIWSLESZ-UHFFFAOYSA-N 1 1 298.342 3.867 20 5 CHBDMO Cc1ccc2c(c1)CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000483994757 1126809135 /nfs/dbraw/zinc/80/91/35/1126809135.db2.gz OONBYOIUFKQEOG-UHFFFAOYSA-N 1 1 296.370 3.504 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCc1ccncc1 ZINC000181482271 1126855982 /nfs/dbraw/zinc/85/59/82/1126855982.db2.gz GLBJUMUATZZNKR-AWEZNQCLSA-N 1 1 299.374 3.534 20 5 CHBDMO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000267916296 1127008458 /nfs/dbraw/zinc/00/84/58/1127008458.db2.gz PJRDCWNNNOOQLR-ZDUSSCGKSA-N 1 1 285.347 3.573 20 5 CHBDMO Cc1ccoc1C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000271035446 1127066493 /nfs/dbraw/zinc/06/64/93/1127066493.db2.gz KCKOVMCPNDOABI-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccoc1C[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000271035446 1127066497 /nfs/dbraw/zinc/06/64/97/1127066497.db2.gz KCKOVMCPNDOABI-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](C)CC1 ZINC000349975659 1127169726 /nfs/dbraw/zinc/16/97/26/1127169726.db2.gz OETHAEFBJSJAFY-LBPRGKRZSA-N 1 1 262.353 3.525 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000286905376 1127275885 /nfs/dbraw/zinc/27/58/85/1127275885.db2.gz JJIYLGFYFOZBBA-UHFFFAOYSA-N 1 1 284.306 3.605 20 5 CHBDMO CCCCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H](C)CCC ZINC000355537596 1127348136 /nfs/dbraw/zinc/34/81/36/1127348136.db2.gz AFNVVINJXOJZKM-CYBMUJFWSA-N 1 1 296.415 3.509 20 5 CHBDMO CC[N@@H+](CCSC)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000592204052 1127345067 /nfs/dbraw/zinc/34/50/67/1127345067.db2.gz QZAZEPAENDCWHV-GFCCVEGCSA-N 1 1 282.409 3.649 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](C(F)(F)F)C1 ZINC000761053952 1127413032 /nfs/dbraw/zinc/41/30/32/1127413032.db2.gz IFKIOJYXSLACPQ-KOLCDFICSA-N 1 1 288.269 3.540 20 5 CHBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359293510 1127456722 /nfs/dbraw/zinc/45/67/22/1127456722.db2.gz FPFTUFGXWWVTIJ-BBRMVZONSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)C1(C)CC1 ZINC000360027080 1127487161 /nfs/dbraw/zinc/48/71/61/1127487161.db2.gz DBBRQDHWRSERFX-JTQLQIEISA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1c(C[N@@H+](C2CC2)C2CCCC2)cccc1[N+](=O)[O-] ZINC000060562753 1127544342 /nfs/dbraw/zinc/54/43/42/1127544342.db2.gz QCFHRQDBWXERRA-UHFFFAOYSA-N 1 1 274.364 3.810 20 5 CHBDMO CSc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000603424858 1127648517 /nfs/dbraw/zinc/64/85/17/1127648517.db2.gz QPOMZQKNWBWKPC-SNVBAGLBSA-N 1 1 292.360 3.761 20 5 CHBDMO COc1ccc(C[N@@H+](C)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000603837847 1127673871 /nfs/dbraw/zinc/67/38/71/1127673871.db2.gz PAZUBPUSWXIWEM-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000603836686 1127675406 /nfs/dbraw/zinc/67/54/06/1127675406.db2.gz AKYZTTMVYBCJAE-CQSZACIVSA-N 1 1 262.353 3.668 20 5 CHBDMO CCC(CC)C[N@@H+](CC)CCOc1ccccc1[N+](=O)[O-] ZINC000603849891 1127676847 /nfs/dbraw/zinc/67/68/47/1127676847.db2.gz ZMDWPNAXNFJVSL-UHFFFAOYSA-N 1 1 294.395 3.732 20 5 CHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])s2)C1 ZINC000604409274 1127702985 /nfs/dbraw/zinc/70/29/85/1127702985.db2.gz MTBBFXJNVGLLEE-GFCCVEGCSA-N 1 1 297.424 3.580 20 5 CHBDMO CC[N@@H+](CCC(F)(F)F)Cc1cccc([N+](=O)[O-])c1C ZINC000604525267 1127706814 /nfs/dbraw/zinc/70/68/14/1127706814.db2.gz DUVOYUFZQCKULF-UHFFFAOYSA-N 1 1 290.285 3.678 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000298250253 1127716926 /nfs/dbraw/zinc/71/69/26/1127716926.db2.gz KLFYCNRCRXPKSR-DDTOSNHZSA-N 1 1 296.317 3.633 20 5 CHBDMO CC[N@@H+](CCc1cccs1)Cc1cccc([N+](=O)[O-])c1 ZINC000063755667 1127864359 /nfs/dbraw/zinc/86/43/59/1127864359.db2.gz LKLZRKWWSKNMOF-UHFFFAOYSA-N 1 1 290.388 3.721 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000374007187 1127870337 /nfs/dbraw/zinc/87/03/37/1127870337.db2.gz CJWZFJSKXIVTJV-TZMCWYRMSA-N 1 1 286.331 3.738 20 5 CHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000076067351 1127932063 /nfs/dbraw/zinc/93/20/63/1127932063.db2.gz BUOSZHWXDDITOR-HUUCEWRRSA-N 1 1 294.420 3.701 20 5 CHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539827557 1127943969 /nfs/dbraw/zinc/94/39/69/1127943969.db2.gz IKYAZRWARYTEQS-FZMZJTMJSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000540055014 1127959663 /nfs/dbraw/zinc/95/96/63/1127959663.db2.gz AUJZCXUHJYUXAD-FZMZJTMJSA-N 1 1 262.353 3.666 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)c1 ZINC000544612285 1127979500 /nfs/dbraw/zinc/97/95/00/1127979500.db2.gz VBKDWMDVCUFFSR-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H](C)C1 ZINC000468260563 1128000027 /nfs/dbraw/zinc/00/00/27/1128000027.db2.gz KYKAOOKDXIHWFW-OLZOCXBDSA-N 1 1 262.353 3.778 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)s1 ZINC000541772419 1128038790 /nfs/dbraw/zinc/03/87/90/1128038790.db2.gz ZCONECWKYYCULL-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC2(CCC2)C1 ZINC000470179403 1128064862 /nfs/dbraw/zinc/06/48/62/1128064862.db2.gz XEFBYCZGELMXCN-GXDHUFHOSA-N 1 1 286.375 3.874 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)C1CCCC1 ZINC000470176210 1128065075 /nfs/dbraw/zinc/06/50/75/1128065075.db2.gz JHOLCZZHTBWPNP-JLHYYAGUSA-N 1 1 274.364 3.873 20 5 CHBDMO CCCC[N@@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470176659 1128065079 /nfs/dbraw/zinc/06/50/79/1128065079.db2.gz XUOGSYODSJADPD-RAXLEYEMSA-N 1 1 262.353 3.730 20 5 CHBDMO CC[C@@H](C)[N@@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470179136 1128065099 /nfs/dbraw/zinc/06/50/99/1128065099.db2.gz SSXREKYQKCHKEE-KIWPFMIBSA-N 1 1 262.353 3.728 20 5 CHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000471022910 1128085582 /nfs/dbraw/zinc/08/55/82/1128085582.db2.gz QRSIAWROHQMFIE-RDTXWAMCSA-N 1 1 296.370 3.830 20 5 CHBDMO Cc1cc([NH+](C)C)cc(C)c1NCc1ccc([N+](=O)[O-])cc1 ZINC000152325524 1128116256 /nfs/dbraw/zinc/11/62/56/1128116256.db2.gz LLCFLQNQBUYPSQ-UHFFFAOYSA-N 1 1 299.374 3.890 20 5 CHBDMO C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCCC1 ZINC000494199794 1128160247 /nfs/dbraw/zinc/16/02/47/1128160247.db2.gz YMINPVBCXXGGLO-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccc(F)cc2)c1 ZINC000035368125 1128328505 /nfs/dbraw/zinc/32/85/05/1128328505.db2.gz DKBSRZDVKCTTKX-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO CC[N@@H+](Cc1ccncc1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000272507330 1128349294 /nfs/dbraw/zinc/34/92/94/1128349294.db2.gz OJLISWCLDGJXFC-CQSZACIVSA-N 1 1 299.374 3.881 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1nccs1 ZINC000153360915 1128373190 /nfs/dbraw/zinc/37/31/90/1128373190.db2.gz LBPOKQFNJZAFOM-MNOVXSKESA-N 1 1 291.376 3.772 20 5 CHBDMO CCC(CC)C[N@@H+](CC)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917054853 1128469769 /nfs/dbraw/zinc/46/97/69/1128469769.db2.gz WSCSFQAVKHWDLD-UHFFFAOYSA-N 1 1 282.359 3.992 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2cccnc2)C1 ZINC000564081518 1128492390 /nfs/dbraw/zinc/49/23/90/1128492390.db2.gz WOFLUAGZGPDZFJ-UKRRQHHQSA-N 1 1 297.358 3.540 20 5 CHBDMO CCCC[N@@H+](CC)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705211 1128722854 /nfs/dbraw/zinc/72/28/54/1128722854.db2.gz GFUQTSFGVRFXMW-UHFFFAOYSA-N 1 1 270.760 3.870 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000610080162 1128737905 /nfs/dbraw/zinc/73/79/05/1128737905.db2.gz KFWQRTQAMTVOHN-LBPRGKRZSA-N 1 1 268.382 3.811 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)CCC[C@@H]1C ZINC000610215387 1117882200 /nfs/dbraw/zinc/88/22/00/1117882200.db2.gz KQEVFCWLXABPRH-STQMWFEESA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000509535924 1117958606 /nfs/dbraw/zinc/95/86/06/1117958606.db2.gz AEDVNCQHEJFENM-DEBLGDTFSA-N 1 1 274.364 3.730 20 5 CHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000359298116 1117984437 /nfs/dbraw/zinc/98/44/37/1117984437.db2.gz KSKOVKBKHOPDOR-MLGOLLRUSA-N 1 1 292.354 3.746 20 5 CHBDMO CC[N@@H+](CCc1ccccn1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000764312731 1118083658 /nfs/dbraw/zinc/08/36/58/1118083658.db2.gz VNSXUPGMUUFPNW-CQSZACIVSA-N 1 1 299.374 3.615 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000615837599 1128764413 /nfs/dbraw/zinc/76/44/13/1128764413.db2.gz IDVJVQCSLFEVIK-RRDVCTQDSA-N 1 1 292.354 3.678 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000615837599 1128764414 /nfs/dbraw/zinc/76/44/14/1128764414.db2.gz IDVJVQCSLFEVIK-RRDVCTQDSA-N 1 1 292.354 3.678 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2Nc1cc(C2CC2)cc[nH+]1 ZINC000580783869 1118504174 /nfs/dbraw/zinc/50/41/74/1118504174.db2.gz NLOPRXNPYLVIFV-HNNXBMFYSA-N 1 1 295.342 3.967 20 5 CHBDMO C[C@H](c1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394943964 1118562999 /nfs/dbraw/zinc/56/29/99/1118562999.db2.gz HNSFGQBOUVXDPS-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394943964 1118563000 /nfs/dbraw/zinc/56/30/00/1118563000.db2.gz HNSFGQBOUVXDPS-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)(C)C ZINC000610581097 1118595217 /nfs/dbraw/zinc/59/52/17/1118595217.db2.gz IRQSLNXYNYLFOU-JTQLQIEISA-N 1 1 291.351 3.602 20 5 CHBDMO CCCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1 ZINC000610581263 1118778267 /nfs/dbraw/zinc/77/82/67/1118778267.db2.gz WFOBGGSTFLFQNU-UHFFFAOYSA-N 1 1 289.335 3.501 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)CCC(F)(F)F ZINC000342682352 1119125017 /nfs/dbraw/zinc/12/50/17/1119125017.db2.gz WYZBRSQWYXUDDM-SECBINFHSA-N 1 1 276.258 3.540 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCC(F)(F)F ZINC000342682352 1119125020 /nfs/dbraw/zinc/12/50/20/1119125020.db2.gz WYZBRSQWYXUDDM-SECBINFHSA-N 1 1 276.258 3.540 20 5 CHBDMO CC(C)[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000158713825 1119151259 /nfs/dbraw/zinc/15/12/59/1119151259.db2.gz KKDMGHLXZDHRBV-UHFFFAOYSA-N 1 1 274.320 3.695 20 5 CHBDMO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc(F)c1F ZINC000121863581 1119183918 /nfs/dbraw/zinc/18/39/18/1119183918.db2.gz PJCYRDHARIKGEG-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1[nH+]c2cc(Nc3ccc([N+](=O)[O-])cc3)ccc2n1C ZINC000091485307 1119243526 /nfs/dbraw/zinc/24/35/26/1119243526.db2.gz INXOXZRTKVITNN-UHFFFAOYSA-N 1 1 282.303 3.534 20 5 CHBDMO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C(C)C ZINC000563820988 1119441250 /nfs/dbraw/zinc/44/12/50/1119441250.db2.gz MXMUQMBGOCEBCP-UHFFFAOYSA-N 1 1 250.342 3.524 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000051016697 1119630070 /nfs/dbraw/zinc/63/00/70/1119630070.db2.gz GLBJYOVSWYKJIT-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000273437280 1120116828 /nfs/dbraw/zinc/11/68/28/1120116828.db2.gz MFXKXVRFWXARKV-INIZCTEOSA-N 1 1 285.347 3.568 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)CC[C@@H]1C ZINC000542701424 1120122221 /nfs/dbraw/zinc/12/22/21/1120122221.db2.gz FDIKXQCYPQTBHL-AAEUAGOBSA-N 1 1 262.353 3.524 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](C1CC1)C1CCCC1 ZINC000103465919 1120252272 /nfs/dbraw/zinc/25/22/72/1120252272.db2.gz HVSWYBODGLXONX-UHFFFAOYSA-N 1 1 278.327 3.641 20 5 CHBDMO CC[C@H](C)C[N@@H+](CC)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000466201976 1120448442 /nfs/dbraw/zinc/44/84/42/1120448442.db2.gz KNCRIXHCPQLNIH-NSHDSACASA-N 1 1 298.358 3.611 20 5 CHBDMO Cc1cc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)oc1C ZINC000282343337 1120480542 /nfs/dbraw/zinc/48/05/42/1120480542.db2.gz VJEIKVIEVJNZGZ-LLVKDONJSA-N 1 1 274.320 3.655 20 5 CHBDMO C[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000530902745 1120483772 /nfs/dbraw/zinc/48/37/72/1120483772.db2.gz ZYRZRRBTLHDHLS-DYVFJYSZSA-N 1 1 282.343 3.788 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000530902745 1120483774 /nfs/dbraw/zinc/48/37/74/1120483774.db2.gz ZYRZRRBTLHDHLS-DYVFJYSZSA-N 1 1 282.343 3.788 20 5 CHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccn1 ZINC000093338685 1120558379 /nfs/dbraw/zinc/55/83/79/1120558379.db2.gz MVIIBZUMECXLQD-VQHVLOKHSA-N 1 1 297.358 3.525 20 5 CHBDMO Cc1c(C[N@@H+]2CCc3ccsc3C2)cccc1[N+](=O)[O-] ZINC000132618724 1120561267 /nfs/dbraw/zinc/56/12/67/1120561267.db2.gz AAIYUBCCSKZJOZ-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1c(C[N@H+]2CCc3ccsc3C2)cccc1[N+](=O)[O-] ZINC000132618724 1120561274 /nfs/dbraw/zinc/56/12/74/1120561274.db2.gz AAIYUBCCSKZJOZ-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO CSCC[C@@H](C)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093558616 1120561991 /nfs/dbraw/zinc/56/19/91/1120561991.db2.gz JBKZEONLYGMVAS-STMXVASLSA-N 1 1 294.420 3.681 20 5 CHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000508991385 1120577924 /nfs/dbraw/zinc/57/79/24/1120577924.db2.gz NIDNFDAVSFHQML-JTQLQIEISA-N 1 1 298.333 3.741 20 5 CHBDMO C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@H]1CC=CCC1 ZINC000509008345 1120588434 /nfs/dbraw/zinc/58/84/34/1120588434.db2.gz MSTTUWAZEMHBGT-NSHDSACASA-N 1 1 296.317 3.661 20 5 CHBDMO C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@H]1CC=CCC1 ZINC000509008345 1120588437 /nfs/dbraw/zinc/58/84/37/1120588437.db2.gz MSTTUWAZEMHBGT-NSHDSACASA-N 1 1 296.317 3.661 20 5 CHBDMO CCC(CC)C[N@@H+](CC)Cc1c(F)cccc1[N+](=O)[O-] ZINC000509128744 1120666995 /nfs/dbraw/zinc/66/69/95/1120666995.db2.gz WSMNKQVFSLLQLK-UHFFFAOYSA-N 1 1 282.359 3.992 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC2(CCC2)C1 ZINC000344210031 1121120476 /nfs/dbraw/zinc/12/04/76/1121120476.db2.gz CTUFJQZFWAGXOG-GFCCVEGCSA-N 1 1 260.337 3.532 20 5 CHBDMO CCC[C@H]([NH2+]Cc1nccs1)c1cccc([N+](=O)[O-])c1 ZINC000041012389 1121254852 /nfs/dbraw/zinc/25/48/52/1121254852.db2.gz RMKPORVNIGOTSC-ZDUSSCGKSA-N 1 1 291.376 3.682 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000512653365 1121510333 /nfs/dbraw/zinc/51/03/33/1121510333.db2.gz WNNFKPHLMQHFSS-VCELZJIISA-N 1 1 286.375 3.873 20 5 CHBDMO C[C@@H]1CC[C@@H]([N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000433037396 1121532352 /nfs/dbraw/zinc/53/23/52/1121532352.db2.gz FACAXIAXFLZVDJ-BBUPELFUSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1c(C[N@@H+]2CC3(CCC3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000433256849 1121631313 /nfs/dbraw/zinc/63/13/13/1121631313.db2.gz CATFGSBYIKQYKH-GFCCVEGCSA-N 1 1 274.364 3.668 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](c2ccco2)C1 ZINC000611271344 1121633949 /nfs/dbraw/zinc/63/39/49/1121633949.db2.gz SNRPIEXWYVGVTP-VFQAQYNWSA-N 1 1 298.342 3.691 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2csc([N+](=O)[O-])c2)c1C ZINC000428744820 1121656598 /nfs/dbraw/zinc/65/65/98/1121656598.db2.gz NUEYGKCKRCWJIA-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO Cc1cccc(C[N@@H+](C)Cc2csc([N+](=O)[O-])c2)c1C ZINC000428744820 1121656600 /nfs/dbraw/zinc/65/66/00/1121656600.db2.gz NUEYGKCKRCWJIA-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000035019502 1122149624 /nfs/dbraw/zinc/14/96/24/1122149624.db2.gz QZPZIFYZMCSCQV-RYUDHWBXSA-N 1 1 274.320 3.908 20 5 CHBDMO CCC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])CC(C)C ZINC000505784094 1122530961 /nfs/dbraw/zinc/53/09/61/1122530961.db2.gz OPVZEZYOZXMRPG-UHFFFAOYSA-N 1 1 268.332 3.602 20 5 CHBDMO C[C@@H]1CCCC[C@H]1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001191521339 1122604460 /nfs/dbraw/zinc/60/44/60/1122604460.db2.gz PTNYHDIHEHTMDF-HIFRSBDPSA-N 1 1 288.391 3.779 20 5 CHBDMO Cc1c(C[N@@H+]2C[C@H](C)CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC001192500878 1122648307 /nfs/dbraw/zinc/64/83/07/1122648307.db2.gz JUXNMROKDWDXIT-GFCCVEGCSA-N 1 1 276.380 3.771 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000437820736 1122658530 /nfs/dbraw/zinc/65/85/30/1122658530.db2.gz HRNAVBZAWFDAPI-HOCLYGCPSA-N 1 1 296.370 3.973 20 5 CHBDMO CCC[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000506405114 1122734029 /nfs/dbraw/zinc/73/40/29/1122734029.db2.gz RYBPDOAWRFHTTR-UHFFFAOYSA-N 1 1 274.320 3.697 20 5 CHBDMO CC[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000518581228 1122768224 /nfs/dbraw/zinc/76/82/24/1122768224.db2.gz BDGWZHZWFQKUQV-STQMWFEESA-N 1 1 262.353 3.778 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507106309 1122925721 /nfs/dbraw/zinc/92/57/21/1122925721.db2.gz XHBVNTUXOYNHFW-QGZVFWFLSA-N 1 1 296.370 3.893 20 5 CHBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000507184391 1122934772 /nfs/dbraw/zinc/93/47/72/1122934772.db2.gz UYRTWTJYGVKNKJ-HNNXBMFYSA-N 1 1 296.370 3.893 20 5 CHBDMO CC(C)c1ccc(C[N@H+](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000183742665 1129090679 /nfs/dbraw/zinc/09/06/79/1129090679.db2.gz KPYLMVYOFZAUSD-UHFFFAOYSA-N 1 1 299.374 3.745 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)Cc2ccncc2)cc1[N+](=O)[O-] ZINC000183742665 1129090680 /nfs/dbraw/zinc/09/06/80/1129090680.db2.gz KPYLMVYOFZAUSD-UHFFFAOYSA-N 1 1 299.374 3.745 20 5 CHBDMO C[N@@H+](CCC1CCCCC1)Cc1ccccc1[N+](=O)[O-] ZINC000507651604 1122981189 /nfs/dbraw/zinc/98/11/89/1122981189.db2.gz QPMKTQHEWNJBBR-UHFFFAOYSA-N 1 1 276.380 3.997 20 5 CHBDMO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351754498 1123278444 /nfs/dbraw/zinc/27/84/44/1123278444.db2.gz FRXQLPMBGAREBR-UWVGGRQHSA-N 1 1 284.306 3.636 20 5 CHBDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351754498 1123278446 /nfs/dbraw/zinc/27/84/46/1123278446.db2.gz FRXQLPMBGAREBR-UWVGGRQHSA-N 1 1 284.306 3.636 20 5 CHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522714117 1123719858 /nfs/dbraw/zinc/71/98/58/1123719858.db2.gz CEPVBELLHXDZJX-OAHLLOKOSA-N 1 1 262.353 3.605 20 5 CHBDMO CC(C)[N@H+](Cc1ccccc1[N+](=O)[O-])CC1CCC1 ZINC000444770020 1124061603 /nfs/dbraw/zinc/06/16/03/1124061603.db2.gz JXKNUPKFSODVFB-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCC12CCC2 ZINC000444778665 1124063708 /nfs/dbraw/zinc/06/37/08/1124063708.db2.gz XAZJQYNWNLUTIE-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO CCC(C)(C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000525998950 1124489106 /nfs/dbraw/zinc/48/91/06/1124489106.db2.gz KROQILZUMUIGDM-UHFFFAOYSA-N 1 1 250.342 3.524 20 5 CHBDMO Cc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cs1 ZINC000449010494 1124633168 /nfs/dbraw/zinc/63/31/68/1124633168.db2.gz LRAOOGJESCRHQG-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO Cc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cs1 ZINC000449010494 1124633174 /nfs/dbraw/zinc/63/31/74/1124633174.db2.gz LRAOOGJESCRHQG-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1c(F)cccc1[N+](=O)[O-] ZINC000872078019 1124676735 /nfs/dbraw/zinc/67/67/35/1124676735.db2.gz DQYPEPJHZICXPV-CKYFFXLPSA-N 1 1 284.306 3.665 20 5 CHBDMO Cc1cccc(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)[nH+]1 ZINC000450765312 1125100893 /nfs/dbraw/zinc/10/08/93/1125100893.db2.gz RPLBGCYBWLHOHY-OAHLLOKOSA-N 1 1 297.358 3.682 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CC1CC1)C1CCC1 ZINC000475670324 1125167384 /nfs/dbraw/zinc/16/73/84/1125167384.db2.gz GLYGZVRXQMRYIX-UHFFFAOYSA-N 1 1 274.364 3.668 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000532072960 1125232158 /nfs/dbraw/zinc/23/21/58/1125232158.db2.gz AXHCTTGTWNISSM-LLVKDONJSA-N 1 1 268.382 3.668 20 5 CHBDMO CC(C)[C@@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303648514 1129550666 /nfs/dbraw/zinc/55/06/66/1129550666.db2.gz DDMZQFAAAGQWOE-INIZCTEOSA-N 1 1 276.380 3.648 20 5 CHBDMO CC[N@@H+](Cc1cccc(Cl)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169042788 1129690841 /nfs/dbraw/zinc/69/08/41/1129690841.db2.gz FSCBNWDRFPANNW-ZFWWWQNUSA-N 1 1 296.798 3.607 20 5 CHBDMO CC[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169039779 1129690855 /nfs/dbraw/zinc/69/08/55/1129690855.db2.gz TWABAGUDJOHTAM-ZFWWWQNUSA-N 1 1 296.798 3.607 20 5 CHBDMO CCCC1CCC([N@@H+](C)Cc2cccnc2[N+](=O)[O-])CC1 ZINC001169953857 1129768367 /nfs/dbraw/zinc/76/83/67/1129768367.db2.gz WTNNNHGQGXZPMJ-UHFFFAOYSA-N 1 1 291.395 3.781 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC23CCC3)ccc1Cl ZINC000769983191 1129934448 /nfs/dbraw/zinc/93/44/48/1129934448.db2.gz GAWRURLNGIEFIW-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746663602 1129978615 /nfs/dbraw/zinc/97/86/15/1129978615.db2.gz SHBOGSZUJBWDNZ-CYBMUJFWSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@@H]1C[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)CCS1 ZINC001461964733 1130142405 /nfs/dbraw/zinc/14/24/05/1130142405.db2.gz XVHODIPHDGSABY-CYBMUJFWSA-N 1 1 294.420 3.539 20 5 CHBDMO CC[C@H]1C[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)CCS1 ZINC001461964759 1130143612 /nfs/dbraw/zinc/14/36/12/1130143612.db2.gz XVHODIPHDGSABY-ZDUSSCGKSA-N 1 1 294.420 3.539 20 5 CHBDMO CC1(C)CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746665766 1130143624 /nfs/dbraw/zinc/14/36/24/1130143624.db2.gz FXKARJFONFNDAQ-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CCC(CC)[N@@H+](C)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170351389 1130487088 /nfs/dbraw/zinc/48/70/88/1130487088.db2.gz FWFUXMSXWBAPGQ-GFCCVEGCSA-N 1 1 294.395 3.655 20 5 CHBDMO CC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC1CCC1 ZINC000793351272 1130549980 /nfs/dbraw/zinc/54/99/80/1130549980.db2.gz FMWXWXCYXBZENH-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@@H+]1CCN[C@@H]2C[C@@H]21 ZINC001235287474 1130731406 /nfs/dbraw/zinc/73/14/06/1130731406.db2.gz CSMVMOASDGRXND-UXHICEINSA-N 1 1 288.394 3.539 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCN[C@@H]2C[C@@H]21 ZINC001235287474 1130731411 /nfs/dbraw/zinc/73/14/11/1130731411.db2.gz CSMVMOASDGRXND-UXHICEINSA-N 1 1 288.394 3.539 20 5 CHBDMO C[N@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783508474 1130831711 /nfs/dbraw/zinc/83/17/11/1130831711.db2.gz QRVWUOSKLZSMAO-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[N@@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783508474 1130831718 /nfs/dbraw/zinc/83/17/18/1130831718.db2.gz QRVWUOSKLZSMAO-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1C ZINC000816648930 1131120958 /nfs/dbraw/zinc/12/09/58/1131120958.db2.gz QWSOHKLWVIDRFC-NEPJUHHUSA-N 1 1 286.331 3.695 20 5 CHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](Cc3ccoc3)C2)cc1 ZINC000824820796 1131485898 /nfs/dbraw/zinc/48/58/98/1131485898.db2.gz NEWWPBYDFNEAEA-HNNXBMFYSA-N 1 1 286.331 3.567 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@]3(CC3(F)F)C2)cc1[N+](=O)[O-] ZINC000846108803 1131686393 /nfs/dbraw/zinc/68/63/93/1131686393.db2.gz QUFXBFPRAKQOJD-AWEZNQCLSA-N 1 1 296.317 3.524 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccns1 ZINC000716013717 1132008447 /nfs/dbraw/zinc/00/84/47/1132008447.db2.gz HHFGJRBSNGZMMW-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO CC[N@H+]1CC[C@@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001230203742 1132159927 /nfs/dbraw/zinc/15/99/27/1132159927.db2.gz WWYSSETVBQUVHY-OAHLLOKOSA-N 1 1 292.382 3.861 20 5 CHBDMO C[N@@H+](Cc1c2ccccc2cc2ccccc21)C1COC1 ZINC001141728585 1132242015 /nfs/dbraw/zinc/24/20/15/1132242015.db2.gz YMQGCBAHIZPCCT-UHFFFAOYSA-N 1 1 277.367 3.824 20 5 CHBDMO CCC[N@@H+](CC)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907445 1132350443 /nfs/dbraw/zinc/35/04/43/1132350443.db2.gz DUKLOTRNUIQZNI-HNNXBMFYSA-N 1 1 276.380 3.574 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C)CC1 ZINC001173221563 1132411483 /nfs/dbraw/zinc/41/14/83/1132411483.db2.gz KHHGTMAHLPDEOL-UONOGXRCSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C(F)F)C1 ZINC001173225684 1132412556 /nfs/dbraw/zinc/41/25/56/1132412556.db2.gz FISJPSFCCSNFIS-DGCLKSJQSA-N 1 1 298.333 3.503 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCCC[C@H]1C ZINC001173227372 1132412960 /nfs/dbraw/zinc/41/29/60/1132412960.db2.gz QGMDUPPVNQFLSF-ZIAGYGMSSA-N 1 1 276.380 3.790 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCCC1(F)F ZINC001173236107 1132414865 /nfs/dbraw/zinc/41/48/65/1132414865.db2.gz WSBMQPHBOUMTRG-BXUZGUMPSA-N 1 1 298.333 3.693 20 5 CHBDMO O=[N+]([O-])c1ccc(Nc2ccc3[nH]c[nH+]c3c2)c(Cl)c1 ZINC001160224554 1132949817 /nfs/dbraw/zinc/94/98/17/1132949817.db2.gz SRDXNFIKYCAYPX-UHFFFAOYSA-N 1 1 288.694 3.868 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC001204602155 1133466474 /nfs/dbraw/zinc/46/64/74/1133466474.db2.gz SAGWJKRNRGSHQS-QGZVFWFLSA-N 1 1 288.391 3.976 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC001204929788 1133502271 /nfs/dbraw/zinc/50/22/71/1133502271.db2.gz CUTAACUAORGMKN-KRWDZBQOSA-N 1 1 299.374 3.877 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)C[C@H]1CC1(C)C ZINC001206808233 1133751304 /nfs/dbraw/zinc/75/13/04/1133751304.db2.gz DUQPBWXCOUXVBQ-CYBMUJFWSA-N 1 1 276.380 3.690 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+]CC=C(Cl)Cl)cc1[N+](=O)[O-] ZINC000407046791 1135089752 /nfs/dbraw/zinc/08/97/52/1135089752.db2.gz HSJSUEVALYXVOJ-SECBINFHSA-N 1 1 289.162 3.873 20 5 CHBDMO C[N@H+](Cc1ccc2occc2c1)Cc1ccccc1[N+](=O)[O-] ZINC000347590583 529992188 /nfs/dbraw/zinc/99/21/88/529992188.db2.gz OXEPXIVQZARBOA-UHFFFAOYSA-N 1 1 296.326 3.973 20 5 CHBDMO C[N@@H+](Cc1ccc2occc2c1)Cc1ccccc1[N+](=O)[O-] ZINC000347590583 529992190 /nfs/dbraw/zinc/99/21/90/529992190.db2.gz OXEPXIVQZARBOA-UHFFFAOYSA-N 1 1 296.326 3.973 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccccc1[N+](=O)[O-] ZINC000035738534 172391888 /nfs/dbraw/zinc/39/18/88/172391888.db2.gz APUAQAUABKFODD-MNOVXSKESA-N 1 1 260.293 3.600 20 5 CHBDMO C[C@H]1CCC[C@H](C)[NH+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000352003052 228173697 /nfs/dbraw/zinc/17/36/97/228173697.db2.gz JSAWEKGNSSGGRQ-UWVGGRQHSA-N 1 1 284.306 3.636 20 5 CHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000313532666 260300767 /nfs/dbraw/zinc/30/07/67/260300767.db2.gz PUEJBUXCJHGCJS-LBPRGKRZSA-N 1 1 280.343 3.602 20 5 CHBDMO CC[N@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])cc1Cl ZINC000518400973 260399672 /nfs/dbraw/zinc/39/96/72/260399672.db2.gz VHHLMCWOQIJNPB-LBPRGKRZSA-N 1 1 297.786 3.535 20 5 CHBDMO Cc1c(C[N@H+]2CCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000497416220 262158252 /nfs/dbraw/zinc/15/82/52/262158252.db2.gz IUGIZKFQYAEPQA-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000525786446 262236188 /nfs/dbraw/zinc/23/61/88/262236188.db2.gz JPEMDEYOVTYTBF-OAHLLOKOSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000519001675 265289467 /nfs/dbraw/zinc/28/94/67/265289467.db2.gz MOAGPHGKKHPOTJ-TZMCWYRMSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC12CCC2 ZINC000357023184 266233844 /nfs/dbraw/zinc/23/38/44/266233844.db2.gz LBCBCZSYUCGPCK-LBPRGKRZSA-N 1 1 292.354 3.746 20 5 CHBDMO C[C@H]([N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000534349905 328047796 /nfs/dbraw/zinc/04/77/96/328047796.db2.gz AWADKSQPNUSLEK-FROQITRMSA-N 1 1 276.380 3.974 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCCC[C@H]1C ZINC000255955119 327037258 /nfs/dbraw/zinc/03/72/58/327037258.db2.gz SZAPHYCDVLUGDT-DOMZBBRYSA-N 1 1 292.379 3.614 20 5 CHBDMO CCCC[C@@H](CN)[NH2+][C@@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000423301653 330188932 /nfs/dbraw/zinc/18/89/32/330188932.db2.gz UHMWYMNNSWYPOB-HOCLYGCPSA-N 1 1 293.411 3.543 20 5 CHBDMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000527238488 330240647 /nfs/dbraw/zinc/24/06/47/330240647.db2.gz FPHXHJSRIYSFKY-TXEJJXNPSA-N 1 1 286.331 3.838 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000079601926 330249091 /nfs/dbraw/zinc/24/90/91/330249091.db2.gz PIMGUSJGOZPDRN-SNVBAGLBSA-N 1 1 268.382 3.665 20 5 CHBDMO C[C@@H](F)CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553153 331033869 /nfs/dbraw/zinc/03/38/69/331033869.db2.gz XPYAJBMUILJVJM-TZMCWYRMSA-N 1 1 280.343 3.522 20 5 CHBDMO CCC[C@@H]1[C@H](C)CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000464743417 331365754 /nfs/dbraw/zinc/36/57/54/331365754.db2.gz YJGBKONLDFYXLW-UKRRQHHQSA-N 1 1 276.380 3.995 20 5 CHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000464857374 331371493 /nfs/dbraw/zinc/37/14/93/331371493.db2.gz NHIIUTMSBMLPQP-LBPRGKRZSA-N 1 1 296.436 3.867 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCSC(C)(C)C1 ZINC000490099148 332081423 /nfs/dbraw/zinc/08/14/23/332081423.db2.gz GCPLOAWAMKNQBA-LBPRGKRZSA-N 1 1 294.420 3.792 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490429312 332089295 /nfs/dbraw/zinc/08/92/95/332089295.db2.gz DYAJWASUDKCOHB-AWEZNQCLSA-N 1 1 280.343 3.744 20 5 CHBDMO C[N@H+](Cc1cc2ccccc2o1)Cc1ccccc1[N+](=O)[O-] ZINC000175183675 333016595 /nfs/dbraw/zinc/01/65/95/333016595.db2.gz UDWMNVBDLBQGCP-UHFFFAOYSA-N 1 1 296.326 3.973 20 5 CHBDMO C[N@@H+](Cc1cc2ccccc2o1)Cc1ccccc1[N+](=O)[O-] ZINC000175183675 333016597 /nfs/dbraw/zinc/01/65/97/333016597.db2.gz UDWMNVBDLBQGCP-UHFFFAOYSA-N 1 1 296.326 3.973 20 5 CHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000513682574 333032075 /nfs/dbraw/zinc/03/20/75/333032075.db2.gz APUVQHIPPBOCKB-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO CC(C)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000521195740 333114714 /nfs/dbraw/zinc/11/47/14/333114714.db2.gz RDPFRYDJBHZPKT-UHFFFAOYSA-N 1 1 276.380 3.995 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2ccsc2C1 ZINC000132850991 334007913 /nfs/dbraw/zinc/00/79/13/334007913.db2.gz GRHAGJJRZSYYEW-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccsc2C1 ZINC000132850991 334007914 /nfs/dbraw/zinc/00/79/14/334007914.db2.gz GRHAGJJRZSYYEW-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO Cc1cnc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000135159010 334118287 /nfs/dbraw/zinc/11/82/87/334118287.db2.gz RHDKOEPMYQDXAX-MNOVXSKESA-N 1 1 291.376 3.772 20 5 CHBDMO C[N@H+]1CCCC[C@H]1CCSCc1ccc([N+](=O)[O-])cc1 ZINC000551460863 334251030 /nfs/dbraw/zinc/25/10/30/334251030.db2.gz ALMCSGRFTNWNQF-AWEZNQCLSA-N 1 1 294.420 3.702 20 5 CHBDMO C[C@H]([N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])C1(C)CC1 ZINC000091900337 334385861 /nfs/dbraw/zinc/38/58/61/334385861.db2.gz DSNUFLJBKYPHLY-CFNZNRNTSA-N 1 1 274.364 3.728 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000576392590 335197684 /nfs/dbraw/zinc/19/76/84/335197684.db2.gz SCUTUDVEYGPBDG-SVEBXFOSSA-N 1 1 298.386 3.873 20 5 CHBDMO COc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000352540218 533823124 /nfs/dbraw/zinc/82/31/24/533823124.db2.gz IJORSXIDXSUOQE-OAHLLOKOSA-N 1 1 298.342 3.550 20 5 CHBDMO COc1cc(C[N@H+]2CC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000352540218 533823127 /nfs/dbraw/zinc/82/31/27/533823127.db2.gz IJORSXIDXSUOQE-OAHLLOKOSA-N 1 1 298.342 3.550 20 5 CHBDMO CC(C)C[N@@H+](Cc1csc([N+](=O)[O-])c1)C(C)C ZINC000339926810 519718760 /nfs/dbraw/zinc/71/87/60/519718760.db2.gz NCGXOWCFUCCBRF-UHFFFAOYSA-N 1 1 256.371 3.523 20 5 CHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000130116228 522966472 /nfs/dbraw/zinc/96/64/72/522966472.db2.gz RBZOTPQSRGRLCQ-MRXNPFEDSA-N 1 1 285.347 3.573 20 5 CHBDMO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000053036118 524590070 /nfs/dbraw/zinc/59/00/70/524590070.db2.gz YLUNTZOUPUJEJJ-LBPRGKRZSA-N 1 1 274.320 3.655 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc(O)c1)c1ccccc1[N+](=O)[O-] ZINC000037151290 525612367 /nfs/dbraw/zinc/61/23/67/525612367.db2.gz RSZZHWDHBLQZLS-NWDGAFQWSA-N 1 1 286.331 3.712 20 5 CHBDMO Cc1ccoc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000291671626 525803402 /nfs/dbraw/zinc/80/34/02/525803402.db2.gz GNYNQVQCVOJHHK-UHFFFAOYSA-N 1 1 274.320 3.521 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289687894 526079894 /nfs/dbraw/zinc/07/98/94/526079894.db2.gz GUMNJFRGMQRDEA-QWRGUYRKSA-N 1 1 284.306 3.633 20 5 CHBDMO O=[N+]([O-])c1cc(CNc2cccc(C3CC3)[nH+]2)cs1 ZINC000292959647 527330856 /nfs/dbraw/zinc/33/08/56/527330856.db2.gz LHGWZJJQGPQOGV-UHFFFAOYSA-N 1 1 275.333 3.541 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000127380778 527396172 /nfs/dbraw/zinc/39/61/72/527396172.db2.gz QGIHJHPYHGGXNZ-PFWMLDTASA-N 1 1 297.358 3.773 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1cccnc1 ZINC000347369044 527500805 /nfs/dbraw/zinc/50/08/05/527500805.db2.gz GYLOWEDYOISMCP-ZROIWOOFSA-N 1 1 297.358 3.525 20 5 CHBDMO C[C@H]([NH2+]Cc1scnc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000713482109 1131965137 /nfs/dbraw/zinc/96/51/37/1131965137.db2.gz XNDUOPNCJKNERL-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccns1 ZINC000716012433 1132007591 /nfs/dbraw/zinc/00/75/91/1132007591.db2.gz APEBUOHLNIGBEP-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO CC[C@H](c1ccccc1)[N@@H+](CC)Cc1cccnc1[N+](=O)[O-] ZINC000885969346 1125631546 /nfs/dbraw/zinc/63/15/46/1125631546.db2.gz PHEZCNDGNYBXHA-MRXNPFEDSA-N 1 1 299.374 3.963 20 5 CHBDMO C[C@@H]1[C@@H](C)CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000050564683 1129972171 /nfs/dbraw/zinc/97/21/71/1129972171.db2.gz XVKOUWJXNCMXHX-WDEREUQCSA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@H](C)C1 ZINC000482293842 1126749695 /nfs/dbraw/zinc/74/96/95/1126749695.db2.gz SHQXIQMASYJZNX-LBPRGKRZSA-N 1 1 262.353 3.525 20 5 CHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC(C)(C)C1 ZINC000483107786 1126768195 /nfs/dbraw/zinc/76/81/95/1126768195.db2.gz SDBGSNLQQSATOT-OAHLLOKOSA-N 1 1 276.380 3.648 20 5 CHBDMO CC1=C(C)C[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000483370593 1126783190 /nfs/dbraw/zinc/78/31/90/1126783190.db2.gz GUXAICZPRAMCNX-CYBMUJFWSA-N 1 1 260.337 3.698 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccccc2)C2CC2)c1 ZINC000043643070 1127005782 /nfs/dbraw/zinc/00/57/82/1127005782.db2.gz FROYOCJLYIYVGZ-UHFFFAOYSA-N 1 1 282.343 3.759 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000348917980 1127134982 /nfs/dbraw/zinc/13/49/82/1127134982.db2.gz ANJDXDYTOUDZLM-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000348917980 1127134985 /nfs/dbraw/zinc/13/49/85/1127134985.db2.gz ANJDXDYTOUDZLM-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@@H](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000588977847 1127209057 /nfs/dbraw/zinc/20/90/57/1127209057.db2.gz AMUOMXYLAJVBSR-OAHLLOKOSA-N 1 1 274.364 3.525 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000589209390 1127216369 /nfs/dbraw/zinc/21/63/69/1127216369.db2.gz KXHRHBVMMGDYNU-UYZDIKGJSA-N 1 1 286.375 3.730 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+](CC2CC2)C2CCC2)c(F)c1 ZINC000352403517 1127229209 /nfs/dbraw/zinc/22/92/09/1127229209.db2.gz VUGKFXJZHQFTHH-UHFFFAOYSA-N 1 1 296.317 3.638 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+](CC2CC2)C2CCC2)c(F)c1 ZINC000352403517 1127229213 /nfs/dbraw/zinc/22/92/13/1127229213.db2.gz VUGKFXJZHQFTHH-UHFFFAOYSA-N 1 1 296.317 3.638 20 5 CHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000287027228 1127283375 /nfs/dbraw/zinc/28/33/75/1127283375.db2.gz RZLVZHSQTITYIQ-UHFFFAOYSA-N 1 1 298.333 3.647 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000046089166 1127330395 /nfs/dbraw/zinc/33/03/95/1127330395.db2.gz DGXZDEIPHGUYHJ-OAHLLOKOSA-N 1 1 288.372 3.993 20 5 CHBDMO CCCCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H](C)CCC ZINC000355537597 1127348416 /nfs/dbraw/zinc/34/84/16/1127348416.db2.gz AFNVVINJXOJZKM-ZDUSSCGKSA-N 1 1 296.415 3.509 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccc(Cl)o1 ZINC000594513366 1127420269 /nfs/dbraw/zinc/42/02/69/1127420269.db2.gz NHUWHHKMMRASLG-GFCCVEGCSA-N 1 1 292.722 3.618 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC1CC=CC1)C1CC1 ZINC000595387109 1127461712 /nfs/dbraw/zinc/46/17/12/1127461712.db2.gz OBXJZMZIIGSGBI-UHFFFAOYSA-N 1 1 272.348 3.525 20 5 CHBDMO Cc1noc(C[N@H+](C)[C@H]2CCC[C@@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595553260 1127466751 /nfs/dbraw/zinc/46/67/51/1127466751.db2.gz WKWBBUIYEFISAH-RYUDHWBXSA-N 1 1 295.383 3.538 20 5 CHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)o1 ZINC000597222535 1127535895 /nfs/dbraw/zinc/53/58/95/1127535895.db2.gz FDEQLSWREIMFND-CHWSQXEVSA-N 1 1 298.342 3.697 20 5 CHBDMO Cc1ccc2c(c1)C[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C2 ZINC000361602663 1127576372 /nfs/dbraw/zinc/57/63/72/1127576372.db2.gz NOVJQVADNCSIRS-UHFFFAOYSA-N 1 1 282.343 3.727 20 5 CHBDMO Cc1ccc2c(c1)C[N@H+](Cc1cccc([N+](=O)[O-])c1C)C2 ZINC000361602663 1127576374 /nfs/dbraw/zinc/57/63/74/1127576374.db2.gz NOVJQVADNCSIRS-UHFFFAOYSA-N 1 1 282.343 3.727 20 5 CHBDMO CSc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000603428176 1127648422 /nfs/dbraw/zinc/64/84/22/1127648422.db2.gz QAJRYQCQYNLHRQ-SNVBAGLBSA-N 1 1 292.360 3.761 20 5 CHBDMO Cc1c(C[N@@H+]2CCC(F)(F)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000599624845 1127686024 /nfs/dbraw/zinc/68/60/24/1127686024.db2.gz ZWINNZOZXWRRSB-SNVBAGLBSA-N 1 1 284.306 3.523 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cn1 ZINC000297490177 1127697485 /nfs/dbraw/zinc/69/74/85/1127697485.db2.gz ZYIUHVNBBXQEBX-WDEREUQCSA-N 1 1 289.310 3.541 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1ccc([N+](=O)[O-])cc1 ZINC000297490175 1127697723 /nfs/dbraw/zinc/69/77/23/1127697723.db2.gz ZYIUHVNBBXQEBX-QWRGUYRKSA-N 1 1 289.310 3.541 20 5 CHBDMO CCC(CC)[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000604434779 1127705761 /nfs/dbraw/zinc/70/57/61/1127705761.db2.gz GVBRATGRPZWRHY-UHFFFAOYSA-N 1 1 268.382 3.809 20 5 CHBDMO CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC(C)C ZINC000604492906 1127707810 /nfs/dbraw/zinc/70/78/10/1127707810.db2.gz SIXKMSPVUCJHIH-UHFFFAOYSA-N 1 1 264.369 3.505 20 5 CHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000076068570 1127933494 /nfs/dbraw/zinc/93/34/94/1127933494.db2.gz GTAYCWJYTPOKQW-ZFWWWQNUSA-N 1 1 294.420 3.701 20 5 CHBDMO C[C@@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000539826812 1127944230 /nfs/dbraw/zinc/94/42/30/1127944230.db2.gz ZBVOIPDTGWRQGG-WOLRVDTOSA-N 1 1 274.364 3.728 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]21 ZINC000543897983 1127952363 /nfs/dbraw/zinc/95/23/63/1127952363.db2.gz GHBHNVSRHPIAHA-UHOFOFEASA-N 1 1 274.364 3.605 20 5 CHBDMO CC(C)(C)[C@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000544188332 1127962608 /nfs/dbraw/zinc/96/26/08/1127962608.db2.gz YEIGUEFPFNLQAO-AWEZNQCLSA-N 1 1 276.380 3.505 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@H](C)C1 ZINC000468260566 1128000391 /nfs/dbraw/zinc/00/03/91/1128000391.db2.gz KYKAOOKDXIHWFW-STQMWFEESA-N 1 1 262.353 3.778 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccccc1F ZINC000541775073 1128037815 /nfs/dbraw/zinc/03/78/15/1128037815.db2.gz RHQSMTQUEYJEQE-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1ccccc1F ZINC000541775073 1128037820 /nfs/dbraw/zinc/03/78/20/1128037820.db2.gz RHQSMTQUEYJEQE-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](C)[C@@H]1C ZINC000541770313 1128038891 /nfs/dbraw/zinc/03/88/91/1128038891.db2.gz FDVKOJSTSDDTCB-AAEUAGOBSA-N 1 1 262.353 3.524 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC(C)(C)C1 ZINC000470179260 1128064601 /nfs/dbraw/zinc/06/46/01/1128064601.db2.gz VJZQCDPPSSYIRX-LCYFTJDESA-N 1 1 274.364 3.730 20 5 CHBDMO CCOc1cc(C[N@H+]2CC[C@@H](C)[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492816887 1128113747 /nfs/dbraw/zinc/11/37/47/1128113747.db2.gz JKZRDAPAURMGMC-TZMCWYRMSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000493310852 1128138395 /nfs/dbraw/zinc/13/83/95/1128138395.db2.gz OPMMVYQCYPDMIJ-TXEJJXNPSA-N 1 1 294.782 3.870 20 5 CHBDMO CCC[C@@H](C)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493650970 1128146256 /nfs/dbraw/zinc/14/62/56/1128146256.db2.gz CCLOBOQETWEXBO-SNVBAGLBSA-N 1 1 270.760 3.869 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493650970 1128146257 /nfs/dbraw/zinc/14/62/57/1128146257.db2.gz CCLOBOQETWEXBO-SNVBAGLBSA-N 1 1 270.760 3.869 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](C)C1 ZINC000609193718 1128170580 /nfs/dbraw/zinc/17/05/80/1128170580.db2.gz YOMKLKZOQVROCG-ZDUSSCGKSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609194478 1128170612 /nfs/dbraw/zinc/17/06/12/1128170612.db2.gz OHIWICHNTNMWTR-CQSZACIVSA-N 1 1 292.379 3.756 20 5 CHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccccc1[N+](=O)[O-] ZINC000301069828 1128301714 /nfs/dbraw/zinc/30/17/14/1128301714.db2.gz DMBYVDILCAFYIE-AWEZNQCLSA-N 1 1 291.395 3.661 20 5 CHBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000301120286 1128403721 /nfs/dbraw/zinc/40/37/21/1128403721.db2.gz WJSDGEBMZHZPDL-AWEZNQCLSA-N 1 1 291.395 3.519 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000037494487 1128575103 /nfs/dbraw/zinc/57/51/03/1128575103.db2.gz AYJJGQFHRHABPG-LLVKDONJSA-N 1 1 274.295 3.585 20 5 CHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000556901442 1128636943 /nfs/dbraw/zinc/63/69/43/1128636943.db2.gz NMNOLZNUDUCBLB-CYBMUJFWSA-N 1 1 296.436 3.867 20 5 CHBDMO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000072555884 1117762187 /nfs/dbraw/zinc/76/21/87/1117762187.db2.gz MIGALLXZBZSEAX-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000072555884 1117762193 /nfs/dbraw/zinc/76/21/93/1117762193.db2.gz MIGALLXZBZSEAX-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000610080166 1128737826 /nfs/dbraw/zinc/73/78/26/1128737826.db2.gz KRQYUHWHDJCPKB-CQSZACIVSA-N 1 1 292.379 3.628 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCCC[C@H]1C ZINC000430240065 1117908530 /nfs/dbraw/zinc/90/85/30/1117908530.db2.gz CBMBWCJDINZAEM-DOMZBBRYSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1c(C[N@H+]2CC[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000471170666 1117917845 /nfs/dbraw/zinc/91/78/45/1117917845.db2.gz XCBPWALCAABWTP-KRWDZBQOSA-N 1 1 282.343 3.850 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001307686301 1117928466 /nfs/dbraw/zinc/92/84/66/1117928466.db2.gz SPJRODKFXSNRBZ-BMIGLBTASA-N 1 1 298.333 3.884 20 5 CHBDMO CC1=C[C@H](C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000430269254 1117966388 /nfs/dbraw/zinc/96/63/88/1117966388.db2.gz PYZJMWWOJKDOIJ-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@H](C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000430269254 1117966391 /nfs/dbraw/zinc/96/63/91/1117966391.db2.gz PYZJMWWOJKDOIJ-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000359877461 1118007956 /nfs/dbraw/zinc/00/79/56/1118007956.db2.gz PWTGDFWOYHFRJA-GUYCJALGSA-N 1 1 297.358 3.573 20 5 CHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCC2(CCCCC2)C1 ZINC001167341823 1118332889 /nfs/dbraw/zinc/33/28/89/1118332889.db2.gz LWKMKRFRXJDXPX-UHFFFAOYSA-N 1 1 289.379 3.536 20 5 CHBDMO CCn1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000616129702 1128776701 /nfs/dbraw/zinc/77/67/01/1128776701.db2.gz UYQBAQURGUWPQF-CYBMUJFWSA-N 1 1 287.363 3.609 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)C[C@H]1C ZINC000610133401 1118475258 /nfs/dbraw/zinc/47/52/58/1118475258.db2.gz MJQCNADJFPAFHX-QWHCGFSZSA-N 1 1 292.379 3.612 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001167457716 1118574566 /nfs/dbraw/zinc/57/45/66/1118574566.db2.gz JFHGEJBNFGSBLF-AWEZNQCLSA-N 1 1 280.343 3.889 20 5 CHBDMO Cc1c(C[N@H+]2CC[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000477222128 1118655677 /nfs/dbraw/zinc/65/56/77/1118655677.db2.gz MKTMLIHRTNBVQB-QGZVFWFLSA-N 1 1 296.370 3.893 20 5 CHBDMO CC1=C[C@H](C)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000430882976 1118783322 /nfs/dbraw/zinc/78/33/22/1118783322.db2.gz NXZXLMZVOCNBNB-VGVVRCBHSA-N 1 1 272.348 3.506 20 5 CHBDMO C[C@H]1CCC[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000538731203 1118949779 /nfs/dbraw/zinc/94/97/79/1118949779.db2.gz MRAUQPYFASXBHK-LBPRGKRZSA-N 1 1 286.331 3.839 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000071969847 1118990298 /nfs/dbraw/zinc/99/02/98/1118990298.db2.gz TXVVDROYSJPCIP-CYBMUJFWSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000479579253 1119125533 /nfs/dbraw/zinc/12/55/33/1119125533.db2.gz NTWFDMBBDZSRHX-DOMZBBRYSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1F ZINC000121936015 1119221059 /nfs/dbraw/zinc/22/10/59/1119221059.db2.gz SLPRGDFWOVEOME-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000612144799 1119227586 /nfs/dbraw/zinc/22/75/86/1119227586.db2.gz RMOARFLNUAXRAK-GFCCVEGCSA-N 1 1 278.327 3.522 20 5 CHBDMO CC[N@H+](Cc1cccs1)Cc1ccccc1[N+](=O)[O-] ZINC000248257779 1119337699 /nfs/dbraw/zinc/33/76/99/1119337699.db2.gz PHDUFSIBULKBTL-UHFFFAOYSA-N 1 1 276.361 3.678 20 5 CHBDMO CC[N@@H+](Cc1cccs1)Cc1ccccc1[N+](=O)[O-] ZINC000248257779 1119337703 /nfs/dbraw/zinc/33/77/03/1119337703.db2.gz PHDUFSIBULKBTL-UHFFFAOYSA-N 1 1 276.361 3.678 20 5 CHBDMO CSCCC[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000343651142 1119480516 /nfs/dbraw/zinc/48/05/16/1119480516.db2.gz ADJJPYUOENVTGB-UHFFFAOYSA-N 1 1 296.436 3.903 20 5 CHBDMO CC(C)[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC001167680263 1119675907 /nfs/dbraw/zinc/67/59/07/1119675907.db2.gz BSHDYIXHAJZVHJ-UHFFFAOYSA-N 1 1 292.379 3.627 20 5 CHBDMO CC[C@@H]([NH2+]Cc1ncc(C)s1)c1cccc([N+](=O)[O-])c1 ZINC000122981848 1120063403 /nfs/dbraw/zinc/06/34/03/1120063403.db2.gz XSUJCUUEYDUTLB-CYBMUJFWSA-N 1 1 291.376 3.601 20 5 CHBDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000353665553 1120198716 /nfs/dbraw/zinc/19/87/16/1120198716.db2.gz LDXRQMKPCMFWGS-ZDUSSCGKSA-N 1 1 282.343 3.542 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C1CC1)C1CCCC1 ZINC000064808235 1120303219 /nfs/dbraw/zinc/30/32/19/1120303219.db2.gz XRBCQXDPAIGDDR-UHFFFAOYSA-N 1 1 260.337 3.502 20 5 CHBDMO Cc1c(C[N@H+](C(C)C)C2CCC2)cccc1[N+](=O)[O-] ZINC000077357900 1120328752 /nfs/dbraw/zinc/32/87/52/1120328752.db2.gz FWORJRQNQVUZSL-UHFFFAOYSA-N 1 1 262.353 3.666 20 5 CHBDMO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000053422378 1120495183 /nfs/dbraw/zinc/49/51/83/1120495183.db2.gz DEFWSTDMZVYAHL-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000053422378 1120495187 /nfs/dbraw/zinc/49/51/87/1120495187.db2.gz DEFWSTDMZVYAHL-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)s1 ZINC000093338266 1120558124 /nfs/dbraw/zinc/55/81/24/1120558124.db2.gz ZZJHXTOYWQGSFQ-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1ccc(C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)s1 ZINC000093338266 1120558129 /nfs/dbraw/zinc/55/81/29/1120558129.db2.gz ZZJHXTOYWQGSFQ-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1[nH+]c2cc(Nc3sccc3[N+](=O)[O-])ccc2n1C ZINC000302022497 1120646305 /nfs/dbraw/zinc/64/63/05/1120646305.db2.gz OMTYACYKJVRFEP-UHFFFAOYSA-N 1 1 288.332 3.595 20 5 CHBDMO C[C@@H](c1ccncc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350357673 1120650704 /nfs/dbraw/zinc/65/07/04/1120650704.db2.gz OZYXHTYTCBKHLD-VSKVDJIOSA-N 1 1 297.358 3.696 20 5 CHBDMO CC[C@@]1(C)CC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001307582549 1120684812 /nfs/dbraw/zinc/68/48/12/1120684812.db2.gz HHIGDCLIZWUZAR-AWEZNQCLSA-N 1 1 282.771 3.870 20 5 CHBDMO Cc1c(C[N@H+]([C@@H](C)C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000047909007 1120797303 /nfs/dbraw/zinc/79/73/03/1120797303.db2.gz NIYMGDHRNYNZNF-LBPRGKRZSA-N 1 1 274.364 3.666 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCCc2occc2C1 ZINC000568564687 1120948709 /nfs/dbraw/zinc/94/87/09/1120948709.db2.gz HCUSFBNTPPPFOX-ZZXKWVIFSA-N 1 1 298.342 3.649 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCc2occc2C1 ZINC000568564687 1120948711 /nfs/dbraw/zinc/94/87/11/1120948711.db2.gz HCUSFBNTPPPFOX-ZZXKWVIFSA-N 1 1 298.342 3.649 20 5 CHBDMO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1CC1(C)C ZINC001174907157 1121085715 /nfs/dbraw/zinc/08/57/15/1121085715.db2.gz GTKLRMOLVZQQFD-NSHDSACASA-N 1 1 282.771 3.726 20 5 CHBDMO CCc1ccc(C)[nH+]c1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175900689 1121493188 /nfs/dbraw/zinc/49/31/88/1121493188.db2.gz SUMMNWIWDWZQOD-ZHACJKMWSA-N 1 1 283.331 3.943 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CC[C@@H](C)C1 ZINC000433038367 1121528454 /nfs/dbraw/zinc/52/84/54/1121528454.db2.gz JRPPGAYJAUCADH-BXUZGUMPSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H](C)C(C)C ZINC000543628649 1121534814 /nfs/dbraw/zinc/53/48/14/1121534814.db2.gz VNZKDAKYBQUYGW-CYBMUJFWSA-N 1 1 264.369 3.770 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000543631495 1121538683 /nfs/dbraw/zinc/53/86/83/1121538683.db2.gz NNLZYKUZOCVZCK-BBRMVZONSA-N 1 1 274.364 3.668 20 5 CHBDMO Cc1ncc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000611395312 1121644031 /nfs/dbraw/zinc/64/40/31/1121644031.db2.gz MWXSGBWEDPQCHA-ZJUUUORDSA-N 1 1 291.376 3.772 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000182627411 1121817271 /nfs/dbraw/zinc/81/72/71/1121817271.db2.gz YCIUGFOQFYADAR-CYBMUJFWSA-N 1 1 288.347 3.998 20 5 CHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccsc1 ZINC000619782548 1129013085 /nfs/dbraw/zinc/01/30/85/1129013085.db2.gz CIDJVNXABSWENC-SECBINFHSA-N 1 1 280.324 3.646 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@H](C)[C@H](C)C1 ZINC001180199382 1121966820 /nfs/dbraw/zinc/96/68/20/1121966820.db2.gz RNGSGNNNEAYHLT-WCQYABFASA-N 1 1 276.380 3.690 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000501871518 1122019505 /nfs/dbraw/zinc/01/95/05/1122019505.db2.gz PKBRQVOIVRKTHQ-KRWDZBQOSA-N 1 1 296.370 3.802 20 5 CHBDMO CC(C)C1(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])CC1 ZINC001181697126 1122073225 /nfs/dbraw/zinc/07/32/25/1122073225.db2.gz FPVRBBVIABKMBI-UHFFFAOYSA-N 1 1 276.380 3.505 20 5 CHBDMO CCC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1Cl ZINC001186381660 1122390997 /nfs/dbraw/zinc/39/09/97/1122390997.db2.gz XAIXGIKZPQVGNZ-LBPRGKRZSA-N 1 1 297.786 3.535 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@@H]12 ZINC000515548291 1122509304 /nfs/dbraw/zinc/50/93/04/1122509304.db2.gz RHIXYHKHOLELLH-COXVUDFISA-N 1 1 288.391 3.995 20 5 CHBDMO CC[C@@H](C)C[N@@H+](CC)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001191374867 1122597643 /nfs/dbraw/zinc/59/76/43/1122597643.db2.gz KJNLVGKPXUDXFP-CQSZACIVSA-N 1 1 294.395 3.732 20 5 CHBDMO CC(C)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000159441181 1122861578 /nfs/dbraw/zinc/86/15/78/1122861578.db2.gz AQXNQONGWCCFET-NSHDSACASA-N 1 1 282.771 3.726 20 5 CHBDMO Cc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1C ZINC000507118154 1122927587 /nfs/dbraw/zinc/92/75/87/1122927587.db2.gz BIVVCNUREYTFSR-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO COc1ccc(C[N@H+]2CCC[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000507136015 1122930974 /nfs/dbraw/zinc/93/09/74/1122930974.db2.gz WREPNHMKLZBENA-CQSZACIVSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1cc(C)cc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000507172931 1122934659 /nfs/dbraw/zinc/93/46/59/1122934659.db2.gz JILBQNUPKRVMPJ-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000507182056 1122935513 /nfs/dbraw/zinc/93/55/13/1122935513.db2.gz PCRCTOJLEZHZGU-INIZCTEOSA-N 1 1 296.370 3.893 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000507672220 1122983261 /nfs/dbraw/zinc/98/32/61/1122983261.db2.gz JJJDTYTVLITASG-MRXNPFEDSA-N 1 1 296.370 3.659 20 5 CHBDMO Cc1cccc2c1CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C2 ZINC000729478006 1122998652 /nfs/dbraw/zinc/99/86/52/1122998652.db2.gz SHEJZYOGHCPCTO-UHFFFAOYSA-N 1 1 296.370 3.770 20 5 CHBDMO CC(C)([NH2+]CC=C(Cl)Cl)c1ccccc1[N+](=O)[O-] ZINC000852077874 1123395408 /nfs/dbraw/zinc/39/54/08/1123395408.db2.gz GDBRSOCOHYPYIE-UHFFFAOYSA-N 1 1 289.162 3.739 20 5 CHBDMO Cc1nc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000037668336 1129165624 /nfs/dbraw/zinc/16/56/24/1129165624.db2.gz FJBHABLYBIAQBN-SECBINFHSA-N 1 1 291.376 3.519 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509648561 1124133363 /nfs/dbraw/zinc/13/33/63/1124133363.db2.gz CHWCPZOVZDLKPR-AWEZNQCLSA-N 1 1 298.333 3.884 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509648561 1124133364 /nfs/dbraw/zinc/13/33/64/1124133364.db2.gz CHWCPZOVZDLKPR-AWEZNQCLSA-N 1 1 298.333 3.884 20 5 CHBDMO COc1ccc(C[N@H+]2C[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000525637972 1124450626 /nfs/dbraw/zinc/45/06/26/1124450626.db2.gz MRVFYOWGTOFCKZ-STQMWFEESA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c(F)c1 ZINC000509663741 1125419631 /nfs/dbraw/zinc/41/96/31/1125419631.db2.gz DONAOQWEEVWHMS-BONVTDFDSA-N 1 1 296.317 3.638 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)c(F)c1 ZINC000509663741 1125419634 /nfs/dbraw/zinc/41/96/34/1125419634.db2.gz DONAOQWEEVWHMS-BONVTDFDSA-N 1 1 296.317 3.638 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000739926623 1129410008 /nfs/dbraw/zinc/41/00/08/1129410008.db2.gz IQGMNCWASUFXHF-CQSZACIVSA-N 1 1 280.343 3.889 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000739926622 1129410037 /nfs/dbraw/zinc/41/00/37/1129410037.db2.gz IQGMNCWASUFXHF-AWEZNQCLSA-N 1 1 280.343 3.889 20 5 CHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169012542 1129690145 /nfs/dbraw/zinc/69/01/45/1129690145.db2.gz QXBXTIXSMMUYRF-UXLLHSPISA-N 1 1 288.391 3.577 20 5 CHBDMO CC[C@H](c1ccccc1)[N@@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169040125 1129690466 /nfs/dbraw/zinc/69/04/66/1129690466.db2.gz YAXHZEHYVCNEAN-VNQPRFMTSA-N 1 1 276.380 3.515 20 5 CHBDMO C[N@@H+](Cc1cccc2ccccc21)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169023261 1129691376 /nfs/dbraw/zinc/69/13/76/1129691376.db2.gz DVLVVPWEWHUEEV-YOEHRIQHSA-N 1 1 298.386 3.717 20 5 CHBDMO CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169048723 1129692073 /nfs/dbraw/zinc/69/20/73/1129692073.db2.gz AXLMVPHBFVVJNI-ZOBUZTSGSA-N 1 1 290.407 3.903 20 5 CHBDMO CC[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001169334339 1129719297 /nfs/dbraw/zinc/71/92/97/1129719297.db2.gz XTJLEUXQTPSSMD-HOCLYGCPSA-N 1 1 276.380 3.995 20 5 CHBDMO C[C@H](C1CCCCC1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001169734139 1129753619 /nfs/dbraw/zinc/75/36/19/1129753619.db2.gz RSAOERPZBAQUJR-CYBMUJFWSA-N 1 1 276.380 3.995 20 5 CHBDMO CC(C)[N@@H+](Cc1ccoc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000768336999 1129852039 /nfs/dbraw/zinc/85/20/39/1129852039.db2.gz FUHRHPIWRSZSCA-UHFFFAOYSA-N 1 1 274.320 3.598 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC12CCC2 ZINC000771464619 1129983046 /nfs/dbraw/zinc/98/30/46/1129983046.db2.gz POZUKPNCCJLQAR-LBPRGKRZSA-N 1 1 292.354 3.746 20 5 CHBDMO C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@H]1C ZINC001461846912 1130060397 /nfs/dbraw/zinc/06/03/97/1130060397.db2.gz CXLYGYBDLRBHCU-QWRGUYRKSA-N 1 1 282.771 3.869 20 5 CHBDMO CCc1cccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC001170195923 1130461222 /nfs/dbraw/zinc/46/12/22/1130461222.db2.gz WHVUNQKMYQNAHH-UHFFFAOYSA-N 1 1 298.386 3.832 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799193237 1131075920 /nfs/dbraw/zinc/07/59/20/1131075920.db2.gz MFESSYTUKCUMPJ-KGLIPLIRSA-N 1 1 297.358 3.540 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1C ZINC000816648859 1131120895 /nfs/dbraw/zinc/12/08/95/1131120895.db2.gz QCEQSVUZROAMKV-VXGBXAGGSA-N 1 1 286.331 3.695 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccns1 ZINC000716015242 1132008502 /nfs/dbraw/zinc/00/85/02/1132008502.db2.gz PKSPOQWIRVBSIR-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCO[C@@H]2C[C@@H]21 ZINC001141728142 1132241880 /nfs/dbraw/zinc/24/18/80/1132241880.db2.gz NHASEEKMGNJMMH-VQTJNVASSA-N 1 1 289.378 3.966 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@](C)(F)C1 ZINC001173221385 1132411868 /nfs/dbraw/zinc/41/18/68/1132411868.db2.gz HWZZSYPPQUDEEH-XJKSGUPXSA-N 1 1 294.370 3.740 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@H](C)C1 ZINC001173226050 1132412793 /nfs/dbraw/zinc/41/27/93/1132412793.db2.gz KXAXSWUDWPDTLK-KBPBESRZSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC(F)(F)CC1 ZINC001173228927 1132412911 /nfs/dbraw/zinc/41/29/11/1132412911.db2.gz NSHYUCTUIZHGPS-GFCCVEGCSA-N 1 1 298.333 3.647 20 5 CHBDMO CC(C)[C@@H]1CCC[N@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230995 1132413714 /nfs/dbraw/zinc/41/37/14/1132413714.db2.gz IBGJWAJHBUDISM-CJNGLKHVSA-N 1 1 276.380 3.646 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173235408 1132414898 /nfs/dbraw/zinc/41/48/98/1132414898.db2.gz WSAJJNBAMKFIAF-DZGCQCFKSA-N 1 1 276.380 3.790 20 5 CHBDMO Cc1ccc(C)c(Nc2cc([N+](=O)[O-])ccc2C)[nH+]1 ZINC001211287197 1134402932 /nfs/dbraw/zinc/40/29/32/1134402932.db2.gz GROQRWBPROLPQS-UHFFFAOYSA-N 1 1 257.293 3.659 20 5 CHBDMO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000176444851 1134470061 /nfs/dbraw/zinc/47/00/61/1134470061.db2.gz VTFXQNQCNDTBBF-SNVBAGLBSA-N 1 1 296.417 3.781 20 5 CHBDMO CC(C)[N@H+]1CCC[C@@H](O[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC001223428017 1135345097 /nfs/dbraw/zinc/34/50/97/1135345097.db2.gz YSSXLPJBVAOMDR-CZUORRHYSA-N 1 1 292.379 3.545 20 5 CHBDMO C[N@H+]1CCC[C@@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001226992500 1135772421 /nfs/dbraw/zinc/77/24/21/1135772421.db2.gz KVHBWRZRWNGRBS-CQSZACIVSA-N 1 1 292.382 3.861 20 5 CHBDMO CC1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000336839504 335049646 /nfs/dbraw/zinc/04/96/46/335049646.db2.gz OSJFZGMNLMVTET-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1c(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000519968897 260035536 /nfs/dbraw/zinc/03/55/36/260035536.db2.gz UFZFOHOFEHLEQK-SWLSCSKDSA-N 1 1 276.380 3.914 20 5 CHBDMO C[C@H]([NH2+]Cc1ccccc1F)c1ccccc1[N+](=O)[O-] ZINC000020526074 171239112 /nfs/dbraw/zinc/23/91/12/171239112.db2.gz VNACLQBMQSHEDE-NSHDSACASA-N 1 1 274.295 3.585 20 5 CHBDMO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccccc1[N+](=O)[O-] ZINC000020526284 171239321 /nfs/dbraw/zinc/23/93/21/171239321.db2.gz AFMOFTMRAQXSGV-RISCZKNCSA-N 1 1 286.331 3.916 20 5 CHBDMO Cc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000347388957 226144623 /nfs/dbraw/zinc/14/46/23/226144623.db2.gz UKWRHUKWMYEBKV-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1cccc([N+](=O)[O-])c1 ZINC000037495499 260112399 /nfs/dbraw/zinc/11/23/99/260112399.db2.gz GNDDJDLKHUJLBD-VIFPVBQESA-N 1 1 280.711 3.692 20 5 CHBDMO COc1cccc([C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)c1 ZINC000037771517 260116370 /nfs/dbraw/zinc/11/63/70/260116370.db2.gz YJQPNTJMRPTAGM-JTQLQIEISA-N 1 1 292.360 3.516 20 5 CHBDMO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000080273521 260179599 /nfs/dbraw/zinc/17/95/99/260179599.db2.gz MOWNQRYNIYURAD-WDEREUQCSA-N 1 1 291.376 3.772 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000411697401 262704350 /nfs/dbraw/zinc/70/43/50/262704350.db2.gz RKZQKSGRXVGQAB-QZTJIDSGSA-N 1 1 296.370 3.625 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000534331906 328046648 /nfs/dbraw/zinc/04/66/48/328046648.db2.gz OUAQJFVEWJPINV-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000534331906 328046650 /nfs/dbraw/zinc/04/66/50/328046650.db2.gz OUAQJFVEWJPINV-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)C(C)(C)C)cc1[N+](=O)[O-] ZINC000534349896 328047574 /nfs/dbraw/zinc/04/75/74/328047574.db2.gz TYRYPIPPVLYICI-LBPRGKRZSA-N 1 1 264.369 3.770 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc2C1 ZINC000303512434 328352728 /nfs/dbraw/zinc/35/27/28/328352728.db2.gz BOKDKNRIWOCWDL-SFHVURJKSA-N 1 1 296.370 3.584 20 5 CHBDMO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccccc1[N+](=O)[O-] ZINC000111405501 328354571 /nfs/dbraw/zinc/35/45/71/328354571.db2.gz RNCUQXPKJAQCPJ-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532038688 328396927 /nfs/dbraw/zinc/39/69/27/328396927.db2.gz XUCGICOLXWAWFJ-GOSISDBHSA-N 1 1 296.370 3.758 20 5 CHBDMO C[N@H+](C/C=C\c1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000558737086 327118452 /nfs/dbraw/zinc/11/84/52/327118452.db2.gz WZHJJZJUCZQUJC-POHAHGRESA-N 1 1 296.370 3.783 20 5 CHBDMO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])o1 ZINC000048068859 327277244 /nfs/dbraw/zinc/27/72/44/327277244.db2.gz FHKHCQPBJKHZBB-SMDDNHRTSA-N 1 1 286.331 3.601 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000433035691 330128480 /nfs/dbraw/zinc/12/84/80/330128480.db2.gz NRGAOLBONJSEKA-RISCZKNCSA-N 1 1 262.353 3.524 20 5 CHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ccoc3)o2)cc1 ZINC000171050660 330847675 /nfs/dbraw/zinc/84/76/75/330847675.db2.gz PSUKNSLTUQYMSD-UHFFFAOYSA-N 1 1 298.298 3.738 20 5 CHBDMO Cc1c(C[N@H+]2C[C@@H](C)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000464815902 331369323 /nfs/dbraw/zinc/36/93/23/331369323.db2.gz VIWAXFUZDCPGQG-RYUDHWBXSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H]1CC[C@H](C)C[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000464822215 331369867 /nfs/dbraw/zinc/36/98/67/331369867.db2.gz KXGIUFYLDKHJPN-WDEREUQCSA-N 1 1 282.771 3.869 20 5 CHBDMO CCSCC[C@H](C)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000464856936 331371486 /nfs/dbraw/zinc/37/14/86/331371486.db2.gz MZGSJBROOSATMV-ZDUSSCGKSA-N 1 1 296.436 3.601 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CC(C)(C)C ZINC000489142078 332042108 /nfs/dbraw/zinc/04/21/08/332042108.db2.gz UVGUAEXOOWXDCC-LBPRGKRZSA-N 1 1 264.369 3.942 20 5 CHBDMO COc1cc(C[N@@H+](C(C)C)C2CCCC2)ccc1[N+](=O)[O-] ZINC000490006781 332076357 /nfs/dbraw/zinc/07/63/57/332076357.db2.gz UPNGUIHQBCYQPC-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO CCCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000490823266 332118049 /nfs/dbraw/zinc/11/80/49/332118049.db2.gz SNWXEOVXLIOYBT-UHFFFAOYSA-N 1 1 262.353 3.749 20 5 CHBDMO CC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(C)cc1 ZINC000521221586 333115531 /nfs/dbraw/zinc/11/55/31/333115531.db2.gz MINSJTLTYVWNIS-UHFFFAOYSA-N 1 1 290.388 3.987 20 5 CHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccc(C)cc1 ZINC000521221586 333115532 /nfs/dbraw/zinc/11/55/32/333115532.db2.gz MINSJTLTYVWNIS-UHFFFAOYSA-N 1 1 290.388 3.987 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000522046688 333231599 /nfs/dbraw/zinc/23/15/99/333231599.db2.gz DWXOHDHFIUCIPT-AAEUAGOBSA-N 1 1 262.353 3.524 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000522268114 333277023 /nfs/dbraw/zinc/27/70/23/333277023.db2.gz QZCOESKULBKTHR-QGZVFWFLSA-N 1 1 296.370 3.584 20 5 CHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522466260 333287408 /nfs/dbraw/zinc/28/74/08/333287408.db2.gz IGCYBEARAOFYAP-RHSMWYFYSA-N 1 1 296.370 3.973 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000523854390 333348091 /nfs/dbraw/zinc/34/80/91/333348091.db2.gz HYTJOPMRMVCMJK-UHFFFAOYSA-N 1 1 294.782 3.869 20 5 CHBDMO CC(C)CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000524424514 333361875 /nfs/dbraw/zinc/36/18/75/333361875.db2.gz COOQBRBUCVIDFF-UHFFFAOYSA-N 1 1 276.380 3.648 20 5 CHBDMO CCc1ccc([C@H]([NH2+]C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544362053 333926385 /nfs/dbraw/zinc/92/63/85/333926385.db2.gz FQSWSSGHPOTFDI-MRXNPFEDSA-N 1 1 286.331 3.592 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCCC[C@H]1C ZINC000548586793 334163111 /nfs/dbraw/zinc/16/31/11/334163111.db2.gz JNHRDIVDKOBTJL-CYBMUJFWSA-N 1 1 262.353 3.668 20 5 CHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000551825324 334263516 /nfs/dbraw/zinc/26/35/16/334263516.db2.gz FBRMESFVOCPZFW-CLFYSBASSA-N 1 1 274.364 3.873 20 5 CHBDMO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000130074751 522964925 /nfs/dbraw/zinc/96/49/25/522964925.db2.gz IZUAFGQADMIPNT-OAHLLOKOSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000130074751 522964936 /nfs/dbraw/zinc/96/49/36/522964936.db2.gz IZUAFGQADMIPNT-OAHLLOKOSA-N 1 1 285.347 3.573 20 5 CHBDMO COc1ccc(C[N@@H+](C)C2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000338394819 524002171 /nfs/dbraw/zinc/00/21/71/524002171.db2.gz OYZVJKYLCXEZRH-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000127437748 524451964 /nfs/dbraw/zinc/45/19/64/524451964.db2.gz FBYAVEHKJRJDKX-HNNXBMFYSA-N 1 1 285.347 3.568 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccc[nH]2)cc1[N+](=O)[O-] ZINC000127437748 524451971 /nfs/dbraw/zinc/45/19/71/524451971.db2.gz FBYAVEHKJRJDKX-HNNXBMFYSA-N 1 1 285.347 3.568 20 5 CHBDMO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000044729512 525467226 /nfs/dbraw/zinc/46/72/26/525467226.db2.gz XEBJREMWNRXNQK-LLVKDONJSA-N 1 1 274.320 3.655 20 5 CHBDMO CSC[C@@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000292353677 525652693 /nfs/dbraw/zinc/65/26/93/525652693.db2.gz HONKQYYCTMDVFB-CHWSQXEVSA-N 1 1 294.420 3.731 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(F)cn1 ZINC000147771464 1125505326 /nfs/dbraw/zinc/50/53/26/1125505326.db2.gz REIORKNZLUNDLR-WDEREUQCSA-N 1 1 289.310 3.541 20 5 CHBDMO C[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC001190661913 1122548842 /nfs/dbraw/zinc/54/88/42/1122548842.db2.gz VSOHEJCOYJFPQV-NSHDSACASA-N 1 1 282.771 3.870 20 5 CHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H](C)C(C)C ZINC000065299126 1125584727 /nfs/dbraw/zinc/58/47/27/1125584727.db2.gz OLUYLVTVCKNXLG-SNVBAGLBSA-N 1 1 256.371 3.523 20 5 CHBDMO Cc1ccc([C@@H]2CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC000885926575 1125627336 /nfs/dbraw/zinc/62/73/36/1125627336.db2.gz GAASNDKQRVQHRM-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO CC(C)[C@@H](c1ccccc1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886008615 1125635536 /nfs/dbraw/zinc/63/55/36/1125635536.db2.gz QZSQJUJOQFLRMJ-INIZCTEOSA-N 1 1 299.374 3.819 20 5 CHBDMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCCC[C@H]1c1ccccc1 ZINC000886136161 1125655258 /nfs/dbraw/zinc/65/52/58/1125655258.db2.gz HQGHLYNGLKBCPM-INIZCTEOSA-N 1 1 297.358 3.717 20 5 CHBDMO O=[N+]([O-])c1ncccc1C[N@H+]1CCCC[C@H]1c1ccccc1 ZINC000886136161 1125655259 /nfs/dbraw/zinc/65/52/59/1125655259.db2.gz HQGHLYNGLKBCPM-INIZCTEOSA-N 1 1 297.358 3.717 20 5 CHBDMO C[C@H]1C[C@H](c2ccccc2)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886205090 1125661719 /nfs/dbraw/zinc/66/17/19/1125661719.db2.gz ZLNNMXKYECYVTL-XJKSGUPXSA-N 1 1 297.358 3.573 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1F ZINC000338014153 1126711040 /nfs/dbraw/zinc/71/10/40/1126711040.db2.gz ROCZXXQTJKCXIU-MNOVXSKESA-N 1 1 289.310 3.541 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000138872009 1126747484 /nfs/dbraw/zinc/74/74/84/1126747484.db2.gz ZLGJRVIXJCIIKE-INIZCTEOSA-N 1 1 298.342 3.638 20 5 CHBDMO CCCC[N@@H+](CC)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000485143564 1126888559 /nfs/dbraw/zinc/88/85/59/1126888559.db2.gz JKDDKSCGSQYZIE-LBPRGKRZSA-N 1 1 250.342 3.778 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)C1CCCCC1 ZINC000485707088 1126944100 /nfs/dbraw/zinc/94/41/00/1126944100.db2.gz IYKDRKBJQWKBHC-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC3(CC3)C2)cc1Cl ZINC000783679335 1130846269 /nfs/dbraw/zinc/84/62/69/1130846269.db2.gz OBFIKIDALDOJDB-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CC3)C2)cc1Cl ZINC000783679335 1130846274 /nfs/dbraw/zinc/84/62/74/1130846274.db2.gz OBFIKIDALDOJDB-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccccc3)CC2)c(F)c1 ZINC000267001042 1126991592 /nfs/dbraw/zinc/99/15/92/1126991592.db2.gz HITHWNZLOWRRND-UHFFFAOYSA-N 1 1 286.306 3.513 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000028174201 1127059123 /nfs/dbraw/zinc/05/91/23/1127059123.db2.gz IORBKSFDOSMUOY-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000028174201 1127059125 /nfs/dbraw/zinc/05/91/25/1127059125.db2.gz IORBKSFDOSMUOY-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000570248420 1127082009 /nfs/dbraw/zinc/08/20/09/1127082009.db2.gz MEBPJNAPJZNBHL-KRWDZBQOSA-N 1 1 299.374 3.881 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000588978210 1127208923 /nfs/dbraw/zinc/20/89/23/1127208923.db2.gz PWHWELTWPIZTBN-LBPRGKRZSA-N 1 1 294.782 3.870 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H]1c1ccccc1 ZINC000355218368 1127325701 /nfs/dbraw/zinc/32/57/01/1127325701.db2.gz HTDDJLDHQPRIQI-DOTOQJQBSA-N 1 1 282.343 3.583 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1c1ccsc1 ZINC000046088102 1127327735 /nfs/dbraw/zinc/32/77/35/1127327735.db2.gz ZFIHAVUDJMZDDQ-AWEZNQCLSA-N 1 1 288.372 3.993 20 5 CHBDMO CC(C)[C@H]1[N@H+](Cc2csc([N+](=O)[O-])c2)CC12CC=CC2 ZINC000592529033 1127353016 /nfs/dbraw/zinc/35/30/16/1127353016.db2.gz WBMBXYNLECQLOX-CQSZACIVSA-N 1 1 292.404 3.833 20 5 CHBDMO CC(C)[C@H]1[N@@H+](Cc2csc([N+](=O)[O-])c2)CC12CC=CC2 ZINC000592529033 1127353020 /nfs/dbraw/zinc/35/30/20/1127353020.db2.gz WBMBXYNLECQLOX-CQSZACIVSA-N 1 1 292.404 3.833 20 5 CHBDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595289542 1127458142 /nfs/dbraw/zinc/45/81/42/1127458142.db2.gz UBCDVDUYBADAKB-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595289542 1127458144 /nfs/dbraw/zinc/45/81/44/1127458144.db2.gz UBCDVDUYBADAKB-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]3C[C@H]3C2)o1 ZINC000597222538 1127536749 /nfs/dbraw/zinc/53/67/49/1127536749.db2.gz FDEQLSWREIMFND-STQMWFEESA-N 1 1 298.342 3.697 20 5 CHBDMO C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])c2ccccc2O1 ZINC000295077207 1127618937 /nfs/dbraw/zinc/61/89/37/1127618937.db2.gz PWNTXSQONSKTBY-IUODEOHRSA-N 1 1 298.342 3.597 20 5 CHBDMO CCc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000295594296 1127647373 /nfs/dbraw/zinc/64/73/73/1127647373.db2.gz CHBDQODUYDMEAT-NSHDSACASA-N 1 1 274.320 3.601 20 5 CHBDMO Cc1c(C[N@H+](C)[C@H](C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000603873315 1127679553 /nfs/dbraw/zinc/67/95/53/1127679553.db2.gz LLWGTBCSOULYPZ-GFCCVEGCSA-N 1 1 264.369 3.770 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552448 1127680661 /nfs/dbraw/zinc/68/06/61/1127680661.db2.gz CYTNFEUVLZQIAK-XQQFMLRXSA-N 1 1 292.404 3.626 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(C)cc1 ZINC000604491869 1127707847 /nfs/dbraw/zinc/70/78/47/1127707847.db2.gz MASUVKHUVJKTSX-UHFFFAOYSA-N 1 1 298.386 3.968 20 5 CHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000608977263 1127896477 /nfs/dbraw/zinc/89/64/77/1127896477.db2.gz WKZSUSWFCJKPLH-CQSZACIVSA-N 1 1 284.359 3.830 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1sccc1Cl ZINC000193009428 1127907809 /nfs/dbraw/zinc/90/78/09/1127907809.db2.gz APKGXYLTVWSKNS-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000076068567 1127934240 /nfs/dbraw/zinc/93/42/40/1127934240.db2.gz GTAYCWJYTPOKQW-DZGCQCFKSA-N 1 1 294.420 3.701 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000541774614 1128038172 /nfs/dbraw/zinc/03/81/72/1128038172.db2.gz XQQPQVCICLDXRA-ZDUSSCGKSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000542049197 1128049671 /nfs/dbraw/zinc/04/96/71/1128049671.db2.gz VXCOUYCRGUQXOD-XPKDYRNWSA-N 1 1 274.364 3.605 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000470184731 1128064641 /nfs/dbraw/zinc/06/46/41/1128064641.db2.gz WNZDCHDDSDZOLQ-ZFSVZOPNSA-N 1 1 286.375 3.586 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000492788070 1128113011 /nfs/dbraw/zinc/11/30/11/1128113011.db2.gz HQSQJKIUSRRMQT-CHWSQXEVSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@@H](C)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000492788328 1128113092 /nfs/dbraw/zinc/11/30/92/1128113092.db2.gz IFNVYXNOICICCG-QWHCGFSZSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C2CC2)C1 ZINC000492785035 1128113106 /nfs/dbraw/zinc/11/31/06/1128113106.db2.gz RWKPQAQALHQXDJ-GXTWGEPZSA-N 1 1 274.364 3.696 20 5 CHBDMO CC(C)C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000493923872 1128151765 /nfs/dbraw/zinc/15/17/65/1128151765.db2.gz FPQUQEUGZMOISP-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO CC(C)C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000493923872 1128151769 /nfs/dbraw/zinc/15/17/69/1128151769.db2.gz FPQUQEUGZMOISP-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO CC1(C)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])[C@H]1C1CC1 ZINC000565984240 1128536931 /nfs/dbraw/zinc/53/69/31/1128536931.db2.gz SPRWGVDLRFMWLV-WRLNGNIRSA-N 1 1 286.375 3.728 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@H](CC2CC2)C1 ZINC000556958664 1128651837 /nfs/dbraw/zinc/65/18/37/1128651837.db2.gz JZJFWKVQMFEKTO-SJDLMVEWSA-N 1 1 286.375 3.730 20 5 CHBDMO Cc1ccc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)o1 ZINC000601153441 1128702257 /nfs/dbraw/zinc/70/22/57/1128702257.db2.gz YMTMAWGZYXWYAA-UHFFFAOYSA-N 1 1 288.347 3.909 20 5 CHBDMO CCC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(C)ccn1 ZINC000601269151 1128707446 /nfs/dbraw/zinc/70/74/46/1128707446.db2.gz XEQBFBBDICJOOT-OAHLLOKOSA-N 1 1 299.374 3.929 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000578403734 1128717001 /nfs/dbraw/zinc/71/70/01/1128717001.db2.gz RXINZOYANGBZFK-LBPRGKRZSA-N 1 1 250.342 3.605 20 5 CHBDMO C[C@@H]1CCCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609625627 1128719479 /nfs/dbraw/zinc/71/94/79/1128719479.db2.gz DTWMCPDSYRKRAB-CQSZACIVSA-N 1 1 292.379 3.628 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609631960 1128721355 /nfs/dbraw/zinc/72/13/55/1128721355.db2.gz YMYUDXVMYBYYLU-CQSZACIVSA-N 1 1 276.380 3.853 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609705381 1128722751 /nfs/dbraw/zinc/72/27/51/1128722751.db2.gz XTALTLVWLRGYFA-NSHDSACASA-N 1 1 282.771 3.870 20 5 CHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609767008 1128724356 /nfs/dbraw/zinc/72/43/56/1128724356.db2.gz FMHZGIUMPYPWNF-AWEZNQCLSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215374 1117882085 /nfs/dbraw/zinc/88/20/85/1117882085.db2.gz JIPDYLPUUDZLAQ-CHWSQXEVSA-N 1 1 262.353 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC000471168028 1117910017 /nfs/dbraw/zinc/91/00/17/1117910017.db2.gz GLPCEDFCRUFKBR-QGZVFWFLSA-N 1 1 282.343 3.584 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000430272079 1117974168 /nfs/dbraw/zinc/97/41/68/1117974168.db2.gz ZOBVCJGMLDAVPL-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@@H](C)C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000430272079 1117974172 /nfs/dbraw/zinc/97/41/72/1117974172.db2.gz ZOBVCJGMLDAVPL-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000359877465 1118008381 /nfs/dbraw/zinc/00/83/81/1118008381.db2.gz PWTGDFWOYHFRJA-SUMWQHHRSA-N 1 1 297.358 3.573 20 5 CHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000307837791 1118472187 /nfs/dbraw/zinc/47/21/87/1118472187.db2.gz RRJRIHVZLSOXTN-ZDUSSCGKSA-N 1 1 280.343 3.602 20 5 CHBDMO Cc1c(C[N@H+](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000051127553 1118643693 /nfs/dbraw/zinc/64/36/93/1118643693.db2.gz IGXUABCCWJYONO-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC2(CC2)C1 ZINC000274563995 1118929161 /nfs/dbraw/zinc/92/91/61/1118929161.db2.gz XXIGVZQSVBZMSO-GFCCVEGCSA-N 1 1 260.337 3.532 20 5 CHBDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000091959807 1118933730 /nfs/dbraw/zinc/93/37/30/1118933730.db2.gz IALPRXRJMFNUBK-NXEZZACHSA-N 1 1 289.335 3.611 20 5 CHBDMO Cc1ccc(CC[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511140873 1119098251 /nfs/dbraw/zinc/09/82/51/1119098251.db2.gz VEAPDJJBRJSHNE-UHFFFAOYSA-N 1 1 298.386 3.620 20 5 CHBDMO CCc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000150996388 1119360694 /nfs/dbraw/zinc/36/06/94/1119360694.db2.gz CJNOKXZUISQGDV-LBPRGKRZSA-N 1 1 288.347 3.909 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000583603107 1119384363 /nfs/dbraw/zinc/38/43/63/1119384363.db2.gz UUMXNDKARUPQEH-ZFWWWQNUSA-N 1 1 297.358 3.540 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC23CCCCC3)cs1 ZINC000536181704 1119448697 /nfs/dbraw/zinc/44/86/97/1119448697.db2.gz SWVZJIWMABQHAM-UHFFFAOYSA-N 1 1 280.393 3.955 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000708503115 1119501203 /nfs/dbraw/zinc/50/12/03/1119501203.db2.gz ODFMMMACYVQLPF-LBPRGKRZSA-N 1 1 280.343 3.746 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000311865463 1119571715 /nfs/dbraw/zinc/57/17/15/1119571715.db2.gz KSIZSJJTDUUPPA-JTQLQIEISA-N 1 1 268.332 3.600 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CC1CC1)C(C)C ZINC000542702481 1120123414 /nfs/dbraw/zinc/12/34/14/1120123414.db2.gz HVGQVAQABASSSX-UHFFFAOYSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@H]21 ZINC000541111792 1120148407 /nfs/dbraw/zinc/14/84/07/1120148407.db2.gz SLLAIUKFRXSVJR-UHOFOFEASA-N 1 1 274.364 3.605 20 5 CHBDMO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000091437164 1120172059 /nfs/dbraw/zinc/17/20/59/1120172059.db2.gz DAAHKBFQOMWELW-ZJUUUORDSA-N 1 1 289.335 3.611 20 5 CHBDMO Cc1ncc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000047258863 1120644759 /nfs/dbraw/zinc/64/47/59/1120644759.db2.gz WZZKSEQYKSVGOQ-SNVBAGLBSA-N 1 1 291.376 3.553 20 5 CHBDMO Cc1ncc(C[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000047258863 1120644760 /nfs/dbraw/zinc/64/47/60/1120644760.db2.gz WZZKSEQYKSVGOQ-SNVBAGLBSA-N 1 1 291.376 3.553 20 5 CHBDMO CC(C)C[C@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001167897129 1121257264 /nfs/dbraw/zinc/25/72/64/1121257264.db2.gz DRCDFFUTNMRCKV-OAHLLOKOSA-N 1 1 276.380 3.995 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000500501388 1121288683 /nfs/dbraw/zinc/28/86/83/1121288683.db2.gz MCVMNUGCPVMWGQ-INIZCTEOSA-N 1 1 276.380 3.648 20 5 CHBDMO Cc1ccsc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000549808640 1121452178 /nfs/dbraw/zinc/45/21/78/1121452178.db2.gz VHKXEVIEWKVACJ-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000509377980 1121558978 /nfs/dbraw/zinc/55/89/78/1121558978.db2.gz GZKWOTGRBCCWCN-XOVSCCBYSA-N 1 1 262.353 3.586 20 5 CHBDMO CCC(CC)C[N@@H+](CC)CCc1ccc([N+](=O)[O-])cc1 ZINC000512774055 1121590804 /nfs/dbraw/zinc/59/08/04/1121590804.db2.gz VRKUPGHEZHQMOW-UHFFFAOYSA-N 1 1 278.396 3.895 20 5 CHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000466743437 1121595848 /nfs/dbraw/zinc/59/58/48/1121595848.db2.gz LPIPNJFNRIDCFM-GFCCVEGCSA-N 1 1 280.343 3.602 20 5 CHBDMO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1ccccc1[N+](=O)[O-] ZINC000619611489 1128999614 /nfs/dbraw/zinc/99/96/14/1128999614.db2.gz IXPAZOIGOPGELL-WFASDCNBSA-N 1 1 297.358 3.718 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C)[C@H](F)C1 ZINC000611516985 1121654254 /nfs/dbraw/zinc/65/42/54/1121654254.db2.gz QLRXZECDDVRUCY-SLEUVZQESA-N 1 1 280.343 3.644 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C)[C@H](F)C1 ZINC000611516985 1121654257 /nfs/dbraw/zinc/65/42/57/1121654257.db2.gz QLRXZECDDVRUCY-SLEUVZQESA-N 1 1 280.343 3.644 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000619785418 1129013500 /nfs/dbraw/zinc/01/35/00/1129013500.db2.gz QYJBZZBBXPNIPV-SFHVURJKSA-N 1 1 296.370 3.757 20 5 CHBDMO C[C@H](Nc1cccc(C2CC2)[nH+]1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000822259446 1121948113 /nfs/dbraw/zinc/94/81/13/1121948113.db2.gz YDVMGZFHRFJBLJ-JTQLQIEISA-N 1 1 298.346 3.623 20 5 CHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])CC1CCCCC1 ZINC000501834538 1122014371 /nfs/dbraw/zinc/01/43/71/1122014371.db2.gz XUPHHASQWXHDCP-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505307360 1122356680 /nfs/dbraw/zinc/35/66/80/1122356680.db2.gz DSTJLOULXXIYCO-CQSZACIVSA-N 1 1 262.353 3.668 20 5 CHBDMO Cc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000434986116 1122426057 /nfs/dbraw/zinc/42/60/57/1122426057.db2.gz MPZDGTIYXTZGAQ-MRXNPFEDSA-N 1 1 282.343 3.850 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000434986116 1122426061 /nfs/dbraw/zinc/42/60/61/1122426061.db2.gz MPZDGTIYXTZGAQ-MRXNPFEDSA-N 1 1 282.343 3.850 20 5 CHBDMO CC[N@@H+](CCc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001190356618 1122534907 /nfs/dbraw/zinc/53/49/07/1122534907.db2.gz RSFDARABSLBVCP-UHFFFAOYSA-N 1 1 298.386 3.968 20 5 CHBDMO CC[C@H](C)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001190528832 1122541711 /nfs/dbraw/zinc/54/17/11/1122541711.db2.gz MQRPOJDZRJQTGP-ZDUSSCGKSA-N 1 1 264.369 3.851 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001190771099 1122555379 /nfs/dbraw/zinc/55/53/79/1122555379.db2.gz XIZQFFFDLQECHO-NSHDSACASA-N 1 1 298.333 3.884 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@H]1C1CCCC1 ZINC000505898560 1122593851 /nfs/dbraw/zinc/59/38/51/1122593851.db2.gz PYZVJMBTYRURRV-HNNXBMFYSA-N 1 1 292.354 3.889 20 5 CHBDMO Cc1ccsc1C[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506064948 1122639003 /nfs/dbraw/zinc/63/90/03/1122639003.db2.gz ZXNHPXUSRCXKIJ-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO Cc1c(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC001192481524 1122649515 /nfs/dbraw/zinc/64/95/15/1122649515.db2.gz NCVPHPDEZOWGAS-NUTKFTJISA-N 1 1 288.391 3.914 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@@H]1C ZINC001193413271 1122690371 /nfs/dbraw/zinc/69/03/71/1122690371.db2.gz MJIUBKZDGMADSN-BBRMVZONSA-N 1 1 276.380 3.995 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC001195147162 1122848971 /nfs/dbraw/zinc/84/89/71/1122848971.db2.gz KJTSRZBNKABHBE-HNNXBMFYSA-N 1 1 274.364 3.525 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507020291 1122919438 /nfs/dbraw/zinc/91/94/38/1122919438.db2.gz HHMQZBAGYQPYBH-UTSBKAFOSA-N 1 1 262.353 3.728 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000507114824 1122927464 /nfs/dbraw/zinc/92/74/64/1122927464.db2.gz CGRLDUJVDKGXBG-AWEZNQCLSA-N 1 1 262.353 3.524 20 5 CHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@@H]1c1ccccc1 ZINC000507162059 1122932405 /nfs/dbraw/zinc/93/24/05/1122932405.db2.gz UANIIZGPPHEXKL-DLBZAZTESA-N 1 1 296.370 3.830 20 5 CHBDMO C[N@@H+](Cc1cccc2cc[nH]c21)Cc1ccccc1[N+](=O)[O-] ZINC000507174849 1122936328 /nfs/dbraw/zinc/93/63/28/1122936328.db2.gz SRAJJZBRNKKXNV-UHFFFAOYSA-N 1 1 295.342 3.708 20 5 CHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000507194402 1122937527 /nfs/dbraw/zinc/93/75/27/1122937527.db2.gz FZGCYJJZWYBYCD-MRXNPFEDSA-N 1 1 296.370 3.893 20 5 CHBDMO CC(C)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000507319161 1122947623 /nfs/dbraw/zinc/94/76/23/1122947623.db2.gz OHFANYYGQNXZMC-UHFFFAOYSA-N 1 1 262.353 3.748 20 5 CHBDMO Cc1ccc(C[N@H+](CC(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000508012049 1123254968 /nfs/dbraw/zinc/25/49/68/1123254968.db2.gz CFWYSKGLACKDJW-UHFFFAOYSA-N 1 1 262.353 3.524 20 5 CHBDMO C[N@@H+](CCCF)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000895897896 1123526874 /nfs/dbraw/zinc/52/68/74/1123526874.db2.gz HIFLKIGAUZGUOW-UHFFFAOYSA-N 1 1 292.310 3.646 20 5 CHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000542631611 1129129623 /nfs/dbraw/zinc/12/96/23/1129129623.db2.gz HCKWPEGSKGIJOD-CQSZACIVSA-N 1 1 292.379 3.758 20 5 CHBDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000542631609 1129129900 /nfs/dbraw/zinc/12/99/00/1129129900.db2.gz HCKWPEGSKGIJOD-AWEZNQCLSA-N 1 1 292.379 3.758 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000519917665 1124068827 /nfs/dbraw/zinc/06/88/27/1124068827.db2.gz BVUSUJFHXWPUST-UHFFFAOYSA-N 1 1 284.359 3.925 20 5 CHBDMO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000866541318 1124080555 /nfs/dbraw/zinc/08/05/55/1124080555.db2.gz YCUNIUKKUBBWTE-GFCCVEGCSA-N 1 1 288.347 3.909 20 5 CHBDMO COc1cc(C[N@H+]2CCCCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000446063497 1124108715 /nfs/dbraw/zinc/10/87/15/1124108715.db2.gz QWWDFKXRGMJUIK-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO CC[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000446722391 1124120257 /nfs/dbraw/zinc/12/02/57/1124120257.db2.gz FLCIEXGGXBRJAM-CYBMUJFWSA-N 1 1 292.379 3.614 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000532072963 1125232521 /nfs/dbraw/zinc/23/25/21/1125232521.db2.gz AXHCTTGTWNISSM-NSHDSACASA-N 1 1 268.382 3.668 20 5 CHBDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000212970249 1125357293 /nfs/dbraw/zinc/35/72/93/1125357293.db2.gz IRYMPEBZKSADFE-ZDUSSCGKSA-N 1 1 280.343 3.889 20 5 CHBDMO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CO2 ZINC000090452335 1129295229 /nfs/dbraw/zinc/29/52/29/1129295229.db2.gz MFYVQQURUZUIES-MLGOLLRUSA-N 1 1 298.342 3.688 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(CCCC2)C1 ZINC000743864080 1129542541 /nfs/dbraw/zinc/54/25/41/1129542541.db2.gz UUNZZWYYAHSVCW-CYBMUJFWSA-N 1 1 274.364 3.922 20 5 CHBDMO CC1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000303862473 1129576296 /nfs/dbraw/zinc/57/62/96/1129576296.db2.gz GTLKAPPGUNAUKZ-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO CC(C)(C)C1=CC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC001168934464 1129684141 /nfs/dbraw/zinc/68/41/41/1129684141.db2.gz YDBSCXXPNJDYPS-UHFFFAOYSA-N 1 1 292.354 3.912 20 5 CHBDMO CC(C)(C)C1=CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC001168934464 1129684144 /nfs/dbraw/zinc/68/41/44/1129684144.db2.gz YDBSCXXPNJDYPS-UHFFFAOYSA-N 1 1 292.354 3.912 20 5 CHBDMO CCCC[N@@H+](Cc1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169030251 1129690626 /nfs/dbraw/zinc/69/06/26/1129690626.db2.gz XJUBTDQGFYXXBO-DLBZAZTESA-N 1 1 290.407 3.734 20 5 CHBDMO CC[C@H]1CCCC[C@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001169334338 1129718833 /nfs/dbraw/zinc/71/88/33/1129718833.db2.gz XTJLEUXQTPSSMD-GOEBONIOSA-N 1 1 276.380 3.995 20 5 CHBDMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC000796524675 1129773283 /nfs/dbraw/zinc/77/32/83/1129773283.db2.gz DFLCBMBAQYFGHD-ZDUSSCGKSA-N 1 1 280.343 3.744 20 5 CHBDMO CCCC[N@@H+](CC)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746656434 1130135316 /nfs/dbraw/zinc/13/53/16/1130135316.db2.gz XXQFZPGWQXGEDL-UHFFFAOYSA-N 1 1 270.760 3.870 20 5 CHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1C=CCCCCC1 ZINC001170192571 1130457227 /nfs/dbraw/zinc/45/72/27/1130457227.db2.gz AFXSKHSYSFXIFI-INIZCTEOSA-N 1 1 288.391 3.958 20 5 CHBDMO C[N@@H+](CCCCCF)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000792869070 1130503448 /nfs/dbraw/zinc/50/34/48/1130503448.db2.gz ACBBUQQYSRIEQA-UHFFFAOYSA-N 1 1 288.750 3.820 20 5 CHBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000782107228 1130755485 /nfs/dbraw/zinc/75/54/85/1130755485.db2.gz LFQHECREIDQWIP-LRDDRELGSA-N 1 1 292.354 3.746 20 5 CHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000782107230 1130755748 /nfs/dbraw/zinc/75/57/48/1130755748.db2.gz LFQHECREIDQWIP-MLGOLLRUSA-N 1 1 292.354 3.746 20 5 CHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783527033 1130834766 /nfs/dbraw/zinc/83/47/66/1130834766.db2.gz UNTQRXNKDRFKIO-CYBMUJFWSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@H](CCc1ccccc1)[N@@H+]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116330152 1131141173 /nfs/dbraw/zinc/14/11/73/1131141173.db2.gz WJIPSBBZHSHIKS-CQSZACIVSA-N 1 1 296.370 3.932 20 5 CHBDMO C[C@H](CCc1ccccc1)[N@H+]1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001116330152 1131141175 /nfs/dbraw/zinc/14/11/75/1131141175.db2.gz WJIPSBBZHSHIKS-CQSZACIVSA-N 1 1 296.370 3.932 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000844440928 1131564949 /nfs/dbraw/zinc/56/49/49/1131564949.db2.gz WUDNGKNVWGRDLW-CQSZACIVSA-N 1 1 296.317 3.524 20 5 CHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC(C)C ZINC000037111562 1131996820 /nfs/dbraw/zinc/99/68/20/1131996820.db2.gz BFHQYFGRWRMGDY-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO C[N@H+]1CC[C@@H](Oc2c3ccccc3c(O)c3ccccc32)C1 ZINC001229025666 1132001741 /nfs/dbraw/zinc/00/17/41/1132001741.db2.gz XLLSBPMAWXHODI-CYBMUJFWSA-N 1 1 293.366 3.782 20 5 CHBDMO C[C@H]1CCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909242 1132371100 /nfs/dbraw/zinc/37/11/00/1132371100.db2.gz RJXKRMMNARCDSE-BBRMVZONSA-N 1 1 288.391 3.574 20 5 CHBDMO CCC[N@@H+](CC1CC1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173226584 1132412503 /nfs/dbraw/zinc/41/25/03/1132412503.db2.gz MRACCAAZZHIDLQ-ZDUSSCGKSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1CCCC1 ZINC001173235669 1132414843 /nfs/dbraw/zinc/41/48/43/1132414843.db2.gz YKAUQLIBNRDLHL-ZDUSSCGKSA-N 1 1 276.380 3.648 20 5 CHBDMO CC(C)[N@@H+](C)Cc1ccc2ccc3cccnc3c2n1 ZINC001232219168 1132439100 /nfs/dbraw/zinc/43/91/00/1132439100.db2.gz MCPZYUWQKLOYHZ-UHFFFAOYSA-N 1 1 265.360 3.623 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C1 ZINC001232218687 1132439604 /nfs/dbraw/zinc/43/96/04/1132439604.db2.gz JYSKWHCTAVUUQV-CYBMUJFWSA-N 1 1 277.371 3.625 20 5 CHBDMO CC(C)(C)C(=[NH2+])Nc1ccc2c(cccc2[N+](=O)[O-])n1 ZINC001155181102 1132645872 /nfs/dbraw/zinc/64/58/72/1132645872.db2.gz HPNZJIKYLYWABI-UHFFFAOYSA-N 1 1 272.308 3.578 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1 ZINC001162152891 1133054380 /nfs/dbraw/zinc/05/43/80/1133054380.db2.gz JKJVHHQQVCEHAL-KBPBESRZSA-N 1 1 291.395 3.578 20 5 CHBDMO O=[N+]([O-])c1ccc(Nc2cc[nH+]c(-c3ccccc3)c2)cn1 ZINC001203566875 1133340418 /nfs/dbraw/zinc/34/04/18/1133340418.db2.gz STWKXHHERFVQKM-UHFFFAOYSA-N 1 1 292.298 3.795 20 5 CHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001205489672 1133582569 /nfs/dbraw/zinc/58/25/69/1133582569.db2.gz WVLZQHRUDVDPMW-SWLSCSKDSA-N 1 1 276.380 3.832 20 5 CHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001205489671 1133582702 /nfs/dbraw/zinc/58/27/02/1133582702.db2.gz WVLZQHRUDVDPMW-IUODEOHRSA-N 1 1 276.380 3.832 20 5 CHBDMO Cc1c(C[N@H+]2C[C@@H](C3CC3)[C@@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001205875831 1133625465 /nfs/dbraw/zinc/62/54/65/1133625465.db2.gz PNHOAPBNFIKFGD-RDJZCZTQSA-N 1 1 286.375 3.524 20 5 CHBDMO Cc1[nH+]c2c(Nc3cc([N+](=O)[O-])ccc3C)cccn2c1C ZINC001211288355 1134403808 /nfs/dbraw/zinc/40/38/08/1134403808.db2.gz RGILBFHJVHIJPU-UHFFFAOYSA-N 1 1 296.330 3.911 20 5 CHBDMO CC(C)[N@H+]1CCC[C@H](O[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001224024708 1135412035 /nfs/dbraw/zinc/41/20/35/1135412035.db2.gz KTKVZOWWGQXVPR-BBRMVZONSA-N 1 1 292.379 3.545 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC000344460645 530004462 /nfs/dbraw/zinc/00/44/62/530004462.db2.gz IYTUGASOXBOYSP-ZDUSSCGKSA-N 1 1 262.353 3.605 20 5 CHBDMO C[N@H+](Cc1cccs1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000035717315 172371662 /nfs/dbraw/zinc/37/16/62/172371662.db2.gz CZTRCQRGKSNUOW-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[N@@H+](Cc1cccs1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000035717315 172371664 /nfs/dbraw/zinc/37/16/64/172371664.db2.gz CZTRCQRGKSNUOW-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[N@H+](Cc1ccsc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000035719173 172373589 /nfs/dbraw/zinc/37/35/89/172373589.db2.gz ANVBJGQZPIEFTR-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[N@@H+](Cc1ccsc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000035719173 172373590 /nfs/dbraw/zinc/37/35/90/172373590.db2.gz ANVBJGQZPIEFTR-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO CC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1nccs1 ZINC000078004330 260167601 /nfs/dbraw/zinc/16/76/01/260167601.db2.gz ADMKAVCPIVJKGH-LBPRGKRZSA-N 1 1 291.376 3.601 20 5 CHBDMO Cc1c(Cn2c[nH+]c3c2C[C@H](C)[C@@H](C)C3)cccc1[N+](=O)[O-] ZINC000319241066 262187539 /nfs/dbraw/zinc/18/75/39/262187539.db2.gz MPJYBSWVYNYXLH-RYUDHWBXSA-N 1 1 299.374 3.519 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(Cl)cc1F ZINC000157305586 264305976 /nfs/dbraw/zinc/30/59/76/264305976.db2.gz WVNSCGOCIRJZAO-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000359293446 266561037 /nfs/dbraw/zinc/56/10/37/266561037.db2.gz FLEHWNOBCZSDNQ-XJKSGUPXSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1ccccc1[N+](=O)[O-] ZINC000271805508 328197354 /nfs/dbraw/zinc/19/73/54/328197354.db2.gz PZXASVDDQNRHRR-MNOVXSKESA-N 1 1 289.310 3.541 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532038788 328396960 /nfs/dbraw/zinc/39/69/60/328396960.db2.gz BCLCWNCHEYHANI-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO COc1ccccc1[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000037562549 326855492 /nfs/dbraw/zinc/85/54/92/326855492.db2.gz WLIGLEVTFGTYIR-SNVBAGLBSA-N 1 1 292.360 3.516 20 5 CHBDMO C[N@@H+](CCCc1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000558740173 327118466 /nfs/dbraw/zinc/11/84/66/327118466.db2.gz WSCUZGIQRYZTNW-UHFFFAOYSA-N 1 1 298.386 3.702 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@H]2c2cccn2C)cccc1[N+](=O)[O-] ZINC000079865247 330063049 /nfs/dbraw/zinc/06/30/49/330063049.db2.gz PHNHNFYMWZIGQZ-KRWDZBQOSA-N 1 1 299.374 3.579 20 5 CHBDMO CC(C)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000445436429 330342619 /nfs/dbraw/zinc/34/26/19/330342619.db2.gz RBVJCHYPCCCBOQ-QWHCGFSZSA-N 1 1 262.353 3.634 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](c2ccccc2)C1 ZINC000120184343 330386189 /nfs/dbraw/zinc/38/61/89/330386189.db2.gz QQBKLTGQXJPXMP-HNNXBMFYSA-N 1 1 282.343 3.584 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000442888905 330790620 /nfs/dbraw/zinc/79/06/20/330790620.db2.gz CFLYBXBJXFRKIG-LBPRGKRZSA-N 1 1 292.379 3.545 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H]1C(C)C ZINC000470175504 331042198 /nfs/dbraw/zinc/04/21/98/331042198.db2.gz ZBZHAUSLVKYSCM-WQMJKPAKSA-N 1 1 274.364 3.728 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464777033 331367517 /nfs/dbraw/zinc/36/75/17/331367517.db2.gz LTYFZNCYVXIPRS-MRXNPFEDSA-N 1 1 276.380 3.649 20 5 CHBDMO CC(C)[C@H]1C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CCS1 ZINC000464779744 331367828 /nfs/dbraw/zinc/36/78/28/331367828.db2.gz ZJZHMMDEWFFGRY-IUODEOHRSA-N 1 1 294.420 3.729 20 5 CHBDMO CC(C)(C)C[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000488402591 332004182 /nfs/dbraw/zinc/00/41/82/332004182.db2.gz KFGIJTHZXSMHEK-OAHLLOKOSA-N 1 1 276.380 3.995 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C2CC2)[C@H]2C=CCCC2)c1 ZINC000490043757 332078000 /nfs/dbraw/zinc/07/80/00/332078000.db2.gz KLFMSKVIIDZERL-AWEZNQCLSA-N 1 1 272.348 3.668 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CCCOC(C)C ZINC000490091339 332081223 /nfs/dbraw/zinc/08/12/23/332081223.db2.gz XDKYAWFIZSKYFD-AWEZNQCLSA-N 1 1 294.395 3.711 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000247305303 334278788 /nfs/dbraw/zinc/27/87/88/334278788.db2.gz GTJYGIXPFIYVCY-GOSISDBHSA-N 1 1 296.370 3.802 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000522268113 333276969 /nfs/dbraw/zinc/27/69/69/333276969.db2.gz QZCOESKULBKTHR-KRWDZBQOSA-N 1 1 296.370 3.584 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2C2CCCC2)cc1 ZINC000522269176 333277265 /nfs/dbraw/zinc/27/72/65/333277265.db2.gz YXLYLBLZJUYCMH-QGZVFWFLSA-N 1 1 288.391 3.792 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000523550813 333332650 /nfs/dbraw/zinc/33/26/50/333332650.db2.gz ALJOFIOCYAMEPZ-CQSZACIVSA-N 1 1 262.353 3.749 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000524609367 333368435 /nfs/dbraw/zinc/36/84/35/333368435.db2.gz VEIFKNIRXQMRMY-HNNXBMFYSA-N 1 1 276.380 3.792 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000576021256 335142378 /nfs/dbraw/zinc/14/23/78/335142378.db2.gz WSYYFIBKHHIYAU-FZSTZKMBSA-N 1 1 274.364 3.871 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000037668283 333536073 /nfs/dbraw/zinc/53/60/73/333536073.db2.gz LJSQBSMGMOHHCJ-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1c(C[N@H+]2CC[C@@H](CC3CC3)C2)cccc1[N+](=O)[O-] ZINC000550051468 334211923 /nfs/dbraw/zinc/21/19/23/334211923.db2.gz VGGSWVPSVIQAAR-AWEZNQCLSA-N 1 1 274.364 3.525 20 5 CHBDMO C[C@H]([N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000552081124 334286928 /nfs/dbraw/zinc/28/69/28/334286928.db2.gz DXNPLIMMCGYUEM-VIFPVBQESA-N 1 1 286.322 3.739 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000552081124 334286929 /nfs/dbraw/zinc/28/69/29/334286929.db2.gz DXNPLIMMCGYUEM-VIFPVBQESA-N 1 1 286.322 3.739 20 5 CHBDMO C[C@@H]([N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])C1(C)CC1 ZINC000091900338 334385820 /nfs/dbraw/zinc/38/58/20/334385820.db2.gz DSNUFLJBKYPHLY-STMXVASLSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1ccoc1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000267220440 334695785 /nfs/dbraw/zinc/69/57/85/334695785.db2.gz CXWJCOJKOWCJIJ-GFCCVEGCSA-N 1 1 274.320 3.655 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000576553057 335218245 /nfs/dbraw/zinc/21/82/45/335218245.db2.gz LPUHZNFYAQTPKW-LBPRGKRZSA-N 1 1 280.368 3.614 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](c3ccccc3)C2)cc1 ZINC000576851282 335255898 /nfs/dbraw/zinc/25/58/98/335255898.db2.gz MLSRVJWNNAZDRR-QGZVFWFLSA-N 1 1 296.370 3.974 20 5 CHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC1CCCCC1 ZINC000195669620 336058171 /nfs/dbraw/zinc/05/81/71/336058171.db2.gz HEKCLZJFHNAQFK-UHFFFAOYSA-N 1 1 276.380 3.649 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353878477 533825515 /nfs/dbraw/zinc/82/55/15/533825515.db2.gz DEXKCVKVDVTXOY-MNOVXSKESA-N 1 1 268.382 3.667 20 5 CHBDMO CO[C@]1(C)CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000280647275 521751885 /nfs/dbraw/zinc/75/18/85/521751885.db2.gz YUNRUGJUBYLTHQ-CZUORRHYSA-N 1 1 292.379 3.547 20 5 CHBDMO CCc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])o1 ZINC000291742435 523940684 /nfs/dbraw/zinc/94/06/84/523940684.db2.gz PBARDMOZCNZHEX-UHFFFAOYSA-N 1 1 288.347 3.775 20 5 CHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000339919919 524142315 /nfs/dbraw/zinc/14/23/15/524142315.db2.gz DSCAZKPFLONZNO-CMPLNLGQSA-N 1 1 268.382 3.667 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+](CCC(F)(F)F)C2CC2)cc1 ZINC000130913596 527347160 /nfs/dbraw/zinc/34/71/60/527347160.db2.gz OBMZZBXONYDBDL-UHFFFAOYSA-N 1 1 288.269 3.512 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](CCC(F)(F)F)C2CC2)cc1 ZINC000130913596 527347162 /nfs/dbraw/zinc/34/71/62/527347162.db2.gz OBMZZBXONYDBDL-UHFFFAOYSA-N 1 1 288.269 3.512 20 5 CHBDMO CC(C)c1ccc(C[N@@H+]2CCSC[C@H]2C)cc1[N+](=O)[O-] ZINC000353469687 528094525 /nfs/dbraw/zinc/09/45/25/528094525.db2.gz JCVFWFKVQUFEJZ-GFCCVEGCSA-N 1 1 294.420 3.656 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2CCSC[C@H]2C)cc1[N+](=O)[O-] ZINC000353469687 528094532 /nfs/dbraw/zinc/09/45/32/528094532.db2.gz JCVFWFKVQUFEJZ-GFCCVEGCSA-N 1 1 294.420 3.656 20 5 CHBDMO CC(C)c1ccc[nH+]c1NCc1cccc([N+](=O)[O-])c1 ZINC000341955473 535376788 /nfs/dbraw/zinc/37/67/88/535376788.db2.gz GYFHRSFGVHJQPP-UHFFFAOYSA-N 1 1 271.320 3.725 20 5 CHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000885960568 1125630514 /nfs/dbraw/zinc/63/05/14/1125630514.db2.gz NBVCRXASJNZYCO-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000886540829 1125687020 /nfs/dbraw/zinc/68/70/20/1125687020.db2.gz LNABQOLEXMUDMI-CJNGLKHVSA-N 1 1 297.358 3.573 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1cccc([N+](=O)[O-])c1 ZINC000338020066 1126711416 /nfs/dbraw/zinc/71/14/16/1126711416.db2.gz PUBRDDPNKWNHHY-MNOVXSKESA-N 1 1 289.310 3.541 20 5 CHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000482489460 1126760704 /nfs/dbraw/zinc/76/07/04/1126760704.db2.gz KJWJYVJZIUHWQI-NHYWBVRUSA-N 1 1 262.353 3.524 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000483095374 1126767551 /nfs/dbraw/zinc/76/75/51/1126767551.db2.gz AKFLKSJGNANRIT-CYBMUJFWSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182843579 1126878544 /nfs/dbraw/zinc/87/85/44/1126878544.db2.gz XDMREOYXKSRBPD-AWEZNQCLSA-N 1 1 299.374 3.881 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@H]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000485733615 1126948480 /nfs/dbraw/zinc/94/84/80/1126948480.db2.gz BMBCJBQFKPEEOI-JSGCOSHPSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1cccs1 ZINC000266460992 1126982730 /nfs/dbraw/zinc/98/27/30/1126982730.db2.gz MDKZOEXPBLFMGN-NSHDSACASA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccs1 ZINC000266460992 1126982732 /nfs/dbraw/zinc/98/27/32/1126982732.db2.gz MDKZOEXPBLFMGN-NSHDSACASA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1cccc(F)c1 ZINC000487866573 1127045019 /nfs/dbraw/zinc/04/50/19/1127045019.db2.gz HDPZVTGJRMVNFP-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccc(F)c1 ZINC000487866573 1127045022 /nfs/dbraw/zinc/04/50/22/1127045022.db2.gz HDPZVTGJRMVNFP-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO CC(C)CC[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000042457021 1127049833 /nfs/dbraw/zinc/04/98/33/1127049833.db2.gz XSWQJSRQYXXOCL-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO CCCC[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000913064091 1127121201 /nfs/dbraw/zinc/12/12/01/1127121201.db2.gz CEHOOLZHHWNCIR-UHFFFAOYSA-N 1 1 295.364 3.561 20 5 CHBDMO CCCC[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000913064091 1127121203 /nfs/dbraw/zinc/12/12/03/1127121203.db2.gz CEHOOLZHHWNCIR-UHFFFAOYSA-N 1 1 295.364 3.561 20 5 CHBDMO CC[N@@H+](CCc1cccs1)Cc1csc([N+](=O)[O-])c1 ZINC000351658990 1127202228 /nfs/dbraw/zinc/20/22/28/1127202228.db2.gz NGQVJHIXHNBXIO-UHFFFAOYSA-N 1 1 296.417 3.782 20 5 CHBDMO CCCC[C@@H](C)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000589309137 1127218674 /nfs/dbraw/zinc/21/86/74/1127218674.db2.gz DQUYVYUQRMCHHQ-LLVKDONJSA-N 1 1 268.332 3.744 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000589309137 1127218676 /nfs/dbraw/zinc/21/86/76/1127218676.db2.gz DQUYVYUQRMCHHQ-LLVKDONJSA-N 1 1 268.332 3.744 20 5 CHBDMO CC(C)c1ccc(C[NH+]2CC3(CC(F)C3)C2)cc1[N+](=O)[O-] ZINC000590969342 1127279768 /nfs/dbraw/zinc/27/97/68/1127279768.db2.gz WZMKWURUCUQYFN-UHFFFAOYSA-N 1 1 292.354 3.652 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]12 ZINC000058577287 1127362254 /nfs/dbraw/zinc/36/22/54/1127362254.db2.gz BDADJFSWWDQPBG-XOKHGSTOSA-N 1 1 288.391 3.995 20 5 CHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)C1 ZINC000359302888 1127457077 /nfs/dbraw/zinc/45/70/77/1127457077.db2.gz PDALCEXQNIQGRG-XJKSGUPXSA-N 1 1 274.364 3.607 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593119391 1127475151 /nfs/dbraw/zinc/47/51/51/1127475151.db2.gz XESNILICCWUTCK-SMDDNHRTSA-N 1 1 296.317 3.695 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CCC1 ZINC000360028073 1127487079 /nfs/dbraw/zinc/48/70/79/1127487079.db2.gz QHPDBYMFGPOVFJ-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H](CCF)C1 ZINC000597212106 1127533976 /nfs/dbraw/zinc/53/39/76/1127533976.db2.gz RSKQSCWYAMMDAT-ZBKLQPJUSA-N 1 1 292.354 3.680 20 5 CHBDMO C[C@@H]1c2ccccc2C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000361085664 1127537237 /nfs/dbraw/zinc/53/72/37/1127537237.db2.gz FHZNMEDCWUBTKH-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@@H]1c2ccccc2C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000361085664 1127537240 /nfs/dbraw/zinc/53/72/40/1127537240.db2.gz FHZNMEDCWUBTKH-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+]([C@@H]1C[C@@H]1c1ccccc1)CC2 ZINC000361314804 1127555917 /nfs/dbraw/zinc/55/59/17/1127555917.db2.gz SLCOROYBYXIPIY-QZTJIDSGSA-N 1 1 294.354 3.509 20 5 CHBDMO C[C@H]([NH2+]Cc1cnc(Cl)s1)c1ccc([N+](=O)[O-])cc1 ZINC000294950752 1127609887 /nfs/dbraw/zinc/60/98/87/1127609887.db2.gz ATGZISRDYOOBHQ-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000060877142 1127614773 /nfs/dbraw/zinc/61/47/73/1127614773.db2.gz KFGIJTHZXSMHEK-HNNXBMFYSA-N 1 1 276.380 3.995 20 5 CHBDMO COc1ccc(C[N@@H+]([C@H](C)C(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000061185367 1127663827 /nfs/dbraw/zinc/66/38/27/1127663827.db2.gz MVVYBQDSYSCADD-GFCCVEGCSA-N 1 1 292.379 3.612 20 5 CHBDMO Cc1c(C[N@@H+](C)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000603837845 1127673863 /nfs/dbraw/zinc/67/38/63/1127673863.db2.gz ORGMSURNIVQIDU-UHFFFAOYSA-N 1 1 276.380 3.915 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000603847295 1127676199 /nfs/dbraw/zinc/67/61/99/1127676199.db2.gz PDUKWLZXSQMMHV-UKPHBRMFSA-N 1 1 288.391 3.995 20 5 CHBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000604408733 1127703129 /nfs/dbraw/zinc/70/31/29/1127703129.db2.gz CNEHAJKKNUQQMO-UHFFFAOYSA-N 1 1 297.424 3.723 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])CC(C)(C)C1 ZINC001168423486 1127829489 /nfs/dbraw/zinc/82/94/89/1127829489.db2.gz KWXJCPVZMSTGHR-NSHDSACASA-N 1 1 280.343 3.602 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000374007184 1127870361 /nfs/dbraw/zinc/87/03/61/1127870361.db2.gz CJWZFJSKXIVTJV-GXTWGEPZSA-N 1 1 286.331 3.738 20 5 CHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1C[C@@H]1c1ccccc1 ZINC000411724238 1127871347 /nfs/dbraw/zinc/87/13/47/1127871347.db2.gz UJBSKOUMEIOKBA-SJLPKXTDSA-N 1 1 296.370 3.625 20 5 CHBDMO C[C@H](C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000608976712 1127896331 /nfs/dbraw/zinc/89/63/31/1127896331.db2.gz JGMIVFLSDZQIPS-CQSZACIVSA-N 1 1 284.359 3.830 20 5 CHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000076067343 1127931839 /nfs/dbraw/zinc/93/18/39/1127931839.db2.gz BUOSZHWXDDITOR-LSDHHAIUSA-N 1 1 294.420 3.701 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2C2CCCC2)cc1F ZINC000094774715 1127950889 /nfs/dbraw/zinc/95/08/89/1127950889.db2.gz PESPLRKUUBAJEX-HNNXBMFYSA-N 1 1 292.354 3.889 20 5 CHBDMO CC[C@H](C)C[N@@H+](CC)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774967 1127981160 /nfs/dbraw/zinc/98/11/60/1127981160.db2.gz RRFVIPCQEVRYQC-NSHDSACASA-N 1 1 268.332 3.602 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@H]2CCCC[C@@H]12 ZINC000541108998 1128008744 /nfs/dbraw/zinc/00/87/44/1128008744.db2.gz FUAOUBMWBDYHRF-WPGHFRTFSA-N 1 1 292.354 3.744 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H](C)C1CC1 ZINC000470176948 1128064947 /nfs/dbraw/zinc/06/49/47/1128064947.db2.gz ZFZILGASWFLYQI-SUIFULHWSA-N 1 1 274.364 3.728 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2CCC[C@@H]21 ZINC000470207395 1128066453 /nfs/dbraw/zinc/06/64/53/1128066453.db2.gz VPJYJULEFUBZRM-FCDYRPLESA-N 1 1 286.375 3.873 20 5 CHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC1CC1 ZINC000761510550 1128132232 /nfs/dbraw/zinc/13/22/32/1128132232.db2.gz JJRJEEVFSUPFIE-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761506004 1128132394 /nfs/dbraw/zinc/13/23/94/1128132394.db2.gz LNUQOKILWMNWKK-JTQLQIEISA-N 1 1 270.760 3.869 20 5 CHBDMO CC(C)[C@H]1CC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000493382861 1128140562 /nfs/dbraw/zinc/14/05/62/1128140562.db2.gz IWCDEHJFFGKEHV-NSHDSACASA-N 1 1 282.771 3.726 20 5 CHBDMO C[N@@H+](CCCC(C)(F)F)CCc1cccc([N+](=O)[O-])c1 ZINC000930353057 1128315633 /nfs/dbraw/zinc/31/56/33/1128315633.db2.gz FMYDNINFHUCDGH-UHFFFAOYSA-N 1 1 286.322 3.505 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000036432174 1128420729 /nfs/dbraw/zinc/42/07/29/1128420729.db2.gz VYSCDWCYCJTRNV-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000570611841 1128628014 /nfs/dbraw/zinc/62/80/14/1128628014.db2.gz ADEHSSFXVSABCO-MRXNPFEDSA-N 1 1 286.375 3.668 20 5 CHBDMO CC[C@H]1CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000430190017 1117826665 /nfs/dbraw/zinc/82/66/65/1117826665.db2.gz FFYVSEUTJCYKGF-LBPRGKRZSA-N 1 1 286.331 3.839 20 5 CHBDMO CC[C@@H]1CC[N@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000430193493 1117835062 /nfs/dbraw/zinc/83/50/62/1117835062.db2.gz FJBQNRBUSIOIIH-CYBMUJFWSA-N 1 1 262.353 3.703 20 5 CHBDMO CC[C@@H]1CC[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000430194364 1117838653 /nfs/dbraw/zinc/83/86/53/1117838653.db2.gz UQZLZBXIENKUSZ-CYBMUJFWSA-N 1 1 286.331 3.839 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000610080160 1128738163 /nfs/dbraw/zinc/73/81/63/1128738163.db2.gz JVJFFUDYFAMSTN-LBPRGKRZSA-N 1 1 280.343 3.889 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000430196160 1117846695 /nfs/dbraw/zinc/84/66/95/1117846695.db2.gz QGPUYOOKMMYNSD-INIZCTEOSA-N 1 1 298.342 3.550 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000430196160 1117846703 /nfs/dbraw/zinc/84/67/03/1117846703.db2.gz QGPUYOOKMMYNSD-INIZCTEOSA-N 1 1 298.342 3.550 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCCC[C@@H]1C ZINC000430240067 1117908777 /nfs/dbraw/zinc/90/87/77/1117908777.db2.gz CBMBWCJDINZAEM-SWLSCSKDSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001307686302 1117928845 /nfs/dbraw/zinc/92/88/45/1117928845.db2.gz SPJRODKFXSNRBZ-BONVTDFDSA-N 1 1 298.333 3.884 20 5 CHBDMO C[N@H+]1CC[C@H](Nc2nc3ccccc3c3ccccc32)C1 ZINC001167281351 1118150158 /nfs/dbraw/zinc/15/01/58/1118150158.db2.gz WHSKBZCNRKDHBB-ZDUSSCGKSA-N 1 1 277.371 3.504 20 5 CHBDMO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CO2 ZINC000090452333 1118327426 /nfs/dbraw/zinc/32/74/26/1118327426.db2.gz MFYVQQURUZUIES-BLLLJJGKSA-N 1 1 298.342 3.688 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCCC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC001167405236 1118460477 /nfs/dbraw/zinc/46/04/77/1118460477.db2.gz BDXRIJHAYXWVFN-HNNXBMFYSA-N 1 1 276.380 3.914 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC=C(c3ccco3)C2)cc1[N+](=O)[O-] ZINC000348675702 1118641745 /nfs/dbraw/zinc/64/17/45/1118641745.db2.gz RDKJWGCXEZGDBE-UHFFFAOYSA-N 1 1 298.342 3.786 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1ccc([N+](=O)[O-])cc1 ZINC000610538810 1118700634 /nfs/dbraw/zinc/70/06/34/1118700634.db2.gz VBZQYMSCQXSAJT-SECBINFHSA-N 1 1 280.711 3.692 20 5 CHBDMO OC[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000092763979 1118851017 /nfs/dbraw/zinc/85/10/17/1118851017.db2.gz NDRRVGQNPJMSPF-HNNXBMFYSA-N 1 1 291.394 3.807 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)CC1 ZINC000468148314 1118874351 /nfs/dbraw/zinc/87/43/51/1118874351.db2.gz VJCCREBXFCUBJF-CHWSQXEVSA-N 1 1 262.353 3.778 20 5 CHBDMO Cc1c(C[N@H+](C)C2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000071950417 1118980300 /nfs/dbraw/zinc/98/03/00/1118980300.db2.gz HJWHPZZSYFEQEN-UHFFFAOYSA-N 1 1 276.380 3.914 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511062926 1118996395 /nfs/dbraw/zinc/99/63/95/1118996395.db2.gz FSMDNCDQMHKILI-CQSZACIVSA-N 1 1 284.359 3.830 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1CCCCCC1 ZINC000248122428 1119318145 /nfs/dbraw/zinc/31/81/45/1119318145.db2.gz FUCMYWDGAOMSJY-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000219697806 1119511056 /nfs/dbraw/zinc/51/10/56/1119511056.db2.gz GMUQKTQWFUGXJU-WFASDCNBSA-N 1 1 262.353 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3CCCC[C@H]3C2)cc1F ZINC000250894025 1119534612 /nfs/dbraw/zinc/53/46/12/1119534612.db2.gz OEABWWHGLOXPMM-KGLIPLIRSA-N 1 1 292.354 3.746 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCSC3(CCC3)CC2)cs1 ZINC000411869797 1119799676 /nfs/dbraw/zinc/79/96/76/1119799676.db2.gz NSQXLZDJNUEFJM-UHFFFAOYSA-N 1 1 298.433 3.518 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCSC3(CCC3)CC2)cs1 ZINC000411869797 1119799678 /nfs/dbraw/zinc/79/96/78/1119799678.db2.gz NSQXLZDJNUEFJM-UHFFFAOYSA-N 1 1 298.433 3.518 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1ccc(C)c[nH+]1 ZINC000468631809 1120228705 /nfs/dbraw/zinc/22/87/05/1120228705.db2.gz MVVLNVBWIGEZJY-JYRVWZFOSA-N 1 1 283.331 3.814 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000312122486 1120309431 /nfs/dbraw/zinc/30/94/31/1120309431.db2.gz WKNHKYVZEVXEKZ-NSHDSACASA-N 1 1 268.332 3.744 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H]1CC=CCC1 ZINC000543179073 1120453170 /nfs/dbraw/zinc/45/31/70/1120453170.db2.gz WICLCHQMHWGXCR-GFCCVEGCSA-N 1 1 278.327 3.522 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000532072997 1120495923 /nfs/dbraw/zinc/49/59/23/1120495923.db2.gz WOHXTWVWGDAMRA-CYBMUJFWSA-N 1 1 292.379 3.616 20 5 CHBDMO Cc1ccc(C[N@H+](C(C)C)C2CCC2)cc1[N+](=O)[O-] ZINC000093608301 1120563828 /nfs/dbraw/zinc/56/38/28/1120563828.db2.gz ZWKPYKUMKRJCSB-UHFFFAOYSA-N 1 1 262.353 3.666 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000511855396 1120665991 /nfs/dbraw/zinc/66/59/91/1120665991.db2.gz OAPZQBQDEIWROY-YORMDBTCSA-N 1 1 286.375 3.873 20 5 CHBDMO Cc1c(C[N@@H+](C)Cc2ccsc2)cccc1[N+](=O)[O-] ZINC000051455381 1120924218 /nfs/dbraw/zinc/92/42/18/1120924218.db2.gz DTXRZZYCVBVUQI-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]2CCCC[C@@H]21 ZINC000542040499 1121156640 /nfs/dbraw/zinc/15/66/40/1121156640.db2.gz LCIRLVLNHXGBGD-RAIGVLPGSA-N 1 1 280.393 3.667 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000500495114 1121286794 /nfs/dbraw/zinc/28/67/94/1121286794.db2.gz ATXMEDJRPDBCNW-OAHLLOKOSA-N 1 1 276.380 3.914 20 5 CHBDMO CCc1ccc(C)[nH+]c1Nc1ccc(OC)c([N+](=O)[O-])c1 ZINC001176359441 1121612653 /nfs/dbraw/zinc/61/26/53/1121612653.db2.gz GZQAXTFNEPLIHA-UHFFFAOYSA-N 1 1 287.319 3.613 20 5 CHBDMO Cc1ccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000544186767 1121684039 /nfs/dbraw/zinc/68/40/39/1121684039.db2.gz IYGSHXZHDCPYJP-KRWDZBQOSA-N 1 1 296.370 3.893 20 5 CHBDMO CCc1ccc2c(c1)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC001177007614 1121704787 /nfs/dbraw/zinc/70/47/87/1121704787.db2.gz ATHSUQAASHEAOU-UHFFFAOYSA-N 1 1 296.370 3.716 20 5 CHBDMO CCc1ccc2c(c1)CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC001177007614 1121704790 /nfs/dbraw/zinc/70/47/90/1121704790.db2.gz ATHSUQAASHEAOU-UHFFFAOYSA-N 1 1 296.370 3.716 20 5 CHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000037775521 1129010855 /nfs/dbraw/zinc/01/08/55/1129010855.db2.gz QHEWBNRWRNSMGA-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@@H](Nc1cccc(C2CC2)[nH+]1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000822259449 1121948779 /nfs/dbraw/zinc/94/87/79/1121948779.db2.gz YDVMGZFHRFJBLJ-SNVBAGLBSA-N 1 1 298.346 3.623 20 5 CHBDMO CC(C)c1[nH+]ccn1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000093634127 1121984529 /nfs/dbraw/zinc/98/45/29/1121984529.db2.gz UJIWAKDCGKNQEJ-UHFFFAOYSA-N 1 1 279.727 3.616 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000501787998 1122008641 /nfs/dbraw/zinc/00/86/41/1122008641.db2.gz BWMXTCVJPCFJPS-FRRDWIJNSA-N 1 1 262.353 3.634 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000501792207 1122009869 /nfs/dbraw/zinc/00/98/69/1122009869.db2.gz CWLNPQCGLYWFAN-AGIUHOORSA-N 1 1 262.353 3.634 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000035010712 1122148199 /nfs/dbraw/zinc/14/81/99/1122148199.db2.gz CSURDDIGLGYZOY-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO CC(C)C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C(C)C ZINC000505615450 1122438269 /nfs/dbraw/zinc/43/82/69/1122438269.db2.gz ZQYLMGVJQBKPRI-UHFFFAOYSA-N 1 1 268.332 3.600 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000578053298 1122552349 /nfs/dbraw/zinc/55/23/49/1122552349.db2.gz KSGMJCMQRHSIOP-GFCCVEGCSA-N 1 1 250.342 3.605 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000516217829 1122578434 /nfs/dbraw/zinc/57/84/34/1122578434.db2.gz UEAMCNPUYJIHOL-JTQLQIEISA-N 1 1 256.371 3.667 20 5 CHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000506220217 1122697935 /nfs/dbraw/zinc/69/79/35/1122697935.db2.gz VAEDHLRDBZZDCI-JSGCOSHPSA-N 1 1 262.353 3.605 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426524700 1122812874 /nfs/dbraw/zinc/81/28/74/1122812874.db2.gz PNQPWWYAGKGMAB-MFKMUULPSA-N 1 1 280.755 3.623 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H]1CC1(C)C ZINC000426569507 1122824166 /nfs/dbraw/zinc/82/41/66/1122824166.db2.gz AVTREXFKFFIJSA-LDCOFTPGSA-N 1 1 274.364 3.728 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@@H](C)[C@H]1C ZINC001195277902 1122860256 /nfs/dbraw/zinc/86/02/56/1122860256.db2.gz HDJRJOXALBBZSU-FDYHWXHSSA-N 1 1 262.353 3.632 20 5 CHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCC[C@H]1C(C)(C)C ZINC001195279152 1122860690 /nfs/dbraw/zinc/86/06/90/1122860690.db2.gz NAKHHFBUDJJEIB-ZIAGYGMSSA-N 1 1 291.395 3.636 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426822128 1122918462 /nfs/dbraw/zinc/91/84/62/1122918462.db2.gz ZZFLYCVNWQJXRZ-TXEJJXNPSA-N 1 1 294.782 3.870 20 5 CHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC(C)C ZINC000507116751 1122925268 /nfs/dbraw/zinc/92/52/68/1122925268.db2.gz RIUPPIWQHCWICQ-CLFYSBASSA-N 1 1 262.353 3.586 20 5 CHBDMO CCC1(CC)CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001197515149 1122958145 /nfs/dbraw/zinc/95/81/45/1122958145.db2.gz YYIXSOSZSMEKLT-UHFFFAOYSA-N 1 1 292.379 3.628 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000507672219 1122983122 /nfs/dbraw/zinc/98/31/22/1122983122.db2.gz JJJDTYTVLITASG-INIZCTEOSA-N 1 1 296.370 3.659 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@@H]3CCC[C@H]32)cccc1[N+](=O)[O-] ZINC000441432672 1123116852 /nfs/dbraw/zinc/11/68/52/1123116852.db2.gz FBGVBRHDFBIHML-XJKSGUPXSA-N 1 1 274.364 3.668 20 5 CHBDMO CC(C)([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000507909507 1123247158 /nfs/dbraw/zinc/24/71/58/1123247158.db2.gz RGSMTEWUIPUOQK-UHFFFAOYSA-N 1 1 288.322 3.759 20 5 CHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCC2(CCCC2)C1 ZINC000851791089 1123380987 /nfs/dbraw/zinc/38/09/87/1123380987.db2.gz SSJWPBHBMGDFIE-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)nc1 ZINC000930235897 1123403688 /nfs/dbraw/zinc/40/36/88/1123403688.db2.gz RSLGJYDHLPKERZ-QWRGUYRKSA-N 1 1 289.310 3.541 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCC12CCC2 ZINC000446837114 1124124874 /nfs/dbraw/zinc/12/48/74/1124124874.db2.gz XWSIYIVAAPHCKV-XVNBXDOJSA-N 1 1 272.348 3.627 20 5 CHBDMO C[C@@H]1C[C@H](C)[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000526989370 1124538351 /nfs/dbraw/zinc/53/83/51/1124538351.db2.gz RJJNPOQMJYPHJJ-TXEJJXNPSA-N 1 1 286.331 3.838 20 5 CHBDMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774966 1129451658 /nfs/dbraw/zinc/45/16/58/1129451658.db2.gz RRFVIPCQEVRYQC-LLVKDONJSA-N 1 1 268.332 3.602 20 5 CHBDMO CC[N@@H+](Cc1cccc(Cl)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169042787 1129690726 /nfs/dbraw/zinc/69/07/26/1129690726.db2.gz FSCBNWDRFPANNW-UKRRQHHQSA-N 1 1 296.798 3.607 20 5 CHBDMO C[N@@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C1CCC(C(C)(C)C)CC1 ZINC001169036348 1129690739 /nfs/dbraw/zinc/69/07/39/1129690739.db2.gz FRBHNRGECUFPBK-LBDPXKHJSA-N 1 1 296.455 3.969 20 5 CHBDMO CC[C@H](c1ccccc1)[N@@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169040122 1129690901 /nfs/dbraw/zinc/69/09/01/1129690901.db2.gz YAXHZEHYVCNEAN-CWRNSKLLSA-N 1 1 276.380 3.515 20 5 CHBDMO C[N@@H+](Cc1ccc2ccccc2c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046786 1129691308 /nfs/dbraw/zinc/69/13/08/1129691308.db2.gz NANWOJCGYNPXLE-MAUKXSAKSA-N 1 1 298.386 3.717 20 5 CHBDMO CC(C)[N@@H+]([C@@H](C)c1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169048720 1129692080 /nfs/dbraw/zinc/69/20/80/1129692080.db2.gz AXLMVPHBFVVJNI-UXLLHSPISA-N 1 1 290.407 3.903 20 5 CHBDMO Cc1ccccc1[C@H]1CCC[N@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169055870 1129693264 /nfs/dbraw/zinc/69/32/64/1129693264.db2.gz QXBXTIXSMMUYRF-YQQAZPJKSA-N 1 1 288.391 3.577 20 5 CHBDMO C[C@@H](C1CCCCC1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001169734140 1129753421 /nfs/dbraw/zinc/75/34/21/1129753421.db2.gz RSAOERPZBAQUJR-ZDUSSCGKSA-N 1 1 276.380 3.995 20 5 CHBDMO C[C@@]1(O)CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769543390 1129916871 /nfs/dbraw/zinc/91/68/71/1129916871.db2.gz OTZOJZVFPGBVJD-HXUWFJFHSA-N 1 1 291.394 3.950 20 5 CHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801517199 1129923794 /nfs/dbraw/zinc/92/37/94/1129923794.db2.gz BHFVYVKSCQFPDI-RYUDHWBXSA-N 1 1 280.343 3.744 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCCC1 ZINC000801522596 1129924576 /nfs/dbraw/zinc/92/45/76/1129924576.db2.gz WCSICERPGFQSLY-UHFFFAOYSA-N 1 1 280.343 3.887 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C[C@@H]1CC=CCC1 ZINC000801539781 1129925806 /nfs/dbraw/zinc/92/58/06/1129925806.db2.gz PSUGUWRCFNXZNK-GFCCVEGCSA-N 1 1 278.327 3.522 20 5 CHBDMO CC(C)[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC1CCC1 ZINC000769929508 1129932811 /nfs/dbraw/zinc/93/28/11/1129932811.db2.gz ZOZNQGLBCRZRTN-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO NC(=[NH+]OCc1ccc([N+](=O)[O-])cc1)C1CCCCCC1 ZINC000746566739 1130068561 /nfs/dbraw/zinc/06/85/61/1130068561.db2.gz URBUJXBLYQZROS-UHFFFAOYSA-N 1 1 291.351 3.564 20 5 CHBDMO COc1ccc(C[C@H](C)[N@@H+](C)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC001170348565 1130486993 /nfs/dbraw/zinc/48/69/93/1130486993.db2.gz YMSUAOPMDHNZQO-LBPRGKRZSA-N 1 1 294.395 3.512 20 5 CHBDMO Cc1sccc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000815130282 1130958661 /nfs/dbraw/zinc/95/86/61/1130958661.db2.gz ZGRSRJLQXHRSCC-UHFFFAOYSA-N 1 1 296.779 3.908 20 5 CHBDMO C[N@H+]1CCCC[C@H]1CCOc1ccc([N+](=O)[O-])cc1Cl ZINC000798213013 1131030161 /nfs/dbraw/zinc/03/01/61/1131030161.db2.gz HVHGHKKSSFNUQV-NSHDSACASA-N 1 1 298.770 3.501 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001115984278 1131124325 /nfs/dbraw/zinc/12/43/25/1131124325.db2.gz NGIGNZUCSHERGD-OLZOCXBDSA-N 1 1 292.354 3.746 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC2(CCC2)C1 ZINC000348177020 1131899758 /nfs/dbraw/zinc/89/97/58/1131899758.db2.gz GUIPKYRGGFSZFD-CYBMUJFWSA-N 1 1 274.364 3.922 20 5 CHBDMO CC[C@H](C)[N@@H+](CC)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001171916484 1132109359 /nfs/dbraw/zinc/10/93/59/1132109359.db2.gz MIHFCDRDZBJQEH-LBPRGKRZSA-N 1 1 250.342 3.524 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@H]1O ZINC001141722573 1132240082 /nfs/dbraw/zinc/24/00/82/1132240082.db2.gz DJYUKWPQOBGLPU-VBKZILBWSA-N 1 1 291.394 3.806 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)C[C@@H]1C ZINC001173227604 1132412280 /nfs/dbraw/zinc/41/22/80/1132412280.db2.gz RFTMWBBNKNTULO-RDBSUJKOSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)C[C@H]1C ZINC001173227603 1132412674 /nfs/dbraw/zinc/41/26/74/1132412674.db2.gz RFTMWBBNKNTULO-MGPQQGTHSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC(F)(F)CC1 ZINC001173228929 1132412730 /nfs/dbraw/zinc/41/27/30/1132412730.db2.gz NSHYUCTUIZHGPS-LBPRGKRZSA-N 1 1 298.333 3.647 20 5 CHBDMO O=[N+]([O-])c1ccc(Nc2cccc3cc[nH+]cc32)cc1 ZINC001174478681 1132882597 /nfs/dbraw/zinc/88/25/97/1132882597.db2.gz VOUQUWSRGLTLEU-UHFFFAOYSA-N 1 1 265.272 3.887 20 5 CHBDMO Cc1[nH+]c2c(Nc3ccc(C)c([N+](=O)[O-])c3)cccn2c1C ZINC001213666020 1134476188 /nfs/dbraw/zinc/47/61/88/1134476188.db2.gz XHWXZTOUQVWTNN-UHFFFAOYSA-N 1 1 296.330 3.911 20 5 CHBDMO CC[C@@]1(C)CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353688938 529524078 /nfs/dbraw/zinc/52/40/78/529524078.db2.gz PIMJRBXRUZSJGE-ZDUSSCGKSA-N 1 1 268.382 3.668 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353688938 529524081 /nfs/dbraw/zinc/52/40/81/529524081.db2.gz PIMJRBXRUZSJGE-ZDUSSCGKSA-N 1 1 268.382 3.668 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)cs1 ZINC000353897344 226808491 /nfs/dbraw/zinc/80/84/91/226808491.db2.gz HXLTZPFZBDMKHE-OAHLLOKOSA-N 1 1 292.404 3.979 20 5 CHBDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000353657914 228140753 /nfs/dbraw/zinc/14/07/53/228140753.db2.gz VFHYDXQYHKPLFT-ZDUSSCGKSA-N 1 1 282.343 3.542 20 5 CHBDMO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000080273531 260179890 /nfs/dbraw/zinc/17/98/90/260179890.db2.gz MOWNQRYNIYURAD-MNOVXSKESA-N 1 1 291.376 3.772 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1c1cccs1 ZINC000015301423 260362549 /nfs/dbraw/zinc/36/25/49/260362549.db2.gz WMUBNOHUPRYFKD-CQSZACIVSA-N 1 1 288.372 3.993 20 5 CHBDMO C[C@@H](CNc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000301228834 261331637 /nfs/dbraw/zinc/33/16/37/261331637.db2.gz DIFMNFAWCKRBGC-AWEZNQCLSA-N 1 1 299.374 3.527 20 5 CHBDMO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)o1 ZINC000048327093 328051727 /nfs/dbraw/zinc/05/17/27/328051727.db2.gz INFCYQQFYITNDL-NHYWBVRUSA-N 1 1 286.331 3.601 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000569533795 327194565 /nfs/dbraw/zinc/19/45/65/327194565.db2.gz OXWLETRKDPMYEP-NSHDSACASA-N 1 1 298.358 3.753 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc2ccccc2o1 ZINC000048068848 327277345 /nfs/dbraw/zinc/27/73/45/327277345.db2.gz OGAPTIQWUKEELN-UHFFFAOYSA-N 1 1 282.299 3.631 20 5 CHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccn1 ZINC000179605920 329210354 /nfs/dbraw/zinc/21/03/54/329210354.db2.gz MVIIBZUMECXLQD-CLFYSBASSA-N 1 1 297.358 3.525 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000079601930 330249109 /nfs/dbraw/zinc/24/91/09/330249109.db2.gz PIMGUSJGOZPDRN-JTQLQIEISA-N 1 1 268.382 3.665 20 5 CHBDMO CC(C)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000445436427 330342695 /nfs/dbraw/zinc/34/26/95/330342695.db2.gz RBVJCHYPCCCBOQ-CHWSQXEVSA-N 1 1 262.353 3.634 20 5 CHBDMO Cc1cnc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000122937472 330432992 /nfs/dbraw/zinc/43/29/92/330432992.db2.gz GMRDKQGSHPCSDN-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCCF)C2)cc1 ZINC000451543727 331033541 /nfs/dbraw/zinc/03/35/41/331033541.db2.gz CIUABEJMJCVGOR-CQSZACIVSA-N 1 1 280.343 3.524 20 5 CHBDMO Cc1ccccc1C[C@H](C)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000489073900 332040447 /nfs/dbraw/zinc/04/04/47/332040447.db2.gz LRLYYCIBOBXYSC-HNNXBMFYSA-N 1 1 298.386 3.966 20 5 CHBDMO CC[C@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490010394 332076568 /nfs/dbraw/zinc/07/65/68/332076568.db2.gz BCSNTBOEMISIJV-OLZOCXBDSA-N 1 1 262.353 3.696 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490056126 332079071 /nfs/dbraw/zinc/07/90/71/332079071.db2.gz DVDHVURQDAGVGC-CQSZACIVSA-N 1 1 292.379 3.758 20 5 CHBDMO CC[C@H]1C[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCS1 ZINC000490088538 332080870 /nfs/dbraw/zinc/08/08/70/332080870.db2.gz OWZRDLMMELKVNA-JSGCOSHPSA-N 1 1 294.420 3.792 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000490084240 332080907 /nfs/dbraw/zinc/08/09/07/332080907.db2.gz IKPNQZUUPIJFJP-DFBGVHRSSA-N 1 1 274.364 3.552 20 5 CHBDMO CCC(CC)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000517124054 333092981 /nfs/dbraw/zinc/09/29/81/333092981.db2.gz KUBRWUSJMUAQOO-UHFFFAOYSA-N 1 1 292.379 3.627 20 5 CHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522466262 333287379 /nfs/dbraw/zinc/28/73/79/333287379.db2.gz IGCYBEARAOFYAP-YOEHRIQHSA-N 1 1 296.370 3.973 20 5 CHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000523702136 333340215 /nfs/dbraw/zinc/34/02/15/333340215.db2.gz UZKAOHZPXLBTOK-SFHVURJKSA-N 1 1 296.370 3.757 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]([C@H](C)C1CC1)C1CC1 ZINC000546705345 334047246 /nfs/dbraw/zinc/04/72/46/334047246.db2.gz QRMAFDOMHDMKRC-GFCCVEGCSA-N 1 1 274.364 3.666 20 5 CHBDMO Cc1cnc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000135158956 334118166 /nfs/dbraw/zinc/11/81/66/334118166.db2.gz RHDKOEPMYQDXAX-WDEREUQCSA-N 1 1 291.376 3.772 20 5 CHBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000081598489 334198839 /nfs/dbraw/zinc/19/88/39/334198839.db2.gz SZAXPCWZHBHQGB-LBPRGKRZSA-N 1 1 290.388 3.719 20 5 CHBDMO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCC[C@H]21 ZINC000550444429 334222746 /nfs/dbraw/zinc/22/27/46/334222746.db2.gz VKFSCVIINCJXFI-CABCVRRESA-N 1 1 274.364 3.605 20 5 CHBDMO Cc1ccc(F)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000553967937 334404313 /nfs/dbraw/zinc/40/43/13/334404313.db2.gz DYTRVTAWOFEYFZ-LBPRGKRZSA-N 1 1 288.322 3.893 20 5 CHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000195670011 336058094 /nfs/dbraw/zinc/05/80/94/336058094.db2.gz OKKHOSUIYOCYDE-XJKSGUPXSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000381386865 336061045 /nfs/dbraw/zinc/06/10/45/336061045.db2.gz LVAUVDLMQIQQPN-NHYWBVRUSA-N 1 1 280.343 3.744 20 5 CHBDMO COc1cc(C[N@@H+](C)C2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000351972028 533781369 /nfs/dbraw/zinc/78/13/69/533781369.db2.gz ZEVQXEYWNFKXCO-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1ccoc1 ZINC000351978739 534346478 /nfs/dbraw/zinc/34/64/78/534346478.db2.gz YZHKFIWIIHFIIZ-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1ccoc1 ZINC000351978739 534346486 /nfs/dbraw/zinc/34/64/86/534346486.db2.gz YZHKFIWIIHFIIZ-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO CC[C@@H]([NH2+]Cc1csc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000041010491 522893146 /nfs/dbraw/zinc/89/31/46/522893146.db2.gz FRNYULRSJNWFAA-CQSZACIVSA-N 1 1 291.376 3.601 20 5 CHBDMO CO[C@@]1(C)CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000280647268 523809925 /nfs/dbraw/zinc/80/99/25/523809925.db2.gz YUNRUGJUBYLTHQ-BBRMVZONSA-N 1 1 292.379 3.547 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289687898 526084222 /nfs/dbraw/zinc/08/42/22/526084222.db2.gz GUMNJFRGMQRDEA-WDEREUQCSA-N 1 1 284.306 3.633 20 5 CHBDMO CCS[C@H]1CCCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000353584528 529225487 /nfs/dbraw/zinc/22/54/87/529225487.db2.gz HTZWLYKVTRUXNW-AWEZNQCLSA-N 1 1 294.420 3.702 20 5 CHBDMO CC(C)[N@@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000077269756 1119191474 /nfs/dbraw/zinc/19/14/74/1119191474.db2.gz OATJHORNAPKUCN-UHFFFAOYSA-N 1 1 290.285 3.758 20 5 CHBDMO CC(C)[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CCCCC1 ZINC000886060131 1125643365 /nfs/dbraw/zinc/64/33/65/1125643365.db2.gz VKWGCAYHSHPRFV-UHFFFAOYSA-N 1 1 277.368 3.533 20 5 CHBDMO Cc1cccc(N[C@@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000614976510 1125703153 /nfs/dbraw/zinc/70/31/53/1125703153.db2.gz DQAULYFOGBLSHV-MRXNPFEDSA-N 1 1 297.358 3.502 20 5 CHBDMO CC(C)SCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000338285491 1126731573 /nfs/dbraw/zinc/73/15/73/1126731573.db2.gz MXAKCXQYAJRTTM-UHFFFAOYSA-N 1 1 294.420 3.701 20 5 CHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000159440174 1126741250 /nfs/dbraw/zinc/74/12/50/1126741250.db2.gz ZUFCEQUHIKADQX-LBPRGKRZSA-N 1 1 280.343 3.602 20 5 CHBDMO Cc1ccc(CNc2cc(C3CC3)cc[nH+]2)cc1[N+](=O)[O-] ZINC000353070372 1127260226 /nfs/dbraw/zinc/26/02/26/1127260226.db2.gz IFOAYFQERIRRRP-UHFFFAOYSA-N 1 1 283.331 3.788 20 5 CHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CCC(F)(F)CC1 ZINC000286742753 1127272702 /nfs/dbraw/zinc/27/27/02/1127272702.db2.gz IESHNZCMYMDJCN-UHFFFAOYSA-N 1 1 290.335 3.666 20 5 CHBDMO CS[C@@H]1CCCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000355216295 1127326301 /nfs/dbraw/zinc/32/63/01/1127326301.db2.gz UWYPFPZFZWALLC-CQSZACIVSA-N 1 1 294.420 3.621 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)[C@@H](C)C1(C)CC1 ZINC001308580910 1127392612 /nfs/dbraw/zinc/39/26/12/1127392612.db2.gz YXSLKASMTBSAIK-ZDUSSCGKSA-N 1 1 276.380 3.832 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595288444 1127458300 /nfs/dbraw/zinc/45/83/00/1127458300.db2.gz IUHUEKFRZRPWNX-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccccc1C[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595288444 1127458301 /nfs/dbraw/zinc/45/83/01/1127458301.db2.gz IUHUEKFRZRPWNX-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CCC(CC)[N@H+](Cc1onc(C)c1[N+](=O)[O-])CC(C)C ZINC000595348355 1127458625 /nfs/dbraw/zinc/45/86/25/1127458625.db2.gz RNPXZMIAVXXTME-UHFFFAOYSA-N 1 1 283.372 3.538 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000595310168 1127459447 /nfs/dbraw/zinc/45/94/47/1127459447.db2.gz VLHSMTGXLKLPGO-UHFFFAOYSA-N 1 1 294.351 3.736 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000595310168 1127459450 /nfs/dbraw/zinc/45/94/50/1127459450.db2.gz VLHSMTGXLKLPGO-UHFFFAOYSA-N 1 1 294.351 3.736 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595565529 1127465348 /nfs/dbraw/zinc/46/53/48/1127465348.db2.gz AHFVUUVFWRVUGC-XEZPLFJOSA-N 1 1 274.364 3.839 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119390 1127474930 /nfs/dbraw/zinc/47/49/30/1127474930.db2.gz XESNILICCWUTCK-RISCZKNCSA-N 1 1 296.317 3.695 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CCF)C1 ZINC000595754385 1127474945 /nfs/dbraw/zinc/47/49/45/1127474945.db2.gz APBKLWMIZUGQNI-OLZOCXBDSA-N 1 1 280.343 3.727 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CCF)C1 ZINC000595754384 1127475071 /nfs/dbraw/zinc/47/50/71/1127475071.db2.gz APBKLWMIZUGQNI-CHWSQXEVSA-N 1 1 280.343 3.727 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595858278 1127478475 /nfs/dbraw/zinc/47/84/75/1127478475.db2.gz VLHPEJIMYNFGPL-PBNFFQIGSA-N 1 1 274.364 3.919 20 5 CHBDMO Cc1ccncc1C[N@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000361434021 1127562922 /nfs/dbraw/zinc/56/29/22/1127562922.db2.gz KKHJNCFRIKMZFT-AWEZNQCLSA-N 1 1 299.374 3.800 20 5 CHBDMO C[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCC1 ZINC000602471351 1127583287 /nfs/dbraw/zinc/58/32/87/1127583287.db2.gz CMAHOFJXHFJZIG-UHFFFAOYSA-N 1 1 288.269 3.598 20 5 CHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000060877165 1127614704 /nfs/dbraw/zinc/61/47/04/1127614704.db2.gz URSSTKRMNXBNHR-HNNXBMFYSA-N 1 1 276.380 3.995 20 5 CHBDMO CCC(F)(F)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000599069121 1127655128 /nfs/dbraw/zinc/65/51/28/1127655128.db2.gz VIZANMSEUWECQM-ZDUSSCGKSA-N 1 1 298.333 3.551 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCOc2ccccc2C1 ZINC000603909666 1127681765 /nfs/dbraw/zinc/68/17/65/1127681765.db2.gz YFGRXHCHFPOWRA-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCOc2ccccc2C1 ZINC000603909666 1127681766 /nfs/dbraw/zinc/68/17/66/1127681766.db2.gz YFGRXHCHFPOWRA-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000543858498 1127950507 /nfs/dbraw/zinc/95/05/07/1127950507.db2.gz SXYNZADAUDLYNT-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)CC1 ZINC000468148318 1127994915 /nfs/dbraw/zinc/99/49/15/1127994915.db2.gz VJCCREBXFCUBJF-QWHCGFSZSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1)C(C)(C)C ZINC000094774685 1128007878 /nfs/dbraw/zinc/00/78/78/1128007878.db2.gz XYZKWOVZBDANSF-JTQLQIEISA-N 1 1 268.332 3.600 20 5 CHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000541701397 1128034177 /nfs/dbraw/zinc/03/41/77/1128034177.db2.gz RCMAGTIBXMYOKE-CQSZACIVSA-N 1 1 262.353 3.749 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](C)[C@H]1C ZINC000541770471 1128038288 /nfs/dbraw/zinc/03/82/88/1128038288.db2.gz FDVKOJSTSDDTCB-WCQYABFASA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC000542049196 1128049500 /nfs/dbraw/zinc/04/95/00/1128049500.db2.gz VXCOUYCRGUQXOD-XNRPHZJLSA-N 1 1 274.364 3.605 20 5 CHBDMO CC[C@@H]1CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470182635 1128064967 /nfs/dbraw/zinc/06/49/67/1128064967.db2.gz MHPHNKSZKIWHQU-KADHNRKRSA-N 1 1 274.364 3.730 20 5 CHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000609204551 1128173715 /nfs/dbraw/zinc/17/37/15/1128173715.db2.gz WAOSZAWMZYFBEC-CHWSQXEVSA-N 1 1 276.380 3.994 20 5 CHBDMO Cc1cc[nH+]c(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000193073560 1128205665 /nfs/dbraw/zinc/20/56/65/1128205665.db2.gz YZCWLPAIBNANMH-OAHLLOKOSA-N 1 1 283.331 3.788 20 5 CHBDMO CC(C)C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C(C)C ZINC000917100966 1128480982 /nfs/dbraw/zinc/48/09/82/1128480982.db2.gz UGYINHOXJIYYFL-UHFFFAOYSA-N 1 1 268.332 3.600 20 5 CHBDMO Cc1ccoc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154292707 1128487241 /nfs/dbraw/zinc/48/72/41/1128487241.db2.gz RVFSZHIMUAKYJD-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO Cc1ccoc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000154292707 1128487244 /nfs/dbraw/zinc/48/72/44/1128487244.db2.gz RVFSZHIMUAKYJD-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO O=[N+]([O-])c1ccc([O-])cc1C[N@H+]1CCCC12CCCCC2 ZINC000568419481 1128584181 /nfs/dbraw/zinc/58/41/81/1128584181.db2.gz GFVVRGQGHZOPFO-UHFFFAOYSA-N 1 1 290.363 3.599 20 5 CHBDMO O=[N+]([O-])c1ccc(O)cc1C[N@@H+]1CCCC12CCCCC2 ZINC000568419481 1128584183 /nfs/dbraw/zinc/58/41/83/1128584183.db2.gz GFVVRGQGHZOPFO-UHFFFAOYSA-N 1 1 290.363 3.599 20 5 CHBDMO O=[N+]([O-])c1ccc(O)cc1C[N@H+]1CCCC12CCCCC2 ZINC000568419481 1128584186 /nfs/dbraw/zinc/58/41/86/1128584186.db2.gz GFVVRGQGHZOPFO-UHFFFAOYSA-N 1 1 290.363 3.599 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCCc3ccccc3C2)c1 ZINC000498928015 1128622480 /nfs/dbraw/zinc/62/24/80/1128622480.db2.gz HJNMVRAJWSTAQK-UHFFFAOYSA-N 1 1 282.343 3.543 20 5 CHBDMO CCC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(C)ccn1 ZINC000601269150 1128707405 /nfs/dbraw/zinc/70/74/05/1128707405.db2.gz XEQBFBBDICJOOT-HNNXBMFYSA-N 1 1 299.374 3.929 20 5 CHBDMO CCCC[N@H+]1CCCC[C@H]1CNc1ccsc1[N+](=O)[O-] ZINC000609560996 1128717984 /nfs/dbraw/zinc/71/79/84/1128717984.db2.gz QFFKXAIKXZMFFD-LBPRGKRZSA-N 1 1 297.424 3.723 20 5 CHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609767012 1128724884 /nfs/dbraw/zinc/72/48/84/1128724884.db2.gz FMHZGIUMPYPWNF-CQSZACIVSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609846133 1128728385 /nfs/dbraw/zinc/72/83/85/1128728385.db2.gz DTSJJXCUAUPRRI-INWMFGNUSA-N 1 1 274.364 3.748 20 5 CHBDMO CC[C@H](C)[C@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610001919 1128734512 /nfs/dbraw/zinc/73/45/12/1128734512.db2.gz LZHPQYKFSHOUEW-DZGCQCFKSA-N 1 1 276.380 3.995 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2cccs2)cc1 ZINC000014672860 1117859825 /nfs/dbraw/zinc/85/98/25/1117859825.db2.gz ZGGOMNCXKHKFCT-AWEZNQCLSA-N 1 1 288.372 3.993 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccsc1 ZINC000084439840 1118355760 /nfs/dbraw/zinc/35/57/60/1118355760.db2.gz XETQCQIEOUAKKZ-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO CC(C)[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000158718486 1119151424 /nfs/dbraw/zinc/15/14/24/1119151424.db2.gz DFCUFOYVQCOJBK-UHFFFAOYSA-N 1 1 274.320 3.695 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1F ZINC000121935886 1119221953 /nfs/dbraw/zinc/22/19/53/1119221953.db2.gz SLPRGDFWOVEOME-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000343016861 1119281592 /nfs/dbraw/zinc/28/15/92/1119281592.db2.gz YDZRNMBOTCFVAU-INIZCTEOSA-N 1 1 274.364 3.668 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000583603104 1119384310 /nfs/dbraw/zinc/38/43/10/1119384310.db2.gz UUMXNDKARUPQEH-DZGCQCFKSA-N 1 1 297.358 3.540 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000543855681 1119596925 /nfs/dbraw/zinc/59/69/25/1119596925.db2.gz KCZAWRADBBZALC-JTQLQIEISA-N 1 1 270.760 3.869 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C1CC1)[C@@H]1C=CCCC1 ZINC000179242478 1119624450 /nfs/dbraw/zinc/62/44/50/1119624450.db2.gz DRNKSTSMMWDOGR-CQSZACIVSA-N 1 1 272.348 3.668 20 5 CHBDMO CC(C)CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001167735342 1120300259 /nfs/dbraw/zinc/30/02/59/1120300259.db2.gz ZMNMZCYQJLPRHN-UHFFFAOYSA-N 1 1 276.380 3.995 20 5 CHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccoc1 ZINC000092935794 1120638842 /nfs/dbraw/zinc/63/88/42/1120638842.db2.gz QTTNXHRXATXSAQ-FNORWQNLSA-N 1 1 286.331 3.723 20 5 CHBDMO C[C@@H](c1ccccn1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350363288 1120651882 /nfs/dbraw/zinc/65/18/82/1120651882.db2.gz XOPNJWSGGUOVNY-LEJCZOIISA-N 1 1 297.358 3.696 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCCCCC1 ZINC000302918019 1120660043 /nfs/dbraw/zinc/66/00/43/1120660043.db2.gz ASHLNQLYIRDPLR-UHFFFAOYSA-N 1 1 262.353 3.749 20 5 CHBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000048609566 1120835218 /nfs/dbraw/zinc/83/52/18/1120835218.db2.gz QENCSOZKDOGELA-AWEZNQCLSA-N 1 1 288.372 3.776 20 5 CHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000048609566 1120835221 /nfs/dbraw/zinc/83/52/21/1120835221.db2.gz QENCSOZKDOGELA-AWEZNQCLSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H](c1cccs1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051501842 1120948268 /nfs/dbraw/zinc/94/82/68/1120948268.db2.gz ANKAUJSOCBOZTF-SNVBAGLBSA-N 1 1 294.351 3.988 20 5 CHBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051501842 1120948273 /nfs/dbraw/zinc/94/82/73/1120948273.db2.gz ANKAUJSOCBOZTF-SNVBAGLBSA-N 1 1 294.351 3.988 20 5 CHBDMO CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000059385830 1121060673 /nfs/dbraw/zinc/06/06/73/1121060673.db2.gz RJKBZUYQDZUIAJ-UHFFFAOYSA-N 1 1 292.379 3.628 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1C1CCC1 ZINC000512653364 1121510310 /nfs/dbraw/zinc/51/03/10/1121510310.db2.gz WNNFKPHLMQHFSS-UFNQUYMESA-N 1 1 286.375 3.873 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000433035690 1121532560 /nfs/dbraw/zinc/53/25/60/1121532560.db2.gz NRGAOLBONJSEKA-FZMZJTMJSA-N 1 1 262.353 3.524 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCC(C)(C)C1 ZINC000483108912 1121694815 /nfs/dbraw/zinc/69/48/15/1121694815.db2.gz ILGIHGCAXVMOJJ-AWEZNQCLSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@@H](C)[C@H](C)C1 ZINC001180199381 1121964372 /nfs/dbraw/zinc/96/43/72/1121964372.db2.gz RNGSGNNNEAYHLT-DGCLKSJQSA-N 1 1 276.380 3.690 20 5 CHBDMO CC[C@@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000518581225 1122006331 /nfs/dbraw/zinc/00/63/31/1122006331.db2.gz BDGWZHZWFQKUQV-CHWSQXEVSA-N 1 1 262.353 3.778 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CC[C@@H](C)C1 ZINC000429591129 1122143289 /nfs/dbraw/zinc/14/32/89/1122143289.db2.gz QQQSEONJPUQIDO-OCCSQVGLSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000035019505 1122149471 /nfs/dbraw/zinc/14/94/71/1122149471.db2.gz QZPZIFYZMCSCQV-NEPJUHHUSA-N 1 1 274.320 3.908 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000514086983 1122375116 /nfs/dbraw/zinc/37/51/16/1122375116.db2.gz DYERJIIXNFGNRQ-CQSZACIVSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCc1cccs1 ZINC000183371550 1129050410 /nfs/dbraw/zinc/05/04/10/1129050410.db2.gz BUBDWXHBPUDCOZ-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO CCC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC1CC1 ZINC000435237748 1122447009 /nfs/dbraw/zinc/44/70/09/1122447009.db2.gz OIOZUTTTWMJBLW-FNORWQNLSA-N 1 1 274.364 3.730 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001167960565 1122524711 /nfs/dbraw/zinc/52/47/11/1122524711.db2.gz UZLIWNSDHNPNTM-LBPRGKRZSA-N 1 1 280.343 3.746 20 5 CHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001190771098 1122554948 /nfs/dbraw/zinc/55/49/48/1122554948.db2.gz XIZQFFFDLQECHO-LLVKDONJSA-N 1 1 298.333 3.884 20 5 CHBDMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000429600738 1122726950 /nfs/dbraw/zinc/72/69/50/1122726950.db2.gz WTRKEGVAQLQQQM-GHMZBOCLSA-N 1 1 282.771 3.869 20 5 CHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CCCCCC1 ZINC000054173167 1122765017 /nfs/dbraw/zinc/76/50/17/1122765017.db2.gz XPAWSGIYBZPBHV-UHFFFAOYSA-N 1 1 268.382 3.811 20 5 CHBDMO C=C/C=C/CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194478304 1122778892 /nfs/dbraw/zinc/77/88/92/1122778892.db2.gz SOJLVIKKRRBIBZ-CWDCEQMOSA-N 1 1 286.375 3.907 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000506622157 1122793044 /nfs/dbraw/zinc/79/30/44/1122793044.db2.gz ALLNFCKXAVMBPQ-LBPRGKRZSA-N 1 1 280.343 3.744 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507020288 1122919030 /nfs/dbraw/zinc/91/90/30/1122919030.db2.gz HHMQZBAGYQPYBH-RSPDNQDQSA-N 1 1 262.353 3.728 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1cccc2[nH]ccc21 ZINC000507115505 1122924691 /nfs/dbraw/zinc/92/46/91/1122924691.db2.gz INSAMGLZHRFOIM-UHFFFAOYSA-N 1 1 295.342 3.708 20 5 CHBDMO CC1(F)CC[NH+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001196583559 1122927782 /nfs/dbraw/zinc/92/77/82/1122927782.db2.gz RDRKCWXWQNPZMZ-UHFFFAOYSA-N 1 1 286.734 3.572 20 5 CHBDMO CC[N@@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C1CC1 ZINC000507234392 1122941075 /nfs/dbraw/zinc/94/10/75/1122941075.db2.gz SEDFOVOLNHXOFB-UHFFFAOYSA-N 1 1 262.353 3.703 20 5 CHBDMO CCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000048907973 1123156259 /nfs/dbraw/zinc/15/62/59/1123156259.db2.gz WAGKLKINIKHWNM-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@H](O)C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000776520794 1123345737 /nfs/dbraw/zinc/34/57/37/1123345737.db2.gz GQTAPFYPLPOXTR-AWEZNQCLSA-N 1 1 279.383 3.806 20 5 CHBDMO C[N@@H+](CCCF)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000895897582 1123527153 /nfs/dbraw/zinc/52/71/53/1123527153.db2.gz CLADCYGETJOLFY-UHFFFAOYSA-N 1 1 292.310 3.646 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000444764888 1124061425 /nfs/dbraw/zinc/06/14/25/1124061425.db2.gz COOGOZBUJZLIPE-GFCCVEGCSA-N 1 1 280.343 3.602 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000475619928 1124071718 /nfs/dbraw/zinc/07/17/18/1124071718.db2.gz BDQJPWDKNHKDDD-LBPRGKRZSA-N 1 1 282.409 3.914 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000475619927 1124071991 /nfs/dbraw/zinc/07/19/91/1124071991.db2.gz BDQJPWDKNHKDDD-GFCCVEGCSA-N 1 1 282.409 3.914 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000531378682 1125212699 /nfs/dbraw/zinc/21/26/99/1125212699.db2.gz JNOMWEJNEZFAPO-GUYCJALGSA-N 1 1 282.343 3.788 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCC1CCCC1)CC2 ZINC001307524112 1125390958 /nfs/dbraw/zinc/39/09/58/1125390958.db2.gz SPYHBFPSZUMYMA-UHFFFAOYSA-N 1 1 274.364 3.533 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774884 1129452017 /nfs/dbraw/zinc/45/20/17/1129452017.db2.gz HIBFUSRWNQRCMK-LBPRGKRZSA-N 1 1 280.343 3.746 20 5 CHBDMO Cc1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c(C)o1 ZINC000743477611 1129526803 /nfs/dbraw/zinc/52/68/03/1129526803.db2.gz SUIKBJKKBYHZAF-NSHDSACASA-N 1 1 274.320 3.655 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001169382691 1129721666 /nfs/dbraw/zinc/72/16/66/1129721666.db2.gz LOTFKTWENDPUSA-LBPRGKRZSA-N 1 1 280.343 3.602 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCC(C)(C)C1 ZINC000801554991 1129926887 /nfs/dbraw/zinc/92/68/87/1129926887.db2.gz CDCZWNROPQBTNA-LBPRGKRZSA-N 1 1 280.343 3.744 20 5 CHBDMO C[N@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655344 1130135266 /nfs/dbraw/zinc/13/52/66/1130135266.db2.gz VPKOPUNAUZGVJC-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO C[N@@H+](Cc1ccccc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655344 1130135268 /nfs/dbraw/zinc/13/52/68/1130135268.db2.gz VPKOPUNAUZGVJC-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO CC(C)[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC1CC1 ZINC000746657893 1130136110 /nfs/dbraw/zinc/13/61/10/1130136110.db2.gz LPRKKLYTIQVJDB-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO CCC(CC)[N@@H+](C)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170351390 1130486388 /nfs/dbraw/zinc/48/63/88/1130486388.db2.gz FWFUXMSXWBAPGQ-LBPRGKRZSA-N 1 1 294.395 3.655 20 5 CHBDMO C[C@@H]1C[C@@H](C(C)(C)C)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001170785342 1130989875 /nfs/dbraw/zinc/98/98/75/1130989875.db2.gz ZVTRRTXLPCCJTE-OCCSQVGLSA-N 1 1 291.395 3.636 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000797606091 1130998345 /nfs/dbraw/zinc/99/83/45/1130998345.db2.gz YIUVFNBIGGYDMA-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@@H](C)C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000797606091 1130998350 /nfs/dbraw/zinc/99/83/50/1130998350.db2.gz YIUVFNBIGGYDMA-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799196889 1131076283 /nfs/dbraw/zinc/07/62/83/1131076283.db2.gz ZDHHDDIRPLAPKS-UKRRQHHQSA-N 1 1 297.358 3.540 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CCC3)C2)c(F)c1 ZINC000348164109 1131890719 /nfs/dbraw/zinc/89/07/19/1131890719.db2.gz AKIBRFYXWSXQRM-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036787260 1131974707 /nfs/dbraw/zinc/97/47/07/1131974707.db2.gz TXPGEZOTDITFFG-JTQLQIEISA-N 1 1 270.760 3.725 20 5 CHBDMO C[N@@H+](CCC1CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919125 1132362018 /nfs/dbraw/zinc/36/20/18/1132362018.db2.gz DPUMDCJHBBFWAE-MRXNPFEDSA-N 1 1 288.391 3.574 20 5 CHBDMO C[C@H]1CCCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909938 1132371787 /nfs/dbraw/zinc/37/17/87/1132371787.db2.gz VWLBNXCXZGKCPF-BBRMVZONSA-N 1 1 288.391 3.717 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C)CC1 ZINC001173221560 1132411210 /nfs/dbraw/zinc/41/12/10/1132411210.db2.gz KHHGTMAHLPDEOL-KBPBESRZSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@H](C)C1 ZINC001173226053 1132412759 /nfs/dbraw/zinc/41/27/59/1132412759.db2.gz KXAXSWUDWPDTLK-KGLIPLIRSA-N 1 1 276.380 3.648 20 5 CHBDMO FC[C@H]1CCC[N@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232227067 1132439506 /nfs/dbraw/zinc/43/95/06/1132439506.db2.gz GMSVUPJKBFWYAM-MRXNPFEDSA-N 1 1 295.361 3.717 20 5 CHBDMO CCCC[N@@H+](C)C[C@@H](C)Nc1cc(C)c([N+](=O)[O-])cc1F ZINC001163423820 1133150370 /nfs/dbraw/zinc/15/03/70/1133150370.db2.gz SNOXXJHOHYTYSG-GFCCVEGCSA-N 1 1 297.374 3.575 20 5 CHBDMO Cc1[nH+]c2c(Nc3cccc([N+](=O)[O-])c3)cccn2c1C ZINC001204449588 1133448312 /nfs/dbraw/zinc/44/83/12/1133448312.db2.gz BAGSJHAPADGSEB-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO Cc1[nH+]c2ccccn2c1Nc1ccc(C)c([N+](=O)[O-])c1 ZINC001213661712 1134475212 /nfs/dbraw/zinc/47/52/12/1134475212.db2.gz UNXNXNFQJWBYGT-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO C[C@@H](Nc1ccc2c(c1)[nH+]cn2C)c1cccc([N+](=O)[O-])c1 ZINC000348803171 533558206 /nfs/dbraw/zinc/55/82/06/533558206.db2.gz PSOPVFUFYPSAMW-LLVKDONJSA-N 1 1 296.330 3.655 20 5 CHBDMO Cc1csc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)n1 ZINC000080310607 260179439 /nfs/dbraw/zinc/17/94/39/260179439.db2.gz LBXGHHJESGVJNG-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC3(C2)CCCCC3)c1 ZINC000303833697 328359953 /nfs/dbraw/zinc/35/99/53/328359953.db2.gz AEZPXFYDVMFAKK-UHFFFAOYSA-N 1 1 274.364 3.751 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](CCC1CCCC1)C2 ZINC000535246352 328397881 /nfs/dbraw/zinc/39/78/81/328397881.db2.gz JGHRQLFEIPIPNV-UHFFFAOYSA-N 1 1 274.364 3.533 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C/C=C/c1ccccc1)CC2 ZINC000532038610 328396922 /nfs/dbraw/zinc/39/69/22/328396922.db2.gz CNSWPXURPZMABN-QPJJXVBHSA-N 1 1 294.354 3.666 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C/C=C/c1ccccc1)CC2 ZINC000532038610 328396923 /nfs/dbraw/zinc/39/69/23/328396923.db2.gz CNSWPXURPZMABN-QPJJXVBHSA-N 1 1 294.354 3.666 20 5 CHBDMO CCc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000089513367 327171105 /nfs/dbraw/zinc/17/11/05/327171105.db2.gz QALXDYJXIILRKS-LLVKDONJSA-N 1 1 274.320 3.601 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000559635995 327256082 /nfs/dbraw/zinc/25/60/82/327256082.db2.gz CZMLPHIGQXMFKK-XJKSGUPXSA-N 1 1 297.358 3.540 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CC2)C1 ZINC000187002770 329351260 /nfs/dbraw/zinc/35/12/60/329351260.db2.gz SDUQYYWZTUFMIJ-GFCCVEGCSA-N 1 1 260.337 3.532 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C(C)C)C1CCCC1 ZINC000533369158 330359986 /nfs/dbraw/zinc/35/99/86/330359986.db2.gz QXIOMRYDJUUWOF-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO C[C@H](F)CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553151 331033911 /nfs/dbraw/zinc/03/39/11/331033911.db2.gz XPYAJBMUILJVJM-JSGCOSHPSA-N 1 1 280.343 3.522 20 5 CHBDMO C[C@H](F)CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553150 331034023 /nfs/dbraw/zinc/03/40/23/331034023.db2.gz XPYAJBMUILJVJM-GXTWGEPZSA-N 1 1 280.343 3.522 20 5 CHBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000463520002 331348895 /nfs/dbraw/zinc/34/88/95/331348895.db2.gz WATFYKDVRBPNJH-NSHDSACASA-N 1 1 298.358 3.609 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@H](C)[C@H](C)C1 ZINC000490036533 332077883 /nfs/dbraw/zinc/07/78/83/332077883.db2.gz FVJOFTXDIRHTCX-FRRDWIJNSA-N 1 1 262.353 3.552 20 5 CHBDMO COc1cc(C[N@H+]2CCCC(C)(C)CC2)ccc1[N+](=O)[O-] ZINC000490055326 332079110 /nfs/dbraw/zinc/07/91/10/332079110.db2.gz BLILEGXUELIINT-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO CC(C)([NH2+]Cc1ccc(Cl)o1)c1ccccc1[N+](=O)[O-] ZINC000492226350 332388285 /nfs/dbraw/zinc/38/82/85/332388285.db2.gz OSRHQRCNZNMPQE-UHFFFAOYSA-N 1 1 294.738 3.866 20 5 CHBDMO CCOc1cc(C[N@@H+](CC(C)C)C2CC2)ccc1[N+](=O)[O-] ZINC000492356853 332393984 /nfs/dbraw/zinc/39/39/84/332393984.db2.gz LODNUJWJKPNAFD-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000309826868 333050187 /nfs/dbraw/zinc/05/01/87/333050187.db2.gz QZEWIDRGUKMBKY-UHFFFAOYSA-N 1 1 288.322 3.756 20 5 CHBDMO CC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000309826868 333050189 /nfs/dbraw/zinc/05/01/89/333050189.db2.gz QZEWIDRGUKMBKY-UHFFFAOYSA-N 1 1 288.322 3.756 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000523550812 333332599 /nfs/dbraw/zinc/33/25/99/333332599.db2.gz ALJOFIOCYAMEPZ-AWEZNQCLSA-N 1 1 262.353 3.749 20 5 CHBDMO CS[C@H]1CCCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000134596639 334096579 /nfs/dbraw/zinc/09/65/79/334096579.db2.gz LUTILWQSUCVTOI-DOMZBBRYSA-N 1 1 294.420 3.873 20 5 CHBDMO Cc1cccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000549172097 334186898 /nfs/dbraw/zinc/18/68/98/334186898.db2.gz QPFVKTHYWBMKEB-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO CC1(C)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCC[C@H]21 ZINC000550444431 334222675 /nfs/dbraw/zinc/22/26/75/334222675.db2.gz VKFSCVIINCJXFI-HUUCEWRRSA-N 1 1 274.364 3.605 20 5 CHBDMO C[N@H+]1CCCC[C@H]1CCSc1cccc([N+](=O)[O-])c1 ZINC000551462280 334250977 /nfs/dbraw/zinc/25/09/77/334250977.db2.gz ZZSSFOJSBSTPHH-LBPRGKRZSA-N 1 1 280.393 3.561 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](c2ccccc2)C1 ZINC000581196059 336023029 /nfs/dbraw/zinc/02/30/29/336023029.db2.gz CZQYNBNKOPLIMW-INIZCTEOSA-N 1 1 296.370 3.974 20 5 CHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000383626635 336115999 /nfs/dbraw/zinc/11/59/99/336115999.db2.gz UIFHWZUPYNSXFD-YPMHNXCESA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC12CCC2 ZINC000357019728 524297704 /nfs/dbraw/zinc/29/77/04/524297704.db2.gz CSRAAEKVVPFBLV-NSHDSACASA-N 1 1 280.393 3.668 20 5 CHBDMO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000037668276 524862552 /nfs/dbraw/zinc/86/25/52/524862552.db2.gz KBACBOLSOSDTFR-NHYWBVRUSA-N 1 1 286.331 3.601 20 5 CHBDMO Cc1cc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000044729513 525522933 /nfs/dbraw/zinc/52/29/33/525522933.db2.gz XEBJREMWNRXNQK-NSHDSACASA-N 1 1 274.320 3.655 20 5 CHBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774591 526153135 /nfs/dbraw/zinc/15/31/35/526153135.db2.gz WAJMFFJFRLVPRL-SNVBAGLBSA-N 1 1 294.351 3.988 20 5 CHBDMO CC(C)c1ccc[nH+]c1NCc1ccc([N+](=O)[O-])cc1F ZINC000341953539 535376743 /nfs/dbraw/zinc/37/67/43/535376743.db2.gz RVURARUNHFCVRV-UHFFFAOYSA-N 1 1 289.310 3.864 20 5 CHBDMO Cc1ccc([C@H]2CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC000885926576 1125627255 /nfs/dbraw/zinc/62/72/55/1125627255.db2.gz GAASNDKQRVQHRM-MRXNPFEDSA-N 1 1 297.358 3.635 20 5 CHBDMO O=[N+]([O-])c1ncccc1C[N@@H+](CC1CC1)C1CCCCC1 ZINC000885983690 1125633142 /nfs/dbraw/zinc/63/31/42/1125633142.db2.gz MPTDNKGYTKABAJ-UHFFFAOYSA-N 1 1 289.379 3.535 20 5 CHBDMO Cc1ccc2c(c1)C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000482458165 1126757217 /nfs/dbraw/zinc/75/72/17/1126757217.db2.gz SDGLGJHTEBYTBA-GQCTYLIASA-N 1 1 294.354 3.932 20 5 CHBDMO Cc1ccc2c(c1)C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000482458165 1126757219 /nfs/dbraw/zinc/75/72/19/1126757219.db2.gz SDGLGJHTEBYTBA-GQCTYLIASA-N 1 1 294.354 3.932 20 5 CHBDMO CC[N@@H+](CC1CCC1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000483131152 1126768951 /nfs/dbraw/zinc/76/89/51/1126768951.db2.gz YVEBBNPAEFMNOD-LBPRGKRZSA-N 1 1 262.353 3.778 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001170845409 1131128694 /nfs/dbraw/zinc/12/86/94/1131128694.db2.gz BEMJHWDJYILJKV-CYBMUJFWSA-N 1 1 264.369 3.914 20 5 CHBDMO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351754496 1127207379 /nfs/dbraw/zinc/20/73/79/1127207379.db2.gz FRXQLPMBGAREBR-NXEZZACHSA-N 1 1 284.306 3.636 20 5 CHBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351754496 1127207383 /nfs/dbraw/zinc/20/73/83/1127207383.db2.gz FRXQLPMBGAREBR-NXEZZACHSA-N 1 1 284.306 3.636 20 5 CHBDMO CC[C@H](CSC)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000589206624 1127216341 /nfs/dbraw/zinc/21/63/41/1127216341.db2.gz YBHGOOWJDCYQKO-RCQQVGEISA-N 1 1 294.420 3.681 20 5 CHBDMO CC[C@@H](CSC)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000589206622 1127216512 /nfs/dbraw/zinc/21/65/12/1127216512.db2.gz YBHGOOWJDCYQKO-KGXGESDWSA-N 1 1 294.420 3.681 20 5 CHBDMO CC(C)c1ccc(C[N@H+](C)Cc2ccc[nH]2)cc1[N+](=O)[O-] ZINC000354045721 1127288576 /nfs/dbraw/zinc/28/85/76/1127288576.db2.gz YOKNARVUWHTQRB-UHFFFAOYSA-N 1 1 287.363 3.678 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)Cc2ccc[nH]2)cc1[N+](=O)[O-] ZINC000354045721 1127288577 /nfs/dbraw/zinc/28/85/77/1127288577.db2.gz YOKNARVUWHTQRB-UHFFFAOYSA-N 1 1 287.363 3.678 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761045767 1127408386 /nfs/dbraw/zinc/40/83/86/1127408386.db2.gz QZLYSMHFCFWEBS-NXEZZACHSA-N 1 1 288.269 3.540 20 5 CHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000359293443 1127456403 /nfs/dbraw/zinc/45/64/03/1127456403.db2.gz FLEHWNOBCZSDNQ-CZUORRHYSA-N 1 1 274.364 3.607 20 5 CHBDMO CC[C@H](CC(F)F)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000595289092 1127458349 /nfs/dbraw/zinc/45/83/49/1127458349.db2.gz NZBIOCDKTIIFOY-LLVKDONJSA-N 1 1 286.322 3.708 20 5 CHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000359541036 1127467025 /nfs/dbraw/zinc/46/70/25/1127467025.db2.gz CYVQNYJDXHYYAS-BLLLJJGKSA-N 1 1 292.354 3.746 20 5 CHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)C1 ZINC000359541039 1127467418 /nfs/dbraw/zinc/46/74/18/1127467418.db2.gz CYVQNYJDXHYYAS-MLGOLLRUSA-N 1 1 292.354 3.746 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CCF)C1 ZINC000595754386 1127474812 /nfs/dbraw/zinc/47/48/12/1127474812.db2.gz APBKLWMIZUGQNI-QWHCGFSZSA-N 1 1 280.343 3.727 20 5 CHBDMO C[C@H]([NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C(F)F ZINC000603428621 1127649494 /nfs/dbraw/zinc/64/94/94/1127649494.db2.gz KOHQTEYGOVHEJR-GVXVVHGQSA-N 1 1 298.333 3.549 20 5 CHBDMO Cc1c(C[N@H+](C)[C@@H](C)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000603873317 1127679889 /nfs/dbraw/zinc/67/98/89/1127679889.db2.gz LLWGTBCSOULYPZ-LBPRGKRZSA-N 1 1 264.369 3.770 20 5 CHBDMO Cc1noc(C[N@H+](C)C[C@@H](C)C2CCCCC2)c1[N+](=O)[O-] ZINC000599633287 1127684281 /nfs/dbraw/zinc/68/42/81/1127684281.db2.gz PLTXSQLBNIMWRC-LLVKDONJSA-N 1 1 295.383 3.539 20 5 CHBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])s2)C1 ZINC000604409275 1127703492 /nfs/dbraw/zinc/70/34/92/1127703492.db2.gz MTBBFXJNVGLLEE-LBPRGKRZSA-N 1 1 297.424 3.580 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000604484442 1127706243 /nfs/dbraw/zinc/70/62/43/1127706243.db2.gz NECXRDKVRCWMHH-QGZVFWFLSA-N 1 1 298.342 3.638 20 5 CHBDMO C[C@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000539826811 1127943981 /nfs/dbraw/zinc/94/39/81/1127943981.db2.gz ZBVOIPDTGWRQGG-STMXVASLSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1cccc([C@@H]2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000544187841 1127962108 /nfs/dbraw/zinc/96/21/08/1127962108.db2.gz XVQAICMHSHKMFL-MRXNPFEDSA-N 1 1 296.370 3.893 20 5 CHBDMO CCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000544611914 1127979358 /nfs/dbraw/zinc/97/93/58/1127979358.db2.gz NZOGFVKYUBGBDH-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC(C)C ZINC000541999700 1128046740 /nfs/dbraw/zinc/04/67/40/1128046740.db2.gz UEKSQPYOPZQZDN-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CC1CCC1 ZINC000470176957 1128065509 /nfs/dbraw/zinc/06/55/09/1128065509.db2.gz ZHGLYWOYPBQLDB-LCYFTJDESA-N 1 1 274.364 3.730 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000470207396 1128066189 /nfs/dbraw/zinc/06/61/89/1128066189.db2.gz VPJYJULEFUBZRM-GDKQZQJFSA-N 1 1 286.375 3.873 20 5 CHBDMO CCOc1cc(C[N@@H+](C(C)C)C2CCC2)ccc1[N+](=O)[O-] ZINC000492543230 1128102670 /nfs/dbraw/zinc/10/26/70/1128102670.db2.gz YKWKFPLKHJOARB-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1C ZINC000609193664 1128171024 /nfs/dbraw/zinc/17/10/24/1128171024.db2.gz RVVAJKJLSKGIHY-CYBMUJFWSA-N 1 1 292.379 3.756 20 5 CHBDMO CC[N@@H+](CCC1CC1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494652277 1128185761 /nfs/dbraw/zinc/18/57/61/1128185761.db2.gz IDZPZYBYTCDZIK-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO Cc1cc[nH+]c(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000193074217 1128205571 /nfs/dbraw/zinc/20/55/71/1128205571.db2.gz YZCWLPAIBNANMH-HNNXBMFYSA-N 1 1 283.331 3.788 20 5 CHBDMO Cc1occc1C[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000092438489 1128276899 /nfs/dbraw/zinc/27/68/99/1128276899.db2.gz SOWCGWLCUHDENU-FNORWQNLSA-N 1 1 286.331 3.641 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000916152114 1128409709 /nfs/dbraw/zinc/40/97/09/1128409709.db2.gz NKILBOYLNKXRFI-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1C=CCCC1 ZINC000609417620 1128714362 /nfs/dbraw/zinc/71/43/62/1128714362.db2.gz VDNJBWKHVHNBQX-OAHLLOKOSA-N 1 1 274.364 3.914 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C1CC1)C1CCCC1 ZINC000579067094 1128736777 /nfs/dbraw/zinc/73/67/77/1128736777.db2.gz DKQDFPTUNLMBPR-UHFFFAOYSA-N 1 1 290.363 3.510 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCCC[C@H]1C ZINC000430240066 1117908970 /nfs/dbraw/zinc/90/89/70/1117908970.db2.gz CBMBWCJDINZAEM-IUODEOHRSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000359864333 1118007382 /nfs/dbraw/zinc/00/73/82/1118007382.db2.gz ABOSACPGDLRGCB-CXAGYDPISA-N 1 1 297.358 3.573 20 5 CHBDMO CC(C)c1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)on1 ZINC000610420539 1118421549 /nfs/dbraw/zinc/42/15/49/1118421549.db2.gz OUZJPMRQMXLOHT-NSHDSACASA-N 1 1 289.335 3.557 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[C@H]2Nc1cc(C2CC2)cc[nH+]1 ZINC000580783870 1118503719 /nfs/dbraw/zinc/50/37/19/1118503719.db2.gz NLOPRXNPYLVIFV-OAHLLOKOSA-N 1 1 295.342 3.967 20 5 CHBDMO CCn1ccc(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000616785307 1128799323 /nfs/dbraw/zinc/79/93/23/1128799323.db2.gz MRHJKKKQBBZFFW-ZDUSSCGKSA-N 1 1 287.363 3.609 20 5 CHBDMO CCn1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000616785307 1128799326 /nfs/dbraw/zinc/79/93/26/1128799326.db2.gz MRHJKKKQBBZFFW-ZDUSSCGKSA-N 1 1 287.363 3.609 20 5 CHBDMO CCc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000535786005 1118885878 /nfs/dbraw/zinc/88/58/78/1118885878.db2.gz VXEBVZBANVIIHM-UHFFFAOYSA-N 1 1 290.388 3.851 20 5 CHBDMO CCc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000535786005 1118885882 /nfs/dbraw/zinc/88/58/82/1118885882.db2.gz VXEBVZBANVIIHM-UHFFFAOYSA-N 1 1 290.388 3.851 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC2(CC2)C1 ZINC000274563998 1118934248 /nfs/dbraw/zinc/93/42/48/1118934248.db2.gz XXIGVZQSVBZMSO-LBPRGKRZSA-N 1 1 260.337 3.532 20 5 CHBDMO C[N@@H+](CCCc1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511073434 1119009745 /nfs/dbraw/zinc/00/97/45/1119009745.db2.gz PSMPJIXDRZMHHA-UHFFFAOYSA-N 1 1 298.386 3.702 20 5 CHBDMO CCc1ccc(C)[nH+]c1Nc1ccc(C)c([N+](=O)[O-])c1 ZINC001213660150 1119255219 /nfs/dbraw/zinc/25/52/19/1119255219.db2.gz SUUPXISANMAARN-UHFFFAOYSA-N 1 1 271.320 3.913 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2C2CC2)c(Cl)c1 ZINC000611780488 1119387620 /nfs/dbraw/zinc/38/76/20/1119387620.db2.gz IGYXWLLTRIMGDF-AWEZNQCLSA-N 1 1 280.755 3.623 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)CC(C)(C)C ZINC000311881266 1120115646 /nfs/dbraw/zinc/11/56/46/1120115646.db2.gz WOUGBTKHCCPKFL-UHFFFAOYSA-N 1 1 268.332 3.602 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)[C@@H]2CCCC[C@@H]21 ZINC000541108997 1120148388 /nfs/dbraw/zinc/14/83/88/1120148388.db2.gz FUAOUBMWBDYHRF-DJSGYFEHSA-N 1 1 292.354 3.744 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC3(C2)CCCCC3)c(F)c1 ZINC000314186548 1120174782 /nfs/dbraw/zinc/17/47/82/1120174782.db2.gz PBRQIPRBHMCOOD-UHFFFAOYSA-N 1 1 292.354 3.890 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC(C)(C)C ZINC000542931767 1120259969 /nfs/dbraw/zinc/25/99/69/1120259969.db2.gz TYHHLMPPFFDJAN-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO CC(C)[N@@H+](CCOC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1 ZINC000065953515 1120371171 /nfs/dbraw/zinc/37/11/71/1120371171.db2.gz YPFKJPILSROSGE-UHFFFAOYSA-N 1 1 294.395 3.620 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccsc2)C2CC2)c1 ZINC000053419493 1120495045 /nfs/dbraw/zinc/49/50/45/1120495045.db2.gz NJUUJLABFVJPRV-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccsc2)C2CC2)c1 ZINC000053419493 1120495049 /nfs/dbraw/zinc/49/50/49/1120495049.db2.gz NJUUJLABFVJPRV-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccsc2)C2CC2)cc1 ZINC000053432763 1120497673 /nfs/dbraw/zinc/49/76/73/1120497673.db2.gz IHLDADCRAVQIQD-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccsc2)C2CC2)cc1 ZINC000053432763 1120497675 /nfs/dbraw/zinc/49/76/75/1120497675.db2.gz IHLDADCRAVQIQD-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO C[C@@]1(c2ccccc2)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532293345 1120499489 /nfs/dbraw/zinc/49/94/89/1120499489.db2.gz UWIDGHRFABLGNF-GOSISDBHSA-N 1 1 296.370 3.758 20 5 CHBDMO C[C@H]1CCC[N@H+](C(C)(C)CNc2sccc2[N+](=O)[O-])C1 ZINC000301994867 1120529176 /nfs/dbraw/zinc/52/91/76/1120529176.db2.gz PAJNPQNZDPYOMI-NSHDSACASA-N 1 1 297.424 3.579 20 5 CHBDMO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000922670522 1120576277 /nfs/dbraw/zinc/57/62/77/1120576277.db2.gz JIMGIVAZHXDIIH-JTQLQIEISA-N 1 1 294.351 3.955 20 5 CHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000338899477 1120638826 /nfs/dbraw/zinc/63/88/26/1120638826.db2.gz DFZREAKNWRZTRC-UHFFFAOYSA-N 1 1 288.269 3.598 20 5 CHBDMO C[C@H](c1ccccn1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350363287 1120651462 /nfs/dbraw/zinc/65/14/62/1120651462.db2.gz XOPNJWSGGUOVNY-IUCKJTJTSA-N 1 1 297.358 3.696 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[NH+](C2CCC2)C2CCC2)c(F)c1 ZINC000429137976 1120675063 /nfs/dbraw/zinc/67/50/63/1120675063.db2.gz CYWKSKRRBHXEPS-UHFFFAOYSA-N 1 1 296.317 3.780 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@@H+]1CCCNCC1 ZINC001204668343 1121007891 /nfs/dbraw/zinc/00/78/91/1121007891.db2.gz VEUCPYRYPQPLAJ-UHFFFAOYSA-N 1 1 290.410 3.788 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCCNCC1 ZINC001204668343 1121007895 /nfs/dbraw/zinc/00/78/95/1121007895.db2.gz VEUCPYRYPQPLAJ-UHFFFAOYSA-N 1 1 290.410 3.788 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2CN1CCC[NH2+]CC1 ZINC001204668343 1121007900 /nfs/dbraw/zinc/00/79/00/1121007900.db2.gz VEUCPYRYPQPLAJ-UHFFFAOYSA-N 1 1 290.410 3.788 20 5 CHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC001174781665 1121029497 /nfs/dbraw/zinc/02/94/97/1121029497.db2.gz YTHPZUCPZIAMSW-SMDDNHRTSA-N 1 1 280.343 3.887 20 5 CHBDMO Cc1c[nH+]c(Nc2ccc(/C=C/[N+](=O)[O-])cc2)c(C)c1 ZINC001175901127 1121493456 /nfs/dbraw/zinc/49/34/56/1121493456.db2.gz JSGUSJPGQJTNAE-BQYQJAHWSA-N 1 1 269.304 3.689 20 5 CHBDMO Cc1c(C[N@@H+]2CC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000466705814 1121556109 /nfs/dbraw/zinc/55/61/09/1121556109.db2.gz ADCYIHVEGIUGKC-AWEZNQCLSA-N 1 1 276.380 3.771 20 5 CHBDMO CC(C)C[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000466719579 1121566538 /nfs/dbraw/zinc/56/65/38/1121566538.db2.gz XHKVXIYDKZTZGI-HNNXBMFYSA-N 1 1 276.380 3.505 20 5 CHBDMO CC[C@@H]1C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000420955976 1122051805 /nfs/dbraw/zinc/05/18/05/1122051805.db2.gz MKOHIPMKTKSGPT-MELADBBJSA-N 1 1 292.379 3.545 20 5 CHBDMO CC[C@@H]1C[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000420955976 1122051810 /nfs/dbraw/zinc/05/18/10/1122051810.db2.gz MKOHIPMKTKSGPT-MELADBBJSA-N 1 1 292.379 3.545 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CC[C@@H](C)C1 ZINC000429591130 1122142847 /nfs/dbraw/zinc/14/28/47/1122142847.db2.gz QQQSEONJPUQIDO-TZMCWYRMSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000035019500 1122149918 /nfs/dbraw/zinc/14/99/18/1122149918.db2.gz QZPZIFYZMCSCQV-NWDGAFQWSA-N 1 1 274.320 3.908 20 5 CHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000505571194 1122422360 /nfs/dbraw/zinc/42/23/60/1122422360.db2.gz WGHFPEQRHPTTRJ-UHFFFAOYSA-N 1 1 280.343 3.889 20 5 CHBDMO Cc1ccc(C[N@H+]2CCSC(C)(C)CC2)cc1[N+](=O)[O-] ZINC000435053811 1122431264 /nfs/dbraw/zinc/43/12/64/1122431264.db2.gz WHOIPFHUDUAFNN-UHFFFAOYSA-N 1 1 294.420 3.621 20 5 CHBDMO CCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC1CC1 ZINC000435237747 1122447536 /nfs/dbraw/zinc/44/75/36/1122447536.db2.gz OIOZUTTTWMJBLW-ALCCZGGFSA-N 1 1 274.364 3.730 20 5 CHBDMO Cc1ccc(Cn2c[nH+]c3c2C[C@H](C)[C@H](C)C3)cc1[N+](=O)[O-] ZINC001189416762 1122501150 /nfs/dbraw/zinc/50/11/50/1122501150.db2.gz ZWKVKVLFIJMEBF-OLZOCXBDSA-N 1 1 299.374 3.519 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@H]12 ZINC000515548297 1122509383 /nfs/dbraw/zinc/50/93/83/1122509383.db2.gz RHIXYHKHOLELLH-XYPHTWIQSA-N 1 1 288.391 3.995 20 5 CHBDMO C[N@H+](C/C=C/c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000515547136 1122509552 /nfs/dbraw/zinc/50/95/52/1122509552.db2.gz PREYGDLNRDOWRM-JXMROGBWSA-N 1 1 282.343 3.740 20 5 CHBDMO C[N@@H+](C/C=C/c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000515547136 1122509553 /nfs/dbraw/zinc/50/95/53/1122509553.db2.gz PREYGDLNRDOWRM-JXMROGBWSA-N 1 1 282.343 3.740 20 5 CHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC1CCCC1 ZINC000516299907 1122585582 /nfs/dbraw/zinc/58/55/82/1122585582.db2.gz PMBLZEGTFKJJLJ-UHFFFAOYSA-N 1 1 276.380 3.995 20 5 CHBDMO COc1ccc(C[N@H+]2CCCCC(C)(C)C2)cc1[N+](=O)[O-] ZINC000438361287 1122693026 /nfs/dbraw/zinc/69/30/26/1122693026.db2.gz WKIKQARVRDRHFV-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC1CC2(CCC2)C1 ZINC001193743484 1122711775 /nfs/dbraw/zinc/71/17/75/1122711775.db2.gz OZLCDRJEEIEEGK-UHFFFAOYSA-N 1 1 288.391 3.649 20 5 CHBDMO CC[N@H+](Cc1occc1C)Cc1ccccc1[N+](=O)[O-] ZINC000507132936 1122722815 /nfs/dbraw/zinc/72/28/15/1122722815.db2.gz XPDQQQGEDWPDTK-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO CC[N@@H+](Cc1occc1C)Cc1ccccc1[N+](=O)[O-] ZINC000507132936 1122722819 /nfs/dbraw/zinc/72/28/19/1122722819.db2.gz XPDQQQGEDWPDTK-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO CC[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000518581227 1122768857 /nfs/dbraw/zinc/76/88/57/1122768857.db2.gz BDGWZHZWFQKUQV-QWHCGFSZSA-N 1 1 262.353 3.778 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426488824 1122804864 /nfs/dbraw/zinc/80/48/64/1122804864.db2.gz XYWRPEXWKYCUAJ-GXFFZTMASA-N 1 1 280.755 3.623 20 5 CHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543631616 1122945350 /nfs/dbraw/zinc/94/53/50/1122945350.db2.gz MHOFOSWDQHUPHA-ZDUSSCGKSA-N 1 1 296.436 3.867 20 5 CHBDMO C[N@@H+](CCC1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000507617078 1122977126 /nfs/dbraw/zinc/97/71/26/1122977126.db2.gz QORDLJKYAGIHFP-UHFFFAOYSA-N 1 1 276.380 3.997 20 5 CHBDMO C[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339012681 1123669784 /nfs/dbraw/zinc/66/97/84/1123669784.db2.gz URZJMSJZRYAZBQ-SECBINFHSA-N 1 1 288.269 3.598 20 5 CHBDMO C[C@@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339012681 1123669786 /nfs/dbraw/zinc/66/97/86/1123669786.db2.gz URZJMSJZRYAZBQ-SECBINFHSA-N 1 1 288.269 3.598 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCC(C)(C)C1 ZINC000475552091 1124008554 /nfs/dbraw/zinc/00/85/54/1124008554.db2.gz QNURFAVDRUQXJH-CYBMUJFWSA-N 1 1 280.343 3.744 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC2(CCCC2)C1 ZINC000445873952 1124105770 /nfs/dbraw/zinc/10/57/70/1124105770.db2.gz HFRLAJRVXVGLCD-UHFFFAOYSA-N 1 1 292.354 3.890 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000525273840 1124119805 /nfs/dbraw/zinc/11/98/05/1124119805.db2.gz ZKALKBJZKFXEEQ-IVMMDQJWSA-N 1 1 274.364 3.748 20 5 CHBDMO C[N@@H+](CCC1CCCC1)Cc1ccccc1[N+](=O)[O-] ZINC000525634626 1124450834 /nfs/dbraw/zinc/45/08/34/1124450834.db2.gz GKGMBBADZGXVKN-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000485765818 1124614721 /nfs/dbraw/zinc/61/47/21/1124614721.db2.gz MCBOCMFUXDBOEA-AAEUAGOBSA-N 1 1 262.353 3.696 20 5 CHBDMO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccco1 ZINC000872016931 1124656925 /nfs/dbraw/zinc/65/69/25/1124656925.db2.gz QQGSQQTYFASJKS-SNVBAGLBSA-N 1 1 292.360 3.761 20 5 CHBDMO Cc1ccccc1C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872019024 1124657753 /nfs/dbraw/zinc/65/77/53/1124657753.db2.gz SABCIJGJQZXDPJ-LBPRGKRZSA-N 1 1 288.322 3.893 20 5 CHBDMO Cc1cscc1C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872066133 1124672557 /nfs/dbraw/zinc/67/25/57/1124672557.db2.gz FJMXPJLWJMXHCS-JTQLQIEISA-N 1 1 294.351 3.955 20 5 CHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H]2C2CC2)o1 ZINC000449429585 1124735370 /nfs/dbraw/zinc/73/53/70/1124735370.db2.gz XDFLQOGZTHZRAB-HNNXBMFYSA-N 1 1 298.342 3.839 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC(F)(F)C[C@H]2C)cc1[N+](=O)[O-] ZINC000879053807 1125194140 /nfs/dbraw/zinc/19/41/40/1125194140.db2.gz YHWBQEXRLXGEAL-LLVKDONJSA-N 1 1 284.306 3.523 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC(F)(F)C[C@H]2C)cc1[N+](=O)[O-] ZINC000879053807 1125194144 /nfs/dbraw/zinc/19/41/44/1125194144.db2.gz YHWBQEXRLXGEAL-LLVKDONJSA-N 1 1 284.306 3.523 20 5 CHBDMO C[C@@H](c1ccccc1F)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000052074198 1125373933 /nfs/dbraw/zinc/37/39/33/1125373933.db2.gz VAHUDPCFCQIBGW-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000052074198 1125373934 /nfs/dbraw/zinc/37/39/34/1125373934.db2.gz VAHUDPCFCQIBGW-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000139501623 1129202307 /nfs/dbraw/zinc/20/23/07/1129202307.db2.gz XQKISUJOPZCWJJ-CQSZACIVSA-N 1 1 296.370 3.757 20 5 CHBDMO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000037772005 1129266773 /nfs/dbraw/zinc/26/67/73/1129266773.db2.gz MCOGMWATPPTESA-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CO2 ZINC000090452334 1129294848 /nfs/dbraw/zinc/29/48/48/1129294848.db2.gz MFYVQQURUZUIES-LRDDRELGSA-N 1 1 298.342 3.688 20 5 CHBDMO Cc1cccc(C)c1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000738302938 1129392044 /nfs/dbraw/zinc/39/20/44/1129392044.db2.gz BTRLLYNTXWNYDI-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO CC1=C(C)C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000796017363 1129463867 /nfs/dbraw/zinc/46/38/67/1129463867.db2.gz ICWRTGOHCPWDKK-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO CC1=C(C)C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000796017363 1129463869 /nfs/dbraw/zinc/46/38/69/1129463869.db2.gz ICWRTGOHCPWDKK-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1C ZINC000252216492 1129558903 /nfs/dbraw/zinc/55/89/03/1129558903.db2.gz XVKOUWJXNCMXHX-MNOVXSKESA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1cncs1 ZINC000768275071 1129850098 /nfs/dbraw/zinc/85/00/98/1129850098.db2.gz JUKGUDZEURPBLQ-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC(C)(C)C1 ZINC000801539451 1129925822 /nfs/dbraw/zinc/92/58/22/1129925822.db2.gz GWQNJRWLHCYDQU-NSHDSACASA-N 1 1 280.343 3.602 20 5 CHBDMO NC(=[NH+]OCc1cccc([N+](=O)[O-])c1)C1CCCCCC1 ZINC000746567662 1130063731 /nfs/dbraw/zinc/06/37/31/1130063731.db2.gz ZQKQSHAMDCSCEG-UHFFFAOYSA-N 1 1 291.351 3.564 20 5 CHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC(C)(C)C ZINC000812890514 1130723766 /nfs/dbraw/zinc/72/37/66/1130723766.db2.gz FVNFDDDITOJZJD-UHFFFAOYSA-N 1 1 268.332 3.602 20 5 CHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783569076 1130839782 /nfs/dbraw/zinc/83/97/82/1130839782.db2.gz AZCDDLPPHGBXDZ-PWSUYJOCSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@H]1C[C@@H](C(C)(C)C)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001170785341 1130989622 /nfs/dbraw/zinc/98/96/22/1130989622.db2.gz ZVTRRTXLPCCJTE-JSGCOSHPSA-N 1 1 291.395 3.636 20 5 CHBDMO CC1=C[C@H](C)C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000797606090 1130999051 /nfs/dbraw/zinc/99/90/51/1130999051.db2.gz YIUVFNBIGGYDMA-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@H](C)C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000797606090 1130999054 /nfs/dbraw/zinc/99/90/54/1130999054.db2.gz YIUVFNBIGGYDMA-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC2CCC1CC2 ZINC001116463435 1131148847 /nfs/dbraw/zinc/14/88/47/1131148847.db2.gz KIMJCRZHRNSEES-UHFFFAOYSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC2CCC1CC2 ZINC001116463435 1131148849 /nfs/dbraw/zinc/14/88/49/1131148849.db2.gz KIMJCRZHRNSEES-UHFFFAOYSA-N 1 1 280.755 3.623 20 5 CHBDMO C[N@H+]1CC[C@H](Oc2c3ccccc3c(O)c3ccccc32)C1 ZINC001229025667 1132001508 /nfs/dbraw/zinc/00/15/08/1132001508.db2.gz XLLSBPMAWXHODI-ZDUSSCGKSA-N 1 1 293.366 3.782 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCCC[C@@H]1C ZINC001173227370 1132412770 /nfs/dbraw/zinc/41/27/70/1132412770.db2.gz QGMDUPPVNQFLSF-UONOGXRCSA-N 1 1 276.380 3.790 20 5 CHBDMO CC(C)[C@H]1CCC[N@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230996 1132414103 /nfs/dbraw/zinc/41/41/03/1132414103.db2.gz IBGJWAJHBUDISM-CZUORRHYSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]1c1ccccc1 ZINC001173233760 1132414130 /nfs/dbraw/zinc/41/41/30/1132414130.db2.gz NETIMAOYHQFIIN-KSSFIOAISA-N 1 1 296.370 3.973 20 5 CHBDMO C[C@H]1CCC[N@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232219884 1132439388 /nfs/dbraw/zinc/43/93/88/1132439388.db2.gz VNHKOZNOQJKORR-ZDUSSCGKSA-N 1 1 277.371 3.767 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1 ZINC001162152897 1133054844 /nfs/dbraw/zinc/05/48/44/1133054844.db2.gz JKJVHHQQVCEHAL-ZIAGYGMSSA-N 1 1 291.395 3.578 20 5 CHBDMO CC[N@@H+](Cc1c(C)ccc([N+](=O)[O-])c1C)C1CCC1 ZINC001204682134 1133475514 /nfs/dbraw/zinc/47/55/14/1133475514.db2.gz PGMFOWBXBKENFL-UHFFFAOYSA-N 1 1 262.353 3.586 20 5 CHBDMO C[C@@H]1[C@H](N)CC[N@@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001205190406 1133544071 /nfs/dbraw/zinc/54/40/71/1133544071.db2.gz OOIIEEJZHMFTBC-JLTOFOAXSA-N 1 1 290.410 3.915 20 5 CHBDMO C[C@@H]1[C@H](N)CC[N@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001205190406 1133544073 /nfs/dbraw/zinc/54/40/73/1133544073.db2.gz OOIIEEJZHMFTBC-JLTOFOAXSA-N 1 1 290.410 3.915 20 5 CHBDMO C[C@@H]1[C@H]([NH3+])CCN1Cc1c2ccccc2cc2ccccc21 ZINC001205190406 1133544076 /nfs/dbraw/zinc/54/40/76/1133544076.db2.gz OOIIEEJZHMFTBC-JLTOFOAXSA-N 1 1 290.410 3.915 20 5 CHBDMO Cc1cc(C)[nH+]c(Nc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC001213659819 1134474470 /nfs/dbraw/zinc/47/44/70/1134474470.db2.gz BEPGQTQUEUOIKQ-UHFFFAOYSA-N 1 1 257.293 3.659 20 5 CHBDMO Cc1ccc(Nc2c(C)cc[nH+]c2C)c([N+](=O)[O-])c1 ZINC001214167343 1134515313 /nfs/dbraw/zinc/51/53/13/1134515313.db2.gz HEKOVMPGGVRSAO-UHFFFAOYSA-N 1 1 257.293 3.659 20 5 CHBDMO C[C@H]([NH2+]CC=C(Cl)Cl)c1cccc([N+](=O)[O-])c1 ZINC000407069228 1135091721 /nfs/dbraw/zinc/09/17/21/1135091721.db2.gz SHYGYYWJBZDWPB-QMMMGPOBSA-N 1 1 275.135 3.564 20 5 CHBDMO COc1ccc(C[N@@H+](C)[C@H]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000519968916 260035440 /nfs/dbraw/zinc/03/54/40/260035440.db2.gz VXLRSALXGJSINS-OCCSQVGLSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccccc1[N+](=O)[O-] ZINC000020526283 171239258 /nfs/dbraw/zinc/23/92/58/171239258.db2.gz AFMOFTMRAQXSGV-SMDDNHRTSA-N 1 1 286.331 3.916 20 5 CHBDMO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccccc1[N+](=O)[O-] ZINC000020526282 171239308 /nfs/dbraw/zinc/23/93/08/171239308.db2.gz AFMOFTMRAQXSGV-BXUZGUMPSA-N 1 1 286.331 3.916 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000035738536 172392126 /nfs/dbraw/zinc/39/21/26/172392126.db2.gz APUAQAUABKFODD-GHMZBOCLSA-N 1 1 260.293 3.600 20 5 CHBDMO Cc1c(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000519968896 260035507 /nfs/dbraw/zinc/03/55/07/260035507.db2.gz UFZFOHOFEHLEQK-IUODEOHRSA-N 1 1 276.380 3.914 20 5 CHBDMO CC[N@@H+](Cc1ccccn1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000161123318 261237418 /nfs/dbraw/zinc/23/74/18/261237418.db2.gz FMTMYCHAYMPHFI-CYBMUJFWSA-N 1 1 285.347 3.573 20 5 CHBDMO Cc1c(Cn2c[nH+]c3c2C[C@H](C)[C@H](C)C3)cccc1[N+](=O)[O-] ZINC000319241064 262187570 /nfs/dbraw/zinc/18/75/70/262187570.db2.gz MPJYBSWVYNYXLH-NEPJUHHUSA-N 1 1 299.374 3.519 20 5 CHBDMO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)o1 ZINC000048327092 328051691 /nfs/dbraw/zinc/05/16/91/328051691.db2.gz INFCYQQFYITNDL-ABAIWWIYSA-N 1 1 286.331 3.601 20 5 CHBDMO Cc1ccc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])o1 ZINC000160847022 328089613 /nfs/dbraw/zinc/08/96/13/328089613.db2.gz XQMWEIIHRAMQAW-FNORWQNLSA-N 1 1 286.331 3.641 20 5 CHBDMO C[C@@H](c1ccccc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000532038680 328396913 /nfs/dbraw/zinc/39/69/13/328396913.db2.gz VOCWATCMFAIICM-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](c2ccncc2)C1 ZINC000559635994 327255811 /nfs/dbraw/zinc/25/58/11/327255811.db2.gz CZMLPHIGQXMFKK-CZUORRHYSA-N 1 1 297.358 3.540 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000559635993 327255955 /nfs/dbraw/zinc/25/59/55/327255955.db2.gz CZMLPHIGQXMFKK-CJNGLKHVSA-N 1 1 297.358 3.540 20 5 CHBDMO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000175115634 329163097 /nfs/dbraw/zinc/16/30/97/329163097.db2.gz FVCFDDZCYPKKFK-QGZVFWFLSA-N 1 1 299.374 3.661 20 5 CHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000184897368 329263713 /nfs/dbraw/zinc/26/37/13/329263713.db2.gz YQGWQSWJYJANDW-GUYCJALGSA-N 1 1 297.358 3.573 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCCC2(CC2)C1 ZINC000186999011 329352900 /nfs/dbraw/zinc/35/29/00/329352900.db2.gz NHTGYGPHTPCXJD-ZDUSSCGKSA-N 1 1 274.364 3.840 20 5 CHBDMO CCCC[C@H](CN)[NH2+][C@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000423301651 330189039 /nfs/dbraw/zinc/18/90/39/330189039.db2.gz UHMWYMNNSWYPOB-GDBMZVCRSA-N 1 1 293.411 3.543 20 5 CHBDMO CC(C)c1ccc(C[N@@H+]2[C@H](C)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000527238788 330240477 /nfs/dbraw/zinc/24/04/77/330240477.db2.gz VQDGSMRFOFYDEX-TXEJJXNPSA-N 1 1 262.353 3.701 20 5 CHBDMO CSCCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451542892 331033264 /nfs/dbraw/zinc/03/32/64/331033264.db2.gz AQJKKBSAYBWYKK-AWEZNQCLSA-N 1 1 294.420 3.527 20 5 CHBDMO CC[C@H](F)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451543734 331033573 /nfs/dbraw/zinc/03/35/73/331033573.db2.gz CJRZNEFMMCGMPM-KBPBESRZSA-N 1 1 280.343 3.522 20 5 CHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])CC1CCC(F)(F)CC1 ZINC000459286761 331274593 /nfs/dbraw/zinc/27/45/93/331274593.db2.gz HUAJAVWZGKYSPY-UHFFFAOYSA-N 1 1 298.333 3.852 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](C)[C@H]1C ZINC000490067356 332079894 /nfs/dbraw/zinc/07/98/94/332079894.db2.gz MGHMCNSXHMFOMY-UHTWSYAYSA-N 1 1 262.353 3.695 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490429313 332089446 /nfs/dbraw/zinc/08/94/46/332089446.db2.gz DYAJWASUDKCOHB-CQSZACIVSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000492278554 332390226 /nfs/dbraw/zinc/39/02/26/332390226.db2.gz WMIKGBCDNYFBQP-SNVBAGLBSA-N 1 1 270.760 3.726 20 5 CHBDMO COc1ccc(C[N@H+]2CCC[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000513753310 333037712 /nfs/dbraw/zinc/03/77/12/333037712.db2.gz BYDVEHBZTXCMTC-HNNXBMFYSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@@H+](CC2CC2)C(C)C)ccc1[N+](=O)[O-] ZINC000517655399 333105187 /nfs/dbraw/zinc/10/51/87/333105187.db2.gz HUGFILNLDIBCLN-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCC1CC1 ZINC000182916952 333118030 /nfs/dbraw/zinc/11/80/30/333118030.db2.gz QFSOSGJWDFFODW-GFCCVEGCSA-N 1 1 262.353 3.696 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCc1ccccc1)C1CC1 ZINC000195732298 333262462 /nfs/dbraw/zinc/26/24/62/333262462.db2.gz VLDYANPMLBAPGV-UHFFFAOYSA-N 1 1 296.370 3.802 20 5 CHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000522418964 333286750 /nfs/dbraw/zinc/28/67/50/333286750.db2.gz VZDSXMYEIIKKTH-YOEHRIQHSA-N 1 1 296.370 3.973 20 5 CHBDMO C[C@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522536292 333289329 /nfs/dbraw/zinc/28/93/29/333289329.db2.gz HJIXMRUAVDRPNI-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@H]1CCCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522536292 333289331 /nfs/dbraw/zinc/28/93/31/333289331.db2.gz HJIXMRUAVDRPNI-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1ccc(C[C@H](C)[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000523438805 333326797 /nfs/dbraw/zinc/32/67/97/333326797.db2.gz REWABNYJPKOJIG-HNNXBMFYSA-N 1 1 298.386 3.966 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000523552900 333332909 /nfs/dbraw/zinc/33/29/09/333332909.db2.gz BVIWSGFJBOYOAU-AWEZNQCLSA-N 1 1 262.353 3.749 20 5 CHBDMO CC1CCC([N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000523702023 333340154 /nfs/dbraw/zinc/34/01/54/333340154.db2.gz XIPIDDTXOQQZNO-UHFFFAOYSA-N 1 1 276.380 3.648 20 5 CHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000303671710 333345277 /nfs/dbraw/zinc/34/52/77/333345277.db2.gz JVYIHFPOAMEJKP-HNNXBMFYSA-N 1 1 262.353 3.605 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000524766854 333387666 /nfs/dbraw/zinc/38/76/66/333387666.db2.gz XKBWFUUUHKTDBD-OAHLLOKOSA-N 1 1 262.353 3.607 20 5 CHBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000576021255 335142539 /nfs/dbraw/zinc/14/25/39/335142539.db2.gz WSYYFIBKHHIYAU-AQGQNPDFSA-N 1 1 274.364 3.871 20 5 CHBDMO Cc1ccsc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000564358540 334175535 /nfs/dbraw/zinc/17/55/35/334175535.db2.gz SIQKRFPGGOBTKI-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000383626633 336115947 /nfs/dbraw/zinc/11/59/47/336115947.db2.gz UIFHWZUPYNSXFD-WCQYABFASA-N 1 1 280.343 3.744 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H](C)c1cccnc1 ZINC000290314973 521329249 /nfs/dbraw/zinc/32/92/49/521329249.db2.gz CKRRCBGKEYPCEA-AWEZNQCLSA-N 1 1 299.374 3.881 20 5 CHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1C ZINC000050564680 524232365 /nfs/dbraw/zinc/23/23/65/524232365.db2.gz JKNWDXIKNWROJR-GHMZBOCLSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccsc1 ZINC000061363021 525514906 /nfs/dbraw/zinc/51/49/06/525514906.db2.gz RKBLNLJBPVWZCD-SECBINFHSA-N 1 1 280.324 3.646 20 5 CHBDMO Cc1csc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000038090859 526359993 /nfs/dbraw/zinc/35/99/93/526359993.db2.gz YKNIPTZIPSWJFY-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353610671 529057901 /nfs/dbraw/zinc/05/79/01/529057901.db2.gz WHNVWDZHPKJTTL-UHFFFAOYSA-N 1 1 268.382 3.668 20 5 CHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609705340 1118000868 /nfs/dbraw/zinc/00/08/68/1118000868.db2.gz VMOVKRNBFQNPBA-NSHDSACASA-N 1 1 282.771 3.870 20 5 CHBDMO CCC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC001195597063 1122877385 /nfs/dbraw/zinc/87/73/85/1122877385.db2.gz VWILRFCXNNQYCT-UHFFFAOYSA-N 1 1 270.760 3.869 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000036790523 1131974443 /nfs/dbraw/zinc/97/44/43/1131974443.db2.gz TUFXSBLEKDLRFJ-JTQLQIEISA-N 1 1 270.760 3.869 20 5 CHBDMO Cc1ccc([C@H](C)[N@H+](C)Cc2cccnc2[N+](=O)[O-])c(C)c1 ZINC000885963969 1125631613 /nfs/dbraw/zinc/63/16/13/1125631613.db2.gz UHJBQBUXNCNKDC-AWEZNQCLSA-N 1 1 299.374 3.800 20 5 CHBDMO Cc1ccc([C@H](C)[N@@H+](C)Cc2cccnc2[N+](=O)[O-])c(C)c1 ZINC000885963969 1125631616 /nfs/dbraw/zinc/63/16/16/1125631616.db2.gz UHJBQBUXNCNKDC-AWEZNQCLSA-N 1 1 299.374 3.800 20 5 CHBDMO C[C@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655629 1130135996 /nfs/dbraw/zinc/13/59/96/1130135996.db2.gz WKTIRWFSZSKYEX-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655629 1130135999 /nfs/dbraw/zinc/13/59/99/1130135999.db2.gz WKTIRWFSZSKYEX-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000482515261 1126762757 /nfs/dbraw/zinc/76/27/57/1126762757.db2.gz VYLAIAMRJOYIDC-FZSTZKMBSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCc1ccncc1 ZINC000181482256 1126856128 /nfs/dbraw/zinc/85/61/28/1126856128.db2.gz GLBJUMUATZZNKR-CQSZACIVSA-N 1 1 299.374 3.534 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000487291784 1127030778 /nfs/dbraw/zinc/03/07/78/1127030778.db2.gz RZMRUPQBBCPLQX-NEPJUHHUSA-N 1 1 250.342 3.634 20 5 CHBDMO CC1=C[C@@H](C)C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000797526557 1130991218 /nfs/dbraw/zinc/99/12/18/1130991218.db2.gz UMYUHOHRSMNEPZ-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@H]([NH2+]Cc1cnc(Cl)s1)c1ccccc1[N+](=O)[O-] ZINC000271694520 1127096791 /nfs/dbraw/zinc/09/67/91/1127096791.db2.gz FWTCHFZVFBXFKB-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](C3CC3)C2)c(Cl)c1 ZINC000588977730 1127209104 /nfs/dbraw/zinc/20/91/04/1127209104.db2.gz GPAIBIWJGFTOHU-LBPRGKRZSA-N 1 1 294.782 3.870 20 5 CHBDMO C[C@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000354042033 1127288157 /nfs/dbraw/zinc/28/81/57/1127288157.db2.gz JNWWUDQWTFGLHZ-JTQLQIEISA-N 1 1 268.382 3.524 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000354042033 1127288159 /nfs/dbraw/zinc/28/81/59/1127288159.db2.gz JNWWUDQWTFGLHZ-JTQLQIEISA-N 1 1 268.382 3.524 20 5 CHBDMO CC(C)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000045751703 1127293358 /nfs/dbraw/zinc/29/33/58/1127293358.db2.gz IKEQXUDJUOKFGO-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]1C[C@H](C)CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355108023 1127317481 /nfs/dbraw/zinc/31/74/81/1127317481.db2.gz KBYJZIVHXZCVIQ-GHMZBOCLSA-N 1 1 268.382 3.524 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC23CCCC3)c(Cl)c1 ZINC000593038662 1127369240 /nfs/dbraw/zinc/36/92/40/1127369240.db2.gz LIKQDVMCDRVUGI-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)C1 ZINC000359302885 1127457396 /nfs/dbraw/zinc/45/73/96/1127457396.db2.gz PDALCEXQNIQGRG-BBRMVZONSA-N 1 1 274.364 3.607 20 5 CHBDMO CCCC1CCC([N@@H+](C)Cc2onc(C)c2[N+](=O)[O-])CC1 ZINC000595462887 1127463573 /nfs/dbraw/zinc/46/35/73/1127463573.db2.gz XMURSLWVKLZAKV-UHFFFAOYSA-N 1 1 295.383 3.682 20 5 CHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H]4C[C@@H]4C3)o2)c1 ZINC000597222052 1127536772 /nfs/dbraw/zinc/53/67/72/1127536772.db2.gz BNHPTGMBXKVFAP-TZMCWYRMSA-N 1 1 298.342 3.697 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000599059224 1127653675 /nfs/dbraw/zinc/65/36/75/1127653675.db2.gz PXEAYSYBZQJZGI-TUAOUCFPSA-N 1 1 298.333 3.879 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)C(F)(F)[C@@H](C)C1 ZINC000599060169 1127654575 /nfs/dbraw/zinc/65/45/75/1127654575.db2.gz TXSLFLDKYUDKCD-TUAOUCFPSA-N 1 1 298.333 3.879 20 5 CHBDMO CCCC[N@@H+](CC)Cc1cccc([N+](=O)[O-])c1C ZINC000603837995 1127673921 /nfs/dbraw/zinc/67/39/21/1127673921.db2.gz RBTBWJBBGNFKFT-UHFFFAOYSA-N 1 1 250.342 3.525 20 5 CHBDMO CCc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000603824292 1127674174 /nfs/dbraw/zinc/67/41/74/1127674174.db2.gz UTOLXUBBUBWXJR-UHFFFAOYSA-N 1 1 284.359 3.789 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000603847296 1127676063 /nfs/dbraw/zinc/67/60/63/1127676063.db2.gz PDUKWLZXSQMMHV-UNEWFSDZSA-N 1 1 288.391 3.995 20 5 CHBDMO CCCCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])C(C)C ZINC000603845648 1127676248 /nfs/dbraw/zinc/67/62/48/1127676248.db2.gz DXENEXVGEFFCOI-UHFFFAOYSA-N 1 1 294.395 3.874 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+](C1CC1)C1CC1 ZINC000599594057 1127681839 /nfs/dbraw/zinc/68/18/39/1127681839.db2.gz IUCQTQZRTLLKEW-UHFFFAOYSA-N 1 1 290.363 3.509 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012773 1127689330 /nfs/dbraw/zinc/68/93/30/1127689330.db2.gz YTFFGZSKAWOUGV-CQSZACIVSA-N 1 1 292.379 3.628 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000604013250 1127689662 /nfs/dbraw/zinc/68/96/62/1127689662.db2.gz YAPJRJYMNTWLTG-OAHLLOKOSA-N 1 1 274.364 3.749 20 5 CHBDMO C[N@H+](Cc1ccc(Cl)s1)Cc1cccc([N+](=O)[O-])c1 ZINC000061759475 1127716245 /nfs/dbraw/zinc/71/62/45/1127716245.db2.gz ITUCDQQHXSDYLI-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)s1)Cc1cccc([N+](=O)[O-])c1 ZINC000061759475 1127716247 /nfs/dbraw/zinc/71/62/47/1127716247.db2.gz ITUCDQQHXSDYLI-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO Cc1ccsc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000061798667 1127718459 /nfs/dbraw/zinc/71/84/59/1127718459.db2.gz GVBKUAUXQOADOJ-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO Cc1ccsc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000061798667 1127718461 /nfs/dbraw/zinc/71/84/61/1127718461.db2.gz GVBKUAUXQOADOJ-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO C[C@@H]1CCC[N@H+](C(C)(C)CNc2ccccc2[N+](=O)[O-])C1 ZINC000608856068 1127892205 /nfs/dbraw/zinc/89/22/05/1127892205.db2.gz BYCZOPKLGNVOEI-CYBMUJFWSA-N 1 1 291.395 3.517 20 5 CHBDMO C[C@@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000608976739 1127896421 /nfs/dbraw/zinc/89/64/21/1127896421.db2.gz MFNCBMLEDZODOL-AWEZNQCLSA-N 1 1 284.359 3.830 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1C(C)C ZINC000544603740 1127978337 /nfs/dbraw/zinc/97/83/37/1127978337.db2.gz DCGSPJJOCHFKTB-OAHLLOKOSA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000544611786 1127979256 /nfs/dbraw/zinc/97/92/56/1127979256.db2.gz JQWMETQZWWHCJH-QGZVFWFLSA-N 1 1 296.370 3.893 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1ccccn1 ZINC000541772601 1128038359 /nfs/dbraw/zinc/03/83/59/1128038359.db2.gz BNUUGQBKQSXYNM-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO CCC[N@@H+](CC)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470172788 1128064985 /nfs/dbraw/zinc/06/49/85/1128064985.db2.gz CEBOKEGYMGSXPH-RAXLEYEMSA-N 1 1 262.353 3.730 20 5 CHBDMO CCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000470174975 1128064992 /nfs/dbraw/zinc/06/49/92/1128064992.db2.gz XGPYYVZQGVZBDT-RAXLEYEMSA-N 1 1 274.364 3.873 20 5 CHBDMO CC[C@H]1CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470182638 1128065039 /nfs/dbraw/zinc/06/50/39/1128065039.db2.gz MHPHNKSZKIWHQU-XXYUJHKVSA-N 1 1 274.364 3.730 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCC2(CC2)C1 ZINC000470214493 1128065860 /nfs/dbraw/zinc/06/58/60/1128065860.db2.gz PKBCBNKGJYSXND-GXDHUFHOSA-N 1 1 286.375 3.874 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@H](C)C[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492629932 1128106848 /nfs/dbraw/zinc/10/68/48/1128106848.db2.gz KZSJRYOLCYNSFO-OCCSQVGLSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1)C1(C)CC1 ZINC000761514472 1128132925 /nfs/dbraw/zinc/13/29/25/1128132925.db2.gz JVALVMPRQPFUMO-SNVBAGLBSA-N 1 1 282.771 3.869 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1C ZINC000609193665 1128170850 /nfs/dbraw/zinc/17/08/50/1128170850.db2.gz RVVAJKJLSKGIHY-ZDUSSCGKSA-N 1 1 292.379 3.756 20 5 CHBDMO C[C@H]1CCC[N@@H+](CCCCNc2ccccc2[N+](=O)[O-])C1 ZINC000301119364 1128390568 /nfs/dbraw/zinc/39/05/68/1128390568.db2.gz VTDDAXNEUALYSM-AWEZNQCLSA-N 1 1 291.395 3.519 20 5 CHBDMO C[C@@H]1CCC[N@@H+](CCCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC000301120288 1128406236 /nfs/dbraw/zinc/40/62/36/1128406236.db2.gz WJSDGEBMZHZPDL-CQSZACIVSA-N 1 1 291.395 3.519 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCCc3sccc3C2)c1 ZINC000609322786 1128698723 /nfs/dbraw/zinc/69/87/23/1128698723.db2.gz LHIUSUJSRQYORA-UHFFFAOYSA-N 1 1 288.372 3.605 20 5 CHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609672503 1128721402 /nfs/dbraw/zinc/72/14/02/1128721402.db2.gz HLZRRCDVNYGBBU-PBHICJAKSA-N 1 1 296.370 3.973 20 5 CHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609767164 1128724506 /nfs/dbraw/zinc/72/45/06/1128724506.db2.gz SXTJCVKAIXWRDA-AWEZNQCLSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000609766729 1128725355 /nfs/dbraw/zinc/72/53/55/1128725355.db2.gz JUDJGRRCFURRHG-NSHDSACASA-N 1 1 268.382 3.668 20 5 CHBDMO C[C@H](C1CC1)[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000351865158 1117751859 /nfs/dbraw/zinc/75/18/59/1117751859.db2.gz ZWNCLDYQWAXRFE-SECBINFHSA-N 1 1 296.317 3.636 20 5 CHBDMO C[C@H](C1CC1)[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000351865158 1117751865 /nfs/dbraw/zinc/75/18/65/1117751865.db2.gz ZWNCLDYQWAXRFE-SECBINFHSA-N 1 1 296.317 3.636 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C(C)C)C1CCCC1 ZINC000430201861 1117859271 /nfs/dbraw/zinc/85/92/71/1117859271.db2.gz BQNRLVVCNFPPKC-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)CCC[C@@H]1C ZINC000610215385 1117882161 /nfs/dbraw/zinc/88/21/61/1117882161.db2.gz KQEVFCWLXABPRH-OLZOCXBDSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000471168027 1117910164 /nfs/dbraw/zinc/91/01/64/1117910164.db2.gz GLPCEDFCRUFKBR-KRWDZBQOSA-N 1 1 282.343 3.584 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCC(C)(C)C1 ZINC000430243851 1117914484 /nfs/dbraw/zinc/91/44/84/1117914484.db2.gz WBIBMYSKKJALLW-AWEZNQCLSA-N 1 1 292.379 3.614 20 5 CHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCCCC1 ZINC000083126991 1117948099 /nfs/dbraw/zinc/94/80/99/1117948099.db2.gz XLQGXUPPZRRAPD-UHFFFAOYSA-N 1 1 289.335 3.501 20 5 CHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)C1 ZINC000359298118 1117984521 /nfs/dbraw/zinc/98/45/21/1117984521.db2.gz KSKOVKBKHOPDOR-WBMJQRKESA-N 1 1 292.354 3.746 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000430284713 1117993329 /nfs/dbraw/zinc/99/33/29/1117993329.db2.gz OVDUSJLZULTVCY-DGCLKSJQSA-N 1 1 260.337 3.554 20 5 CHBDMO CC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC(C)C ZINC000609705484 1118000463 /nfs/dbraw/zinc/00/04/63/1118000463.db2.gz KGKZPZFKUWVGGH-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO O=[N+]([O-])c1ccccc1CCNc1cc[nH+]c2ccsc21 ZINC000301440635 1118235894 /nfs/dbraw/zinc/23/58/94/1118235894.db2.gz INFJDVJZXRSJQF-UHFFFAOYSA-N 1 1 299.355 3.859 20 5 CHBDMO CC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000126245983 1118546769 /nfs/dbraw/zinc/54/67/69/1118546769.db2.gz LANCJIVPVBFGFJ-UHFFFAOYSA-N 1 1 294.738 3.960 20 5 CHBDMO CC1=C[C@@H](C)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000430882977 1118783292 /nfs/dbraw/zinc/78/32/92/1118783292.db2.gz NXZXLMZVOCNBNB-VUDGCMKMSA-N 1 1 272.348 3.506 20 5 CHBDMO C[C@@H]1C[C@H](C)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000033394651 1118965028 /nfs/dbraw/zinc/96/50/28/1118965028.db2.gz MLIFNSQYMKISJW-HMDMIVDLSA-N 1 1 274.364 3.586 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000071969327 1118988938 /nfs/dbraw/zinc/98/89/38/1118988938.db2.gz LIBWXZCRGVMACC-UHFFFAOYSA-N 1 1 276.380 3.792 20 5 CHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC1CCCCC1 ZINC000511072634 1119006723 /nfs/dbraw/zinc/00/67/23/1119006723.db2.gz GKHGEXMVEAEYJF-UHFFFAOYSA-N 1 1 276.380 3.649 20 5 CHBDMO C[N@H+](C/C=C/c1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511135431 1119094028 /nfs/dbraw/zinc/09/40/28/1119094028.db2.gz GIRHJMWCPTYRNY-JXMROGBWSA-N 1 1 296.370 3.783 20 5 CHBDMO C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C[C@H]1CC=CCC1 ZINC000612144800 1119227518 /nfs/dbraw/zinc/22/75/18/1119227518.db2.gz RMOARFLNUAXRAK-LBPRGKRZSA-N 1 1 278.327 3.522 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000708503114 1119501129 /nfs/dbraw/zinc/50/11/29/1119501129.db2.gz ODFMMMACYVQLPF-GFCCVEGCSA-N 1 1 280.343 3.746 20 5 CHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000219697920 1119511028 /nfs/dbraw/zinc/51/10/28/1119511028.db2.gz GMUQKTQWFUGXJU-SWLSCSKDSA-N 1 1 262.353 3.605 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCc2ccccc2C1 ZINC000033912443 1119621424 /nfs/dbraw/zinc/62/14/24/1119621424.db2.gz USCLYCOPAFLQHY-UITAMQMPSA-N 1 1 294.354 3.666 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1cccs1 ZINC000075966856 1128882867 /nfs/dbraw/zinc/88/28/67/1128882867.db2.gz YBTAJPHISUZOHT-GFCCVEGCSA-N 1 1 290.388 3.892 20 5 CHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)CC1CC1 ZINC000542697445 1120120996 /nfs/dbraw/zinc/12/09/96/1120120996.db2.gz MEYWTGONUCHIQJ-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO CCn1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000616129705 1120155056 /nfs/dbraw/zinc/15/50/56/1120155056.db2.gz UYQBAQURGUWPQF-ZDUSSCGKSA-N 1 1 287.363 3.609 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000066405266 1120390846 /nfs/dbraw/zinc/39/08/46/1120390846.db2.gz XLRFBAMRXHAZLD-ZDUSSCGKSA-N 1 1 270.332 3.788 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c(F)c1 ZINC000313853437 1120413961 /nfs/dbraw/zinc/41/39/61/1120413961.db2.gz SXSKYOGUPODDLC-BLLLJJGKSA-N 1 1 292.354 3.889 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(CCC2)C1 ZINC000123568187 1120539509 /nfs/dbraw/zinc/53/95/09/1120539509.db2.gz RAEITRLRJNBACW-LBPRGKRZSA-N 1 1 260.337 3.532 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCCC3(CC3)C2)c1 ZINC000186611016 1120621682 /nfs/dbraw/zinc/62/16/82/1120621682.db2.gz RBHVQROYAXJLCE-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC3(CC3)C2)c1 ZINC000186611016 1120621685 /nfs/dbraw/zinc/62/16/85/1120621685.db2.gz RBHVQROYAXJLCE-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000302742633 1120656566 /nfs/dbraw/zinc/65/65/66/1120656566.db2.gz ROCITELVAIHXII-ZDUSSCGKSA-N 1 1 270.332 3.788 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000511857135 1120666822 /nfs/dbraw/zinc/66/68/22/1120666822.db2.gz BUTDIRLCKXFGOS-GJZGRUSLSA-N 1 1 274.364 3.668 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000511857139 1120667044 /nfs/dbraw/zinc/66/70/44/1120667044.db2.gz BUTDIRLCKXFGOS-LSDHHAIUSA-N 1 1 274.364 3.668 20 5 CHBDMO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC1CCCC1 ZINC000104352431 1120727255 /nfs/dbraw/zinc/72/72/55/1120727255.db2.gz ZRDJOFHBYAJOGX-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000512178391 1121141890 /nfs/dbraw/zinc/14/18/90/1121141890.db2.gz ILQNTWSNVKUJGR-BMWLXYDHSA-N 1 1 274.364 3.730 20 5 CHBDMO C/C=C/C[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001175043988 1121156941 /nfs/dbraw/zinc/15/69/41/1121156941.db2.gz AYAJJOMMZZCGOK-KZSQQDEKSA-N 1 1 288.391 3.816 20 5 CHBDMO C[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000429583665 1121341400 /nfs/dbraw/zinc/34/14/00/1121341400.db2.gz KYVKCWABYDOPKX-ZWNOBZJWSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1ccsc1 ZINC000611203937 1121630564 /nfs/dbraw/zinc/63/05/64/1121630564.db2.gz FMKCJMMRQWTOAD-NSHDSACASA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccsc1 ZINC000611203937 1121630567 /nfs/dbraw/zinc/63/05/67/1121630567.db2.gz FMKCJMMRQWTOAD-NSHDSACASA-N 1 1 276.361 3.849 20 5 CHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1CCc2ccccc21 ZINC000611549755 1121654989 /nfs/dbraw/zinc/65/49/89/1121654989.db2.gz RXGZPHFRTLZJGI-INIZCTEOSA-N 1 1 296.370 3.757 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000501788002 1122008257 /nfs/dbraw/zinc/00/82/57/1122008257.db2.gz BWMXTCVJPCFJPS-UPJWGTAASA-N 1 1 262.353 3.634 20 5 CHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000035010716 1122148195 /nfs/dbraw/zinc/14/81/95/1122148195.db2.gz XXVDLISQOXCOFE-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000035010020 1122148225 /nfs/dbraw/zinc/14/82/25/1122148225.db2.gz JUZRDWZZKOTBOU-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+](CC2CC2)CC2CCC2)cs1 ZINC000355741360 1122165771 /nfs/dbraw/zinc/16/57/71/1122165771.db2.gz ZLRVCYYWMNJVAW-UHFFFAOYSA-N 1 1 280.393 3.668 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2F)cc1[N+](=O)[O-] ZINC000505615784 1122438778 /nfs/dbraw/zinc/43/87/78/1122438778.db2.gz VAIVNCNOJAGRKL-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2F)cc1[N+](=O)[O-] ZINC000505615784 1122438781 /nfs/dbraw/zinc/43/87/81/1122438781.db2.gz VAIVNCNOJAGRKL-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccc(C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000515260952 1122486876 /nfs/dbraw/zinc/48/68/76/1122486876.db2.gz YPPQNCCWVACLPJ-INIZCTEOSA-N 1 1 286.375 3.668 20 5 CHBDMO CC[C@@H](C)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001190528831 1122541755 /nfs/dbraw/zinc/54/17/55/1122541755.db2.gz MQRPOJDZRJQTGP-CYBMUJFWSA-N 1 1 264.369 3.851 20 5 CHBDMO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])CC(C)(C)C ZINC001194633187 1122787121 /nfs/dbraw/zinc/78/71/21/1122787121.db2.gz NJSQVJNNACSQJJ-UHFFFAOYSA-N 1 1 268.332 3.602 20 5 CHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCC[C@H]1C(C)(C)C ZINC001195279150 1122860277 /nfs/dbraw/zinc/86/02/77/1122860277.db2.gz NAKHHFBUDJJEIB-KGLIPLIRSA-N 1 1 291.395 3.636 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OCC ZINC000506993992 1122917749 /nfs/dbraw/zinc/91/77/49/1122917749.db2.gz CCWPKMYHXNZIFS-GFCCVEGCSA-N 1 1 280.368 3.614 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H]1CC=CCC1)C1CC1 ZINC000507168993 1122935759 /nfs/dbraw/zinc/93/57/59/1122935759.db2.gz GQVZZYLZHZYZKK-CQSZACIVSA-N 1 1 286.375 3.916 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000729474705 1122967393 /nfs/dbraw/zinc/96/73/93/1122967393.db2.gz MRMJSOJTGQKQKX-AWEZNQCLSA-N 1 1 280.343 3.744 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000729474706 1122967657 /nfs/dbraw/zinc/96/76/57/1122967657.db2.gz MRMJSOJTGQKQKX-CQSZACIVSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H](c1cccnc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183730478 1129090792 /nfs/dbraw/zinc/09/07/92/1129090792.db2.gz KZWLLEZXCVFUJX-MRZGDXHCSA-N 1 1 297.358 3.696 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@H]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000444665979 1124051349 /nfs/dbraw/zinc/05/13/49/1124051349.db2.gz QJQVGBUHZXBIHD-JSGCOSHPSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)nc1 ZINC000877469373 1125030741 /nfs/dbraw/zinc/03/07/41/1125030741.db2.gz TZDWFIZNMYQNTQ-UHFFFAOYSA-N 1 1 299.374 3.547 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)nc1 ZINC000877469373 1125030747 /nfs/dbraw/zinc/03/07/47/1125030747.db2.gz TZDWFIZNMYQNTQ-UHFFFAOYSA-N 1 1 299.374 3.547 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c(F)c1 ZINC000509663743 1125419579 /nfs/dbraw/zinc/41/95/79/1125419579.db2.gz DONAOQWEEVWHMS-MEBBXXQBSA-N 1 1 296.317 3.638 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@H]3CCC[C@H]32)c(F)c1 ZINC000509663743 1125419581 /nfs/dbraw/zinc/41/95/81/1125419581.db2.gz DONAOQWEEVWHMS-MEBBXXQBSA-N 1 1 296.317 3.638 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c(F)c1 ZINC000509663739 1125419624 /nfs/dbraw/zinc/41/96/24/1125419624.db2.gz DONAOQWEEVWHMS-BMIGLBTASA-N 1 1 296.317 3.638 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@H]3CCC[C@@H]32)c(F)c1 ZINC000509663739 1125419625 /nfs/dbraw/zinc/41/96/25/1125419625.db2.gz DONAOQWEEVWHMS-BMIGLBTASA-N 1 1 296.317 3.638 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000741795662 1129454099 /nfs/dbraw/zinc/45/40/99/1129454099.db2.gz QKBHONMNCFYQCU-NEPJUHHUSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)c(C)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169050085 1129691925 /nfs/dbraw/zinc/69/19/25/1129691925.db2.gz YLRCWSAUWKJNFP-IAGOWNOFSA-N 1 1 290.407 3.571 20 5 CHBDMO CC(C)C[C@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001169665267 1129744993 /nfs/dbraw/zinc/74/49/93/1129744993.db2.gz BGILCNVBTWHBCZ-ZDUSSCGKSA-N 1 1 264.369 3.504 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1cncs1 ZINC000768275072 1129849498 /nfs/dbraw/zinc/84/94/98/1129849498.db2.gz JUKGUDZEURPBLQ-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC2(CCCC2)C1 ZINC000769395140 1129908696 /nfs/dbraw/zinc/90/86/96/1129908696.db2.gz NDVCJDBGXSGDJL-ALCCZGGFSA-N 1 1 286.375 3.874 20 5 CHBDMO C[C@]1(O)CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769543388 1129917197 /nfs/dbraw/zinc/91/71/97/1129917197.db2.gz OTZOJZVFPGBVJD-FQEVSTJZSA-N 1 1 291.394 3.950 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)O[NH+]=C(N)CC(C)C ZINC000789591090 1130262163 /nfs/dbraw/zinc/26/21/63/1130262163.db2.gz YZCKNWTYFKWRTL-LLVKDONJSA-N 1 1 279.340 3.509 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])s1 ZINC000754671091 1130324491 /nfs/dbraw/zinc/32/44/91/1130324491.db2.gz YVMUKTALTDMZEY-JTQLQIEISA-N 1 1 294.351 3.955 20 5 CHBDMO CC1=C[C@H](C)C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000797525692 1130990491 /nfs/dbraw/zinc/99/04/91/1130990491.db2.gz COFSAYBBHNRYRQ-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@H](C)C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000797525692 1130990495 /nfs/dbraw/zinc/99/04/95/1130990495.db2.gz COFSAYBBHNRYRQ-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000797526557 1130991216 /nfs/dbraw/zinc/99/12/16/1130991216.db2.gz UMYUHOHRSMNEPZ-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001115984276 1131124678 /nfs/dbraw/zinc/12/46/78/1131124678.db2.gz NGIGNZUCSHERGD-CHWSQXEVSA-N 1 1 292.354 3.746 20 5 CHBDMO C[N@H+]1CCC[C@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001228175679 1131824085 /nfs/dbraw/zinc/82/40/85/1131824085.db2.gz GJABSLZTRKUJDV-INIZCTEOSA-N 1 1 292.382 3.861 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](C2CCCC2)C1 ZINC001171331663 1131853170 /nfs/dbraw/zinc/85/31/70/1131853170.db2.gz KIHFFURCNOWPDL-AWEZNQCLSA-N 1 1 274.364 3.607 20 5 CHBDMO OC[C@H]1CCC[N@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001141722698 1132239391 /nfs/dbraw/zinc/23/93/91/1132239391.db2.gz FJSIXFKFLYAQQT-QGZVFWFLSA-N 1 1 291.394 3.950 20 5 CHBDMO C[C@@H]1C[C@H](O)C[N@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001141722785 1132240001 /nfs/dbraw/zinc/24/00/01/1132240001.db2.gz JDAZJQMXIJBSJY-PBHICJAKSA-N 1 1 291.394 3.948 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCCC[C@H]2F)c1 ZINC000840964092 1132313642 /nfs/dbraw/zinc/31/36/42/1132313642.db2.gz XGXQOZCVFQWJPK-CHWSQXEVSA-N 1 1 286.734 3.619 20 5 CHBDMO C[N@@H+](C1CCCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916348 1132360865 /nfs/dbraw/zinc/36/08/65/1132360865.db2.gz RGJARIRCNMCYIG-INIZCTEOSA-N 1 1 288.391 3.717 20 5 CHBDMO CCCC[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909400 1132371584 /nfs/dbraw/zinc/37/15/84/1132371584.db2.gz RNCKRZSHACGUKS-OAHLLOKOSA-N 1 1 276.380 3.574 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001173223103 1132412376 /nfs/dbraw/zinc/41/23/76/1132412376.db2.gz XRQXYDQSGOXQRC-KBMXLJTQSA-N 1 1 288.391 3.648 20 5 CHBDMO Cc1cccc2c1C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173224390 1132412401 /nfs/dbraw/zinc/41/24/01/1132412401.db2.gz FHZPESFTUUNTKV-AWEZNQCLSA-N 1 1 296.370 3.850 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1CC(F)(F)C1 ZINC001173235020 1132414017 /nfs/dbraw/zinc/41/40/17/1132414017.db2.gz VSUYXOSJUUQLQQ-NSHDSACASA-N 1 1 298.333 3.503 20 5 CHBDMO N[C@@H]1CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000843045907 1132494636 /nfs/dbraw/zinc/49/46/36/1132494636.db2.gz ZAIDSNYVCMUPDX-MRXNPFEDSA-N 1 1 276.383 3.526 20 5 CHBDMO N[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000843045907 1132494642 /nfs/dbraw/zinc/49/46/42/1132494642.db2.gz ZAIDSNYVCMUPDX-MRXNPFEDSA-N 1 1 276.383 3.526 20 5 CHBDMO CCC(CC)C[N@@H+](CC)CCOc1cccc([N+](=O)[O-])c1 ZINC001166998262 1133297604 /nfs/dbraw/zinc/29/76/04/1133297604.db2.gz YIGRXXKUYQHHIA-UHFFFAOYSA-N 1 1 294.395 3.732 20 5 CHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001205489673 1133582537 /nfs/dbraw/zinc/58/25/37/1133582537.db2.gz WVLZQHRUDVDPMW-WFASDCNBSA-N 1 1 276.380 3.832 20 5 CHBDMO CC[C@]1(C)CCC[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353688936 529394982 /nfs/dbraw/zinc/39/49/82/529394982.db2.gz PIMJRBXRUZSJGE-CYBMUJFWSA-N 1 1 268.382 3.668 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353688936 529394986 /nfs/dbraw/zinc/39/49/86/529394986.db2.gz PIMJRBXRUZSJGE-CYBMUJFWSA-N 1 1 268.382 3.668 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccsc1Cl ZINC000312624034 260185012 /nfs/dbraw/zinc/18/50/12/260185012.db2.gz MUJLIWHZTPOXPK-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCC(C)(C)C1 ZINC000344471406 529995302 /nfs/dbraw/zinc/99/53/02/529995302.db2.gz XNTBRYIJFFJLBQ-CQSZACIVSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccc([N+](=O)[O-])cc1 ZINC000035738495 172392029 /nfs/dbraw/zinc/39/20/29/172392029.db2.gz ZOBZJSRJXXTNPU-MNOVXSKESA-N 1 1 260.293 3.600 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCC12CCC2 ZINC000444784687 261178914 /nfs/dbraw/zinc/17/89/14/261178914.db2.gz OMVYBSPBWXRNMK-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO C[C@@H](c1cccs1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000313706514 261461302 /nfs/dbraw/zinc/46/13/02/261461302.db2.gz TUGYRNNXWJDXJJ-JTQLQIEISA-N 1 1 294.351 3.988 20 5 CHBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000313706514 261461304 /nfs/dbraw/zinc/46/13/04/261461304.db2.gz TUGYRNNXWJDXJJ-JTQLQIEISA-N 1 1 294.351 3.988 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC(C)(C)C1 ZINC000497363430 262147029 /nfs/dbraw/zinc/14/70/29/262147029.db2.gz JHLHSUJBDIVVKZ-LBPRGKRZSA-N 1 1 262.353 3.778 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](CC1CC1)C1CCC1 ZINC000475673481 264335296 /nfs/dbraw/zinc/33/52/96/264335296.db2.gz NYTAEKXKAVRTNZ-GQCTYLIASA-N 1 1 286.375 3.873 20 5 CHBDMO CC(C)[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC1CC1 ZINC000535073354 328384250 /nfs/dbraw/zinc/38/42/50/328384250.db2.gz GDRIYHQHFDXRPD-ALCCZGGFSA-N 1 1 274.364 3.728 20 5 CHBDMO C[C@H](c1ccccc1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000532038679 328396885 /nfs/dbraw/zinc/39/68/85/328396885.db2.gz VOCWATCMFAIICM-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](CC2CC2)C1 ZINC000559418266 327244414 /nfs/dbraw/zinc/24/44/14/327244414.db2.gz PQXHUHAVCRLIRI-GXTWGEPZSA-N 1 1 274.364 3.778 20 5 CHBDMO CCSCC[C@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000174026240 329157222 /nfs/dbraw/zinc/15/72/22/329157222.db2.gz XMNOANIIGUFVBQ-LBPRGKRZSA-N 1 1 282.409 3.558 20 5 CHBDMO Cc1occc1C[N@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182687827 329244097 /nfs/dbraw/zinc/24/40/97/329244097.db2.gz RSCGLWDQLQLRFV-LBPRGKRZSA-N 1 1 288.347 3.998 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@@H]2c2cccn2C)cccc1[N+](=O)[O-] ZINC000079865244 330062999 /nfs/dbraw/zinc/06/29/99/330062999.db2.gz PHNHNFYMWZIGQZ-QGZVFWFLSA-N 1 1 299.374 3.579 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](c2ccccc2)C1 ZINC000120184214 330386159 /nfs/dbraw/zinc/38/61/59/330386159.db2.gz QQBKLTGQXJPXMP-OAHLLOKOSA-N 1 1 282.343 3.584 20 5 CHBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)C(C)(F)F ZINC000449414415 330923755 /nfs/dbraw/zinc/92/37/55/330923755.db2.gz LXWAFSSKHQPPOG-GHMZBOCLSA-N 1 1 286.322 3.549 20 5 CHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCC(F)(F)C1 ZINC000450977319 331009693 /nfs/dbraw/zinc/00/96/93/331009693.db2.gz VIIIRLLDMAPMOB-GFCCVEGCSA-N 1 1 298.333 3.505 20 5 CHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCCCF)C2)cc1 ZINC000451543726 331033504 /nfs/dbraw/zinc/03/35/04/331033504.db2.gz CIUABEJMJCVGOR-AWEZNQCLSA-N 1 1 280.343 3.524 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000464777031 331367524 /nfs/dbraw/zinc/36/75/24/331367524.db2.gz LTYFZNCYVXIPRS-INIZCTEOSA-N 1 1 276.380 3.649 20 5 CHBDMO Cc1c(C[N@H+]2C[C@@H](C)CC[C@H]2C)cccc1[N+](=O)[O-] ZINC000464815900 331369297 /nfs/dbraw/zinc/36/92/97/331369297.db2.gz VIWAXFUZDCPGQG-NWDGAFQWSA-N 1 1 262.353 3.524 20 5 CHBDMO CCC[C@@]1(C)CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000464843143 331370771 /nfs/dbraw/zinc/37/07/71/331370771.db2.gz QNCHEPQXVXSTIN-INIZCTEOSA-N 1 1 276.380 3.997 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1Cc2ccccc2C1 ZINC000489096897 332041212 /nfs/dbraw/zinc/04/12/12/332041212.db2.gz MBXFPQYHSDWZHH-CYBMUJFWSA-N 1 1 282.343 3.980 20 5 CHBDMO CCC[N@@H+](CC)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000489108286 332041827 /nfs/dbraw/zinc/04/18/27/332041827.db2.gz VGUHDPVIDOVSDA-GFCCVEGCSA-N 1 1 250.342 3.696 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccccc1 ZINC000489122272 332041990 /nfs/dbraw/zinc/04/19/90/332041990.db2.gz JOXOSAVULMCUPV-CQSZACIVSA-N 1 1 284.359 3.830 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C2CC2)[C@H]2C=CCCC2)cc1 ZINC000490838907 332119104 /nfs/dbraw/zinc/11/91/04/332119104.db2.gz BITDPEGDICMFHI-AWEZNQCLSA-N 1 1 272.348 3.668 20 5 CHBDMO C[C@@H]1c2ccccc2CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000513689858 333032528 /nfs/dbraw/zinc/03/25/28/333032528.db2.gz GAICOPGQLGMNAJ-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000522418962 333286744 /nfs/dbraw/zinc/28/67/44/333286744.db2.gz VZDSXMYEIIKKTH-RHSMWYFYSA-N 1 1 296.370 3.973 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)cc1 ZINC000303538199 333343565 /nfs/dbraw/zinc/34/35/65/333343565.db2.gz HJBADPFFVPEUBD-KRWDZBQOSA-N 1 1 286.375 3.917 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+](C2CC2)C2CCCC2)c(F)c1 ZINC000552087135 334287597 /nfs/dbraw/zinc/28/75/97/334287597.db2.gz OFKXCABJLJHITP-UHFFFAOYSA-N 1 1 296.317 3.780 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+](C2CC2)C2CCCC2)c(F)c1 ZINC000552087135 334287599 /nfs/dbraw/zinc/28/75/99/334287599.db2.gz OFKXCABJLJHITP-UHFFFAOYSA-N 1 1 296.317 3.780 20 5 CHBDMO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000352003051 533738683 /nfs/dbraw/zinc/73/86/83/533738683.db2.gz JSAWEKGNSSGGRQ-NXEZZACHSA-N 1 1 284.306 3.636 20 5 CHBDMO CCC[C@@H]([NH2+]Cc1nccs1)c1cccc([N+](=O)[O-])c1 ZINC000041012391 520786786 /nfs/dbraw/zinc/78/67/86/520786786.db2.gz RMKPORVNIGOTSC-CYBMUJFWSA-N 1 1 291.376 3.682 20 5 CHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000130244762 523118444 /nfs/dbraw/zinc/11/84/44/523118444.db2.gz PATVBNBOSAEXMD-KRWDZBQOSA-N 1 1 299.374 3.615 20 5 CHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000339919920 524201450 /nfs/dbraw/zinc/20/14/50/524201450.db2.gz DSCAZKPFLONZNO-JQWIXIFHSA-N 1 1 268.382 3.667 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1 ZINC000061757124 526085221 /nfs/dbraw/zinc/08/52/21/526085221.db2.gz XLRFBAMRXHAZLD-CYBMUJFWSA-N 1 1 270.332 3.788 20 5 CHBDMO O=[N+]([O-])c1cccc(C[NH2+]C2(c3ccccc3F)CC2)c1 ZINC000076766735 527386237 /nfs/dbraw/zinc/38/62/37/527386237.db2.gz ZPHKRALDLSJOSP-UHFFFAOYSA-N 1 1 286.306 3.513 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000353589531 528092126 /nfs/dbraw/zinc/09/21/26/528092126.db2.gz QFMDYFNDDLYXNH-LBPRGKRZSA-N 1 1 262.353 3.703 20 5 CHBDMO CCOCC[N@@H+](CC)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000352833581 528723448 /nfs/dbraw/zinc/72/34/48/528723448.db2.gz SIHXFHQTWJSJSJ-UHFFFAOYSA-N 1 1 294.395 3.577 20 5 CHBDMO CC1(C)CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000353672320 528938501 /nfs/dbraw/zinc/93/85/01/528938501.db2.gz QCXQZSIIPVPULI-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CCC(C)C ZINC000611515311 1121654219 /nfs/dbraw/zinc/65/42/19/1121654219.db2.gz FVASCICPBDVYAG-CYBMUJFWSA-N 1 1 264.369 3.942 20 5 CHBDMO CC(C)[C@H](c1ccccc1)[N@@H+](C)Cc1cccnc1[N+](=O)[O-] ZINC000886008616 1125635711 /nfs/dbraw/zinc/63/57/11/1125635711.db2.gz QZSQJUJOQFLRMJ-MRXNPFEDSA-N 1 1 299.374 3.819 20 5 CHBDMO OC[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000092763981 1125761468 /nfs/dbraw/zinc/76/14/68/1125761468.db2.gz NDRRVGQNPJMSPF-OAHLLOKOSA-N 1 1 291.394 3.807 20 5 CHBDMO CC1=C(C)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000482458723 1126757749 /nfs/dbraw/zinc/75/77/49/1126757749.db2.gz MMCFREWQODZHPC-ALCCZGGFSA-N 1 1 272.348 3.650 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC(C)=C(C)C2)ccc1[N+](=O)[O-] ZINC000483364405 1126783742 /nfs/dbraw/zinc/78/37/42/1126783742.db2.gz ALVAVLGJAIYLSI-UHFFFAOYSA-N 1 1 290.363 3.536 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)c1ccco1 ZINC000183258312 1126883572 /nfs/dbraw/zinc/88/35/72/1126883572.db2.gz ZHAVKCQADGAHAX-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)Cc1cccc(F)c1 ZINC000487866574 1127044490 /nfs/dbraw/zinc/04/44/90/1127044490.db2.gz HDPZVTGJRMVNFP-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1cccc(F)c1 ZINC000487866574 1127044493 /nfs/dbraw/zinc/04/44/93/1127044493.db2.gz HDPZVTGJRMVNFP-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccnc1 ZINC000270623886 1127058882 /nfs/dbraw/zinc/05/88/82/1127058882.db2.gz DVDUEKRRFSXHGT-ZDUSSCGKSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[N@H+](Cc1ccccn1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000270707219 1127060785 /nfs/dbraw/zinc/06/07/85/1127060785.db2.gz GXZHAPXIRHBGSL-CYBMUJFWSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[N@@H+](Cc1ccccn1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000270707219 1127060789 /nfs/dbraw/zinc/06/07/89/1127060789.db2.gz GXZHAPXIRHBGSL-CYBMUJFWSA-N 1 1 285.347 3.573 20 5 CHBDMO CC(C)[N@@H+](CC[C@@H](C)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000351843771 1127211319 /nfs/dbraw/zinc/21/13/19/1127211319.db2.gz HQFQTUAUNKCUES-GFCCVEGCSA-N 1 1 268.332 3.553 20 5 CHBDMO CC(C)[N@@H+](CCCCF)Cc1ccc([N+](=O)[O-])cc1 ZINC000285959808 1127248519 /nfs/dbraw/zinc/24/85/19/1127248519.db2.gz KMSRRLBUYZRUIQ-UHFFFAOYSA-N 1 1 268.332 3.555 20 5 CHBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)nc1 ZINC000590754359 1127270814 /nfs/dbraw/zinc/27/08/14/1127270814.db2.gz AIUGGGDACFPFSV-AWEZNQCLSA-N 1 1 299.374 3.800 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)nc1 ZINC000590754359 1127270816 /nfs/dbraw/zinc/27/08/16/1127270816.db2.gz AIUGGGDACFPFSV-AWEZNQCLSA-N 1 1 299.374 3.800 20 5 CHBDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573046308 1127281468 /nfs/dbraw/zinc/28/14/68/1127281468.db2.gz XFKRKANPCKCJCA-JSGCOSHPSA-N 1 1 262.353 3.666 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccs2)C2CC2)cc1 ZINC000045751361 1127292976 /nfs/dbraw/zinc/29/29/76/1127292976.db2.gz CKAQZQNJJYAJEG-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO Cc1noc(C[N@@H+]2CCCC[C@H]2CCC(C)C)c1[N+](=O)[O-] ZINC000595385402 1127461524 /nfs/dbraw/zinc/46/15/24/1127461524.db2.gz VGSDTMUKGGVWGO-ZDUSSCGKSA-N 1 1 295.383 3.682 20 5 CHBDMO CCC[C@H]([NH2+]Cc1onc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000595406754 1127461576 /nfs/dbraw/zinc/46/15/76/1127461576.db2.gz BRYMMJICWKMZJG-ZDUSSCGKSA-N 1 1 289.335 3.522 20 5 CHBDMO C[C@@H]([N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000604012213 1127689504 /nfs/dbraw/zinc/68/95/04/1127689504.db2.gz MBPUWGTVMJGFDV-CYBMUJFWSA-N 1 1 294.395 3.730 20 5 CHBDMO CC1CCC([N@@H+](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000061799088 1127718267 /nfs/dbraw/zinc/71/82/67/1127718267.db2.gz LDGQKYDELGYAPC-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000076067347 1127931833 /nfs/dbraw/zinc/93/18/33/1127931833.db2.gz BUOSZHWXDDITOR-GJZGRUSLSA-N 1 1 294.420 3.701 20 5 CHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000076068572 1127933480 /nfs/dbraw/zinc/93/34/80/1127933480.db2.gz GTAYCWJYTPOKQW-UKRRQHHQSA-N 1 1 294.420 3.701 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000544116849 1127959551 /nfs/dbraw/zinc/95/95/51/1127959551.db2.gz KKGCFDFTKBKRJQ-ZIAGYGMSSA-N 1 1 274.364 3.944 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccc(F)cc1 ZINC000544610885 1127978383 /nfs/dbraw/zinc/97/83/83/1127978383.db2.gz CZFDEXBFLGFWHE-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC[C@@]1(C)CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000468136757 1127994753 /nfs/dbraw/zinc/99/47/53/1127994753.db2.gz AMWIOQOJAWDAGU-WFASDCNBSA-N 1 1 262.353 3.778 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C1CC1)C1CCCC1 ZINC000541772434 1128038663 /nfs/dbraw/zinc/03/86/63/1128038663.db2.gz ZHWINQMERABUPV-UHFFFAOYSA-N 1 1 274.364 3.810 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000541772201 1128038732 /nfs/dbraw/zinc/03/87/32/1128038732.db2.gz VXNUWEYDFPACET-KRWDZBQOSA-N 1 1 282.343 3.850 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542001323 1128046646 /nfs/dbraw/zinc/04/66/46/1128046646.db2.gz IIRASHYJFVSQOG-SNVBAGLBSA-N 1 1 270.760 3.726 20 5 CHBDMO Cc1ccc([C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000542315455 1128062943 /nfs/dbraw/zinc/06/29/43/1128062943.db2.gz HTLJJXOBEHAVDP-KRWDZBQOSA-N 1 1 296.370 3.893 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000470178431 1128065264 /nfs/dbraw/zinc/06/52/64/1128065264.db2.gz YKNZYUDJEYOEDW-GERKINCISA-N 1 1 286.375 3.730 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccco1 ZINC000470175316 1128065307 /nfs/dbraw/zinc/06/53/07/1128065307.db2.gz PWJROLPYXWBNJE-UKTHLTGXSA-N 1 1 286.331 3.723 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492558015 1128103644 /nfs/dbraw/zinc/10/36/44/1128103644.db2.gz KCGUJSNWXBZEKV-GFCCVEGCSA-N 1 1 280.368 3.614 20 5 CHBDMO CC(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761506875 1128131891 /nfs/dbraw/zinc/13/18/91/1128131891.db2.gz OLFDQMIMQNTTAZ-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC1CCCCC1 ZINC000916980359 1128467230 /nfs/dbraw/zinc/46/72/30/1128467230.db2.gz KZUJCFRCEGXPAX-UHFFFAOYSA-N 1 1 280.343 3.746 20 5 CHBDMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000917040472 1128468413 /nfs/dbraw/zinc/46/84/13/1128468413.db2.gz QXOTVEXMRDZIHK-AWEZNQCLSA-N 1 1 296.370 3.757 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000563782849 1128478724 /nfs/dbraw/zinc/47/87/24/1128478724.db2.gz ODTXIGVJYUNEJC-LBPRGKRZSA-N 1 1 280.368 3.614 20 5 CHBDMO Cc1c(C[N@H+](C)[C@@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000917096887 1128481170 /nfs/dbraw/zinc/48/11/70/1128481170.db2.gz HKIPXWYTNBDCGR-IUODEOHRSA-N 1 1 276.380 3.914 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C1CCCC1 ZINC000047965392 1128676460 /nfs/dbraw/zinc/67/64/60/1128676460.db2.gz ODEUGXOXJIMWEF-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO CC(C)[C@H]1CCC[N@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705295 1128722709 /nfs/dbraw/zinc/72/27/09/1128722709.db2.gz RUCVNQXHBJLFSO-CYBMUJFWSA-N 1 1 282.771 3.869 20 5 CHBDMO C[N@H+](Cc1cccs1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704878 1128722923 /nfs/dbraw/zinc/72/29/23/1128722923.db2.gz ZOHBRXGQKOFBBH-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[N@@H+](Cc1cccs1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609704878 1128722927 /nfs/dbraw/zinc/72/29/27/1128722927.db2.gz ZOHBRXGQKOFBBH-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609766788 1128724546 /nfs/dbraw/zinc/72/45/46/1128724546.db2.gz QOJZRKRBEKCKEL-ZDUSSCGKSA-N 1 1 262.353 3.607 20 5 CHBDMO C[C@@H](C1CC1)[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000351865160 1117751766 /nfs/dbraw/zinc/75/17/66/1117751766.db2.gz ZWNCLDYQWAXRFE-VIFPVBQESA-N 1 1 296.317 3.636 20 5 CHBDMO C[C@@H](C1CC1)[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000351865160 1117751769 /nfs/dbraw/zinc/75/17/69/1117751769.db2.gz ZWNCLDYQWAXRFE-VIFPVBQESA-N 1 1 296.317 3.636 20 5 CHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610001922 1128734532 /nfs/dbraw/zinc/73/45/32/1128734532.db2.gz LZHPQYKFSHOUEW-ZFWWWQNUSA-N 1 1 276.380 3.995 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610080167 1128737733 /nfs/dbraw/zinc/73/77/33/1128737733.db2.gz LDHCNPBHPNEJJF-AWEZNQCLSA-N 1 1 292.379 3.628 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000430196161 1117846179 /nfs/dbraw/zinc/84/61/79/1117846179.db2.gz QGPUYOOKMMYNSD-MRXNPFEDSA-N 1 1 298.342 3.550 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000430196161 1117846187 /nfs/dbraw/zinc/84/61/87/1117846187.db2.gz QGPUYOOKMMYNSD-MRXNPFEDSA-N 1 1 298.342 3.550 20 5 CHBDMO Cc1c(C[N@@H+]2Cc3ccccc3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000610216314 1117883470 /nfs/dbraw/zinc/88/34/70/1117883470.db2.gz LJMFGEIPDJZBLL-CYBMUJFWSA-N 1 1 296.370 3.850 20 5 CHBDMO COc1ccc(C[N@H+]2CCCC(C)(C)CC2)cc1[N+](=O)[O-] ZINC000610216327 1117883815 /nfs/dbraw/zinc/88/38/15/1117883815.db2.gz NHWFQEOWGBIIPM-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000430289065 1117998689 /nfs/dbraw/zinc/99/86/89/1117998689.db2.gz LKVSNJUUMVQENC-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@@H](C)C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000430289065 1117998692 /nfs/dbraw/zinc/99/86/92/1117998692.db2.gz LKVSNJUUMVQENC-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000359877455 1118007907 /nfs/dbraw/zinc/00/79/07/1118007907.db2.gz PWTGDFWOYHFRJA-CXAGYDPISA-N 1 1 297.358 3.573 20 5 CHBDMO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CO2 ZINC000130747190 1118195033 /nfs/dbraw/zinc/19/50/33/1118195033.db2.gz QENKVXICCJCTAM-BLLLJJGKSA-N 1 1 298.342 3.688 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610080163 1118359817 /nfs/dbraw/zinc/35/98/17/1118359817.db2.gz KKNUKHAMTTWGGS-AWEZNQCLSA-N 1 1 262.353 3.749 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC12CCC2 ZINC000610433302 1118427637 /nfs/dbraw/zinc/42/76/37/1118427637.db2.gz OMJFMLFUSXCJAR-UHFFFAOYSA-N 1 1 290.363 3.510 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC12CCC2 ZINC000610433302 1118427639 /nfs/dbraw/zinc/42/76/39/1118427639.db2.gz OMJFMLFUSXCJAR-UHFFFAOYSA-N 1 1 290.363 3.510 20 5 CHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000307837790 1118471775 /nfs/dbraw/zinc/47/17/75/1118471775.db2.gz RRJRIHVZLSOXTN-CYBMUJFWSA-N 1 1 280.343 3.602 20 5 CHBDMO CC(C)[N@@H+](Cc1ccco1)Cc1cccc([N+](=O)[O-])c1 ZINC000349819193 1119280690 /nfs/dbraw/zinc/28/06/90/1119280690.db2.gz OGKOSLFBVVSIQH-UHFFFAOYSA-N 1 1 274.320 3.598 20 5 CHBDMO C[N@@H+](CCCc1ccccc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000536082952 1119382244 /nfs/dbraw/zinc/38/22/44/1119382244.db2.gz AEBJTBNMUKQBDG-UHFFFAOYSA-N 1 1 298.386 3.702 20 5 CHBDMO CS[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000349958252 1119435909 /nfs/dbraw/zinc/43/59/09/1119435909.db2.gz ARDJFBYENJDQQY-OAHLLOKOSA-N 1 1 294.420 3.621 20 5 CHBDMO C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CCCCCC1 ZINC000603838461 1119615982 /nfs/dbraw/zinc/61/59/82/1119615982.db2.gz NSTDTXDGTBVNJB-UHFFFAOYSA-N 1 1 292.379 3.628 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+]CC=C(Cl)Cl)cc1[N+](=O)[O-] ZINC000407046792 1120035224 /nfs/dbraw/zinc/03/52/24/1120035224.db2.gz HSJSUEVALYXVOJ-VIFPVBQESA-N 1 1 289.162 3.873 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(NCCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000094659345 1120053784 /nfs/dbraw/zinc/05/37/84/1120053784.db2.gz JOBBTRYWDNDKMB-AWEZNQCLSA-N 1 1 291.395 3.580 20 5 CHBDMO CC(C)c1ccc(C[N@H+](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000349613451 1120218826 /nfs/dbraw/zinc/21/88/26/1120218826.db2.gz MKAYUWMQSQFVFG-UHFFFAOYSA-N 1 1 288.347 3.943 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)Cc2ccco2)cc1[N+](=O)[O-] ZINC000349613451 1120218831 /nfs/dbraw/zinc/21/88/31/1120218831.db2.gz MKAYUWMQSQFVFG-UHFFFAOYSA-N 1 1 288.347 3.943 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1ccc(C)c[nH+]1 ZINC000468631810 1120228297 /nfs/dbraw/zinc/22/82/97/1120228297.db2.gz MVVLNVBWIGEZJY-MDWZMJQESA-N 1 1 283.331 3.814 20 5 CHBDMO Cc1cccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000313818934 1120412554 /nfs/dbraw/zinc/41/25/54/1120412554.db2.gz KCEXWDYFQCSPSV-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000313818934 1120412556 /nfs/dbraw/zinc/41/25/56/1120412556.db2.gz KCEXWDYFQCSPSV-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)oc1C ZINC000282343342 1120479828 /nfs/dbraw/zinc/47/98/28/1120479828.db2.gz VJEIKVIEVJNZGZ-NSHDSACASA-N 1 1 274.320 3.655 20 5 CHBDMO Cc1c(C[N@@H+](C)[C@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069066488 1120491695 /nfs/dbraw/zinc/49/16/95/1120491695.db2.gz FFULTBAKWLSLLS-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1c(C[N@H+](C)[C@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069066488 1120491699 /nfs/dbraw/zinc/49/16/99/1120491699.db2.gz FFULTBAKWLSLLS-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000092328213 1120541284 /nfs/dbraw/zinc/54/12/84/1120541284.db2.gz XTAQETAOWVSBRD-VHSXEESVSA-N 1 1 289.335 3.611 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000511857134 1120667055 /nfs/dbraw/zinc/66/70/55/1120667055.db2.gz BUTDIRLCKXFGOS-CABCVRRESA-N 1 1 274.364 3.668 20 5 CHBDMO C[C@H]1CCCCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509141972 1120671774 /nfs/dbraw/zinc/67/17/74/1120671774.db2.gz VTCQGTGPXQRXTK-JTQLQIEISA-N 1 1 284.306 3.638 20 5 CHBDMO C[C@H]1CCCCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509141972 1120671776 /nfs/dbraw/zinc/67/17/76/1120671776.db2.gz VTCQGTGPXQRXTK-JTQLQIEISA-N 1 1 284.306 3.638 20 5 CHBDMO CCCC[N@@H+](CC)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000216453264 1120682480 /nfs/dbraw/zinc/68/24/80/1120682480.db2.gz RQGVYZABRMWNIC-GFCCVEGCSA-N 1 1 250.342 3.778 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000511911042 1120844190 /nfs/dbraw/zinc/84/41/90/1120844190.db2.gz ODMHXBHJYORKLP-GFCCVEGCSA-N 1 1 286.331 3.697 20 5 CHBDMO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1CC1(C)C ZINC001174907156 1121086253 /nfs/dbraw/zinc/08/62/53/1121086253.db2.gz GTKLRMOLVZQQFD-LLVKDONJSA-N 1 1 282.771 3.726 20 5 CHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000707145537 1121449157 /nfs/dbraw/zinc/44/91/57/1121449157.db2.gz RRSNUCFDZSZRPH-AOOOYVTPSA-N 1 1 268.744 3.621 20 5 CHBDMO CCC1(CC)CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC001175898441 1121478493 /nfs/dbraw/zinc/47/84/93/1121478493.db2.gz PGQOLTDJSUHCAQ-UHFFFAOYSA-N 1 1 280.343 3.889 20 5 CHBDMO C[C@H]1CC2(CCC2)C[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000433020754 1121520280 /nfs/dbraw/zinc/52/02/80/1121520280.db2.gz DIVYSIPSQKBRST-ZBKLQPJUSA-N 1 1 286.375 3.873 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H]1CC=CCC1 ZINC000543621600 1121529046 /nfs/dbraw/zinc/52/90/46/1121529046.db2.gz VYKDXKKYXWAPDI-AWEZNQCLSA-N 1 1 274.364 3.691 20 5 CHBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C(C)(C)C(F)F ZINC000619432093 1128991818 /nfs/dbraw/zinc/99/18/18/1128991818.db2.gz SBDXULOOPXCTAK-JTQLQIEISA-N 1 1 286.322 3.549 20 5 CHBDMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC=CCC2)o1 ZINC000611521269 1121653957 /nfs/dbraw/zinc/65/39/57/1121653957.db2.gz ZXRDGUDTZGEADA-UHFFFAOYSA-N 1 1 284.315 3.617 20 5 CHBDMO CCC[N@@H+](CC)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000727821380 1121749606 /nfs/dbraw/zinc/74/96/06/1121749606.db2.gz YUNURILKNCNJEJ-UHFFFAOYSA-N 1 1 295.364 3.561 20 5 CHBDMO CC[C@@H]1C[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000420955973 1122052034 /nfs/dbraw/zinc/05/20/34/1122052034.db2.gz MKOHIPMKTKSGPT-MCIONIFRSA-N 1 1 292.379 3.545 20 5 CHBDMO CC[C@@H]1C[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C[C@H](CC)O1 ZINC000420955973 1122052046 /nfs/dbraw/zinc/05/20/46/1122052046.db2.gz MKOHIPMKTKSGPT-MCIONIFRSA-N 1 1 292.379 3.545 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1cccn1C ZINC000183238338 1129034905 /nfs/dbraw/zinc/03/49/05/1129034905.db2.gz LTOZBYPRNYSQMG-QGZVFWFLSA-N 1 1 299.374 3.579 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000505565880 1122419513 /nfs/dbraw/zinc/41/95/13/1122419513.db2.gz YKYDJDXMVLQXFD-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505629601 1122443153 /nfs/dbraw/zinc/44/31/53/1122443153.db2.gz BGZQURSKWCLZKL-RISCZKNCSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000516558727 1122611366 /nfs/dbraw/zinc/61/13/66/1122611366.db2.gz DGGZWXNVNYJHMI-NWDGAFQWSA-N 1 1 298.333 3.941 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC=C(C)C1 ZINC000437351111 1122629557 /nfs/dbraw/zinc/62/95/57/1122629557.db2.gz YQOJDGUGSWURLR-NTEUORMPSA-N 1 1 272.348 3.650 20 5 CHBDMO CC1(C)CCCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000438350887 1122692413 /nfs/dbraw/zinc/69/24/13/1122692413.db2.gz BJGVCRILQVQUBY-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]1Cc1ccccc1 ZINC000437820740 1122705075 /nfs/dbraw/zinc/70/50/75/1122705075.db2.gz HRNAVBZAWFDAPI-ZBFHGGJFSA-N 1 1 296.370 3.973 20 5 CHBDMO CC[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000518581226 1122768643 /nfs/dbraw/zinc/76/86/43/1122768643.db2.gz BDGWZHZWFQKUQV-OLZOCXBDSA-N 1 1 262.353 3.778 20 5 CHBDMO C/C=C/C[C@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001196612714 1122927453 /nfs/dbraw/zinc/92/74/53/1122927453.db2.gz FFIWYFJSKVSFAU-IBUXWKBASA-N 1 1 292.354 3.912 20 5 CHBDMO CC[N@H+](Cc1occc1C)Cc1cccc([N+](=O)[O-])c1 ZINC000507132343 1122928334 /nfs/dbraw/zinc/92/83/34/1122928334.db2.gz RFCVUROAGXBQPA-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO CC[N@@H+](Cc1occc1C)Cc1cccc([N+](=O)[O-])c1 ZINC000507132343 1122928338 /nfs/dbraw/zinc/92/83/38/1122928338.db2.gz RFCVUROAGXBQPA-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO COc1ccc(C[N@H+]2CCC[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000507136014 1122930519 /nfs/dbraw/zinc/93/05/19/1122930519.db2.gz WREPNHMKLZBENA-AWEZNQCLSA-N 1 1 292.379 3.614 20 5 CHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000507166140 1122932925 /nfs/dbraw/zinc/93/29/25/1122932925.db2.gz CYEXJMQMZOSDSO-CQSZACIVSA-N 1 1 262.353 3.605 20 5 CHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000542631652 1129139037 /nfs/dbraw/zinc/13/90/37/1129139037.db2.gz HRMJHSREPIRWOJ-CQSZACIVSA-N 1 1 262.353 3.749 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@H]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000444665980 1124051420 /nfs/dbraw/zinc/05/14/20/1124051420.db2.gz QJQVGBUHZXBIHD-OCCSQVGLSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H](c1cccs1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000121648858 1124111323 /nfs/dbraw/zinc/11/13/23/1124111323.db2.gz FEVBBOBANLQCBI-LBPRGKRZSA-N 1 1 290.388 3.892 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1cccs1 ZINC000525266917 1124120383 /nfs/dbraw/zinc/12/03/83/1124120383.db2.gz ZTDVSTMVLVSAPO-LBPRGKRZSA-N 1 1 290.388 3.892 20 5 CHBDMO Cc1cccc(N2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)[nH+]1 ZINC000450765310 1125100707 /nfs/dbraw/zinc/10/07/07/1125100707.db2.gz RPLBGCYBWLHOHY-HNNXBMFYSA-N 1 1 297.358 3.682 20 5 CHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000531441448 1125219437 /nfs/dbraw/zinc/21/94/37/1125219437.db2.gz GBYIDNQVIQDRSZ-RHSMWYFYSA-N 1 1 296.370 3.973 20 5 CHBDMO Cc1cncc([C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000879748645 1125230158 /nfs/dbraw/zinc/23/01/58/1125230158.db2.gz MLKAYRKCSURCDS-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1cncc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000879748645 1125230161 /nfs/dbraw/zinc/23/01/61/1125230161.db2.gz MLKAYRKCSURCDS-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO CC(C)=CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000532275083 1125246798 /nfs/dbraw/zinc/24/67/98/1125246798.db2.gz DLYJTUYWQUXINE-UHFFFAOYSA-N 1 1 260.337 3.525 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(CCC2)C1 ZINC000123568421 1125431049 /nfs/dbraw/zinc/43/10/49/1125431049.db2.gz RAEITRLRJNBACW-GFCCVEGCSA-N 1 1 260.337 3.532 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000735311477 1129340608 /nfs/dbraw/zinc/34/06/08/1129340608.db2.gz QRPQBFYANHBHJQ-LBPRGKRZSA-N 1 1 280.343 3.746 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000094774410 1129451613 /nfs/dbraw/zinc/45/16/13/1129451613.db2.gz FDMSMEHLAOSOCM-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO C[N@@H+](CCSC(C)(C)C)CCc1ccccc1[N+](=O)[O-] ZINC000796111409 1129467401 /nfs/dbraw/zinc/46/74/01/1129467401.db2.gz FBCGGHXBCOUJSJ-UHFFFAOYSA-N 1 1 296.436 3.601 20 5 CHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000745947055 1129618772 /nfs/dbraw/zinc/61/87/72/1129618772.db2.gz PUFXPWMAJNMWHK-GFCCVEGCSA-N 1 1 280.343 3.602 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001169724940 1129751188 /nfs/dbraw/zinc/75/11/88/1129751188.db2.gz ZPKBHEDQNWUOMG-ZDUSSCGKSA-N 1 1 294.370 3.992 20 5 CHBDMO CCCCC[N@@H+](C)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329378 1130482972 /nfs/dbraw/zinc/48/29/72/1130482972.db2.gz PTONHCVJVONXCM-CYBMUJFWSA-N 1 1 294.395 3.656 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000694469816 1130787580 /nfs/dbraw/zinc/78/75/80/1130787580.db2.gz REKYYNHICJYGLS-ZDUSSCGKSA-N 1 1 280.343 3.602 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783534586 1130835054 /nfs/dbraw/zinc/83/50/54/1130835054.db2.gz XDNFDMPENFPNFA-JTQLQIEISA-N 1 1 270.760 3.726 20 5 CHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783527034 1130835487 /nfs/dbraw/zinc/83/54/87/1130835487.db2.gz UNTQRXNKDRFKIO-ZDUSSCGKSA-N 1 1 282.771 3.869 20 5 CHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000784515367 1130907597 /nfs/dbraw/zinc/90/75/97/1130907597.db2.gz IXYWBDZUENTPON-LBPRGKRZSA-N 1 1 280.343 3.602 20 5 CHBDMO C[C@@H]1C[C@H](C(C)(C)C)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001170785343 1130990159 /nfs/dbraw/zinc/99/01/59/1130990159.db2.gz ZVTRRTXLPCCJTE-TZMCWYRMSA-N 1 1 291.395 3.636 20 5 CHBDMO CC1=C[C@H](C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000797526253 1130991449 /nfs/dbraw/zinc/99/14/49/1130991449.db2.gz KHOBWAQOUNHHBP-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@H](C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000797526253 1130991455 /nfs/dbraw/zinc/99/14/55/1130991455.db2.gz KHOBWAQOUNHHBP-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000816646317 1131117731 /nfs/dbraw/zinc/11/77/31/1131117731.db2.gz BTWORNNSSHVNIU-NEPJUHHUSA-N 1 1 286.331 3.695 20 5 CHBDMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000816648857 1131120822 /nfs/dbraw/zinc/12/08/22/1131120822.db2.gz QCEQSVUZROAMKV-NWDGAFQWSA-N 1 1 286.331 3.695 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000816648858 1131121037 /nfs/dbraw/zinc/12/10/37/1131121037.db2.gz QCEQSVUZROAMKV-RYUDHWBXSA-N 1 1 286.331 3.695 20 5 CHBDMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C/C=C/Cl)C2)cc1 ZINC000831534529 1131489747 /nfs/dbraw/zinc/48/97/47/1131489747.db2.gz PCRWKCZFSMNRGS-IADWALHJSA-N 1 1 280.755 3.527 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437064 1131563381 /nfs/dbraw/zinc/56/33/81/1131563381.db2.gz SCJROEOKMWIUEV-BXUZGUMPSA-N 1 1 296.317 3.777 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844436103 1131563879 /nfs/dbraw/zinc/56/38/79/1131563879.db2.gz GQIKIGALNHFCQW-RISCZKNCSA-N 1 1 296.317 3.777 20 5 CHBDMO CC[N@@H+](C(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907667 1132350852 /nfs/dbraw/zinc/35/08/52/1132350852.db2.gz HJYJRKQRVLEAOK-HNNXBMFYSA-N 1 1 276.380 3.573 20 5 CHBDMO C[N@@H+](C1CCCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916350 1132359728 /nfs/dbraw/zinc/35/97/28/1132359728.db2.gz RGJARIRCNMCYIG-MRXNPFEDSA-N 1 1 288.391 3.717 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCCC[C@@H]1C ZINC001173227367 1132412804 /nfs/dbraw/zinc/41/28/04/1132412804.db2.gz QGMDUPPVNQFLSF-KBPBESRZSA-N 1 1 276.380 3.790 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1cccs1 ZINC001173225912 1132412823 /nfs/dbraw/zinc/41/28/23/1132412823.db2.gz GRHPBRPBTCKDCS-GFCCVEGCSA-N 1 1 290.388 3.719 20 5 CHBDMO CCC(CC)[N@@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233997 1132414069 /nfs/dbraw/zinc/41/40/69/1132414069.db2.gz NTHYSCWDRDCIIV-LBPRGKRZSA-N 1 1 264.369 3.646 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173235411 1132415659 /nfs/dbraw/zinc/41/56/59/1132415659.db2.gz WSAJJNBAMKFIAF-UKRRQHHQSA-N 1 1 276.380 3.790 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cccc(Cl)c1F ZINC000135237295 1132652279 /nfs/dbraw/zinc/65/22/79/1132652279.db2.gz ZUCAMSVAVPWPTM-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO Cc1[nH+]ccn1-c1ccc(Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC001174478389 1132882290 /nfs/dbraw/zinc/88/22/90/1132882290.db2.gz IEJMQZYYTNXXLE-UHFFFAOYSA-N 1 1 294.314 3.833 20 5 CHBDMO Cc1[nH+]ccn1-c1ccc(Nc2cccc([N+](=O)[O-])c2)cc1 ZINC001204455503 1133450492 /nfs/dbraw/zinc/45/04/92/1133450492.db2.gz DSKYENHMGXHTTE-UHFFFAOYSA-N 1 1 294.314 3.833 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC001204929789 1133502354 /nfs/dbraw/zinc/50/23/54/1133502354.db2.gz CUTAACUAORGMKN-QGZVFWFLSA-N 1 1 299.374 3.877 20 5 CHBDMO CC1(C[N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001205883427 1133627437 /nfs/dbraw/zinc/62/74/37/1133627437.db2.gz VASOJOXWFJTFRE-CQSZACIVSA-N 1 1 274.364 3.574 20 5 CHBDMO Cc1ccc(Nc2cccc3[nH+]cn(C)c32)cc1[N+](=O)[O-] ZINC001213670307 1134477357 /nfs/dbraw/zinc/47/73/57/1134477357.db2.gz STFDJUZANCPOJG-UHFFFAOYSA-N 1 1 282.303 3.534 20 5 CHBDMO Cc1c(C[NH2+]Cc2ccsc2Cl)cccc1[N+](=O)[O-] ZINC000312559776 260149026 /nfs/dbraw/zinc/14/90/26/260149026.db2.gz MXOVOYPLKRMHCX-UHFFFAOYSA-N 1 1 296.779 3.908 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426766154 260213765 /nfs/dbraw/zinc/21/37/65/260213765.db2.gz XGDXLKBVGJBSCW-YUELXQCFSA-N 1 1 274.364 3.778 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1ccco1 ZINC000182599170 261945448 /nfs/dbraw/zinc/94/54/48/261945448.db2.gz YEMPJJHNERNUFU-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)Cc1ccco1 ZINC000182599170 261945449 /nfs/dbraw/zinc/94/54/49/261945449.db2.gz YEMPJJHNERNUFU-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000514095298 263273814 /nfs/dbraw/zinc/27/38/14/263273814.db2.gz QNKRIMVWEPTIOA-AWEZNQCLSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]([N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000534349903 328047593 /nfs/dbraw/zinc/04/75/93/328047593.db2.gz AWADKSQPNUSLEK-AORWBKJGSA-N 1 1 276.380 3.974 20 5 CHBDMO CC(C)[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC1CC1 ZINC000535073355 328384450 /nfs/dbraw/zinc/38/44/50/328384450.db2.gz GDRIYHQHFDXRPD-FNORWQNLSA-N 1 1 274.364 3.728 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000255733288 327011118 /nfs/dbraw/zinc/01/11/18/327011118.db2.gz OIFHKGFXDZASNC-XQRVVYSFSA-N 1 1 286.375 3.728 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)cs1 ZINC000177187993 329181659 /nfs/dbraw/zinc/18/16/59/329181659.db2.gz RLCOAYAAQJYDRG-NWDGAFQWSA-N 1 1 298.433 3.516 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCS[C@@H]3CCCC[C@@H]32)cs1 ZINC000177187993 329181661 /nfs/dbraw/zinc/18/16/61/329181661.db2.gz RLCOAYAAQJYDRG-NWDGAFQWSA-N 1 1 298.433 3.516 20 5 CHBDMO CC[C@@H](C)C[N@@H+](CC)Cc1csc([N+](=O)[O-])c1 ZINC000177858147 329193187 /nfs/dbraw/zinc/19/31/87/329193187.db2.gz PGLNEPSJQFKWAE-SNVBAGLBSA-N 1 1 256.371 3.524 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)[C@H]1C1CC1 ZINC000580491070 330348533 /nfs/dbraw/zinc/34/85/33/330348533.db2.gz CUQHYJQNFRHHSC-OAHLLOKOSA-N 1 1 274.364 3.524 20 5 CHBDMO Cc1cnc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000122937718 330432988 /nfs/dbraw/zinc/43/29/88/330432988.db2.gz GMRDKQGSHPCSDN-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO Cc1c(C[N@H+]2C[C@H](C)CC[C@H]2C)cccc1[N+](=O)[O-] ZINC000464815904 331369451 /nfs/dbraw/zinc/36/94/51/331369451.db2.gz VIWAXFUZDCPGQG-VXGBXAGGSA-N 1 1 262.353 3.524 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1cc(C)cc[nH+]1 ZINC000468628356 331437693 /nfs/dbraw/zinc/43/76/93/331437693.db2.gz DNXZMPLCZFEHLP-JYRVWZFOSA-N 1 1 283.331 3.814 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CC1CCC1 ZINC000489233484 332044116 /nfs/dbraw/zinc/04/41/16/332044116.db2.gz PZJPUJJDFUVNPF-GFCCVEGCSA-N 1 1 262.353 3.696 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490056124 332078968 /nfs/dbraw/zinc/07/89/68/332078968.db2.gz DVDHVURQDAGVGC-AWEZNQCLSA-N 1 1 292.379 3.758 20 5 CHBDMO CC[C@H]1C[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CCS1 ZINC000490088539 332080778 /nfs/dbraw/zinc/08/07/78/332080778.db2.gz OWZRDLMMELKVNA-OCCSQVGLSA-N 1 1 294.420 3.792 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000522046689 333231537 /nfs/dbraw/zinc/23/15/37/333231537.db2.gz DWXOHDHFIUCIPT-DGCLKSJQSA-N 1 1 262.353 3.524 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2c2ccccc2)cc1 ZINC000522269143 333277138 /nfs/dbraw/zinc/27/71/38/333277138.db2.gz DOOYNEHBLFJBHS-GOSISDBHSA-N 1 1 296.370 3.974 20 5 CHBDMO CCC(CC)[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000522475166 333287732 /nfs/dbraw/zinc/28/77/32/333287732.db2.gz NRADYEWQZGLTPJ-UHFFFAOYSA-N 1 1 292.379 3.627 20 5 CHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000523702135 333340200 /nfs/dbraw/zinc/34/02/00/333340200.db2.gz UZKAOHZPXLBTOK-GOSISDBHSA-N 1 1 296.370 3.757 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1C(C)C ZINC000303695037 333345478 /nfs/dbraw/zinc/34/54/78/333345478.db2.gz QMRDZEVTDXWACF-HNNXBMFYSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000524766731 333387334 /nfs/dbraw/zinc/38/73/34/333387334.db2.gz NKOAZLPAOGNKJN-HNNXBMFYSA-N 1 1 262.353 3.607 20 5 CHBDMO O=[N+]([O-])c1ccc(CCNc2cccc3cc[nH+]cc32)cc1 ZINC000542731389 333838521 /nfs/dbraw/zinc/83/85/21/333838521.db2.gz GCAQAHKGFDWWID-UHFFFAOYSA-N 1 1 293.326 3.798 20 5 CHBDMO Cc1cnc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000135158990 334118334 /nfs/dbraw/zinc/11/83/34/334118334.db2.gz RHDKOEPMYQDXAX-GHMZBOCLSA-N 1 1 291.376 3.772 20 5 CHBDMO C[C@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000081574989 334197656 /nfs/dbraw/zinc/19/76/56/334197656.db2.gz IXUVUQQYJLEODE-GUYCJALGSA-N 1 1 282.343 3.788 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000081574989 334197657 /nfs/dbraw/zinc/19/76/57/334197657.db2.gz IXUVUQQYJLEODE-GUYCJALGSA-N 1 1 282.343 3.788 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)C1CCCC1 ZINC000551585205 334255164 /nfs/dbraw/zinc/25/51/64/334255164.db2.gz BNYPMGPDHLJGGJ-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000552274178 334311264 /nfs/dbraw/zinc/31/12/64/334311264.db2.gz DSJRJKVPMWUAEO-KRWDZBQOSA-N 1 1 296.370 3.974 20 5 CHBDMO CC[N@@H+](CCC1CC1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000577252207 335329959 /nfs/dbraw/zinc/32/99/59/335329959.db2.gz WJOZYKJWFVTPHP-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000352003050 533829792 /nfs/dbraw/zinc/82/97/92/533829792.db2.gz JSAWEKGNSSGGRQ-AOOOYVTPSA-N 1 1 284.306 3.636 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000352003050 533829797 /nfs/dbraw/zinc/82/97/97/533829797.db2.gz JSAWEKGNSSGGRQ-AOOOYVTPSA-N 1 1 284.306 3.636 20 5 CHBDMO CO[C@]1(C)CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000280495956 521752919 /nfs/dbraw/zinc/75/29/19/521752919.db2.gz MOKFQNORUOMEGB-CZUORRHYSA-N 1 1 292.379 3.547 20 5 CHBDMO Cc1ccc(C[N@@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000066561431 524400261 /nfs/dbraw/zinc/40/02/61/524400261.db2.gz FGFIULXYDYXLKD-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000066561431 524400269 /nfs/dbraw/zinc/40/02/69/524400269.db2.gz FGFIULXYDYXLKD-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc(C[N@@H+](C)[C@H](C)c2ccco2)cc1[N+](=O)[O-] ZINC000131063149 524401167 /nfs/dbraw/zinc/40/11/67/524401167.db2.gz GCIZWVXJFLPEOB-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H](C)c2ccco2)cc1[N+](=O)[O-] ZINC000131063149 524401178 /nfs/dbraw/zinc/40/11/78/524401178.db2.gz GCIZWVXJFLPEOB-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000289378266 524451872 /nfs/dbraw/zinc/45/18/72/524451872.db2.gz BNIBKMPIQIXNHI-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000289378266 524451877 /nfs/dbraw/zinc/45/18/77/524451877.db2.gz BNIBKMPIQIXNHI-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1c(C[N@H+](C)[C@H](C)C2CCC2)cccc1[N+](=O)[O-] ZINC000357026872 525703184 /nfs/dbraw/zinc/70/31/84/525703184.db2.gz RGKJTOXVLOVTAO-GFCCVEGCSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@H](c1ccco1)[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000086234349 526147767 /nfs/dbraw/zinc/14/77/67/526147767.db2.gz QJRRSACSPGLUJI-GFCCVEGCSA-N 1 1 286.331 3.913 20 5 CHBDMO C[C@H](c1ccco1)[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000086234349 526147771 /nfs/dbraw/zinc/14/77/71/526147771.db2.gz QJRRSACSPGLUJI-GFCCVEGCSA-N 1 1 286.331 3.913 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000127380515 527396372 /nfs/dbraw/zinc/39/63/72/527396372.db2.gz QGIHJHPYHGGXNZ-BBOMDTFKSA-N 1 1 297.358 3.773 20 5 CHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000547747054 1117996458 /nfs/dbraw/zinc/99/64/58/1117996458.db2.gz AICDNNCFNFAFRM-CMPLNLGQSA-N 1 1 268.382 3.667 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cn1)c1cccc([N+](=O)[O-])c1 ZINC000147771273 1125506215 /nfs/dbraw/zinc/50/62/15/1125506215.db2.gz REIORKNZLUNDLR-MNOVXSKESA-N 1 1 289.310 3.541 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1ccc([N+](=O)[O-])cc1 ZINC000584743913 1121162955 /nfs/dbraw/zinc/16/29/55/1121162955.db2.gz KGSBNCCAYWVKQA-UHFFFAOYSA-N 1 1 250.342 3.605 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000543628051 1121533864 /nfs/dbraw/zinc/53/38/64/1121533864.db2.gz KCJHPXYRLNEVJW-CQSZACIVSA-N 1 1 262.353 3.668 20 5 CHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)CC1CCCCC1 ZINC000515040025 1122472691 /nfs/dbraw/zinc/47/26/91/1122472691.db2.gz QAZFNKRPHVSRHB-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000135191138 1125581501 /nfs/dbraw/zinc/58/15/01/1125581501.db2.gz RMAFREHOFWTVKO-GFCCVEGCSA-N 1 1 282.771 3.726 20 5 CHBDMO CC[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000533504896 1125611686 /nfs/dbraw/zinc/61/16/86/1125611686.db2.gz IVRHKXSQFOXBAE-LBPRGKRZSA-N 1 1 280.368 3.612 20 5 CHBDMO Cc1coc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000886125286 1125653224 /nfs/dbraw/zinc/65/32/24/1125653224.db2.gz NBIRWTHSTIIMLW-UHFFFAOYSA-N 1 1 274.320 3.521 20 5 CHBDMO CC[C@H]1CCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746666079 1130142464 /nfs/dbraw/zinc/14/24/64/1130142464.db2.gz IJMUDUJTCZQUBZ-LBPRGKRZSA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)n1 ZINC000159881159 1126756812 /nfs/dbraw/zinc/75/68/12/1126756812.db2.gz IGYIESNDYXJVAW-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)n1 ZINC000159881159 1126756816 /nfs/dbraw/zinc/75/68/16/1126756816.db2.gz IGYIESNDYXJVAW-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO COc1cc(C[N@H+]2CCCC[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000485554228 1126924779 /nfs/dbraw/zinc/92/47/79/1126924779.db2.gz UTYFCJBSMGSSDD-AWEZNQCLSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1c1cccnc1 ZINC000348927315 1127134875 /nfs/dbraw/zinc/13/48/75/1127134875.db2.gz ZXDFKHFBSSWZDA-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO CC[C@H](C)[N@@H+](CC)Cc1cccc([N+](=O)[O-])c1C ZINC000595592012 1127154779 /nfs/dbraw/zinc/15/47/79/1127154779.db2.gz AHVYFIDNUPBAHP-NSHDSACASA-N 1 1 250.342 3.524 20 5 CHBDMO Cc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)nc1 ZINC000156321770 1127151128 /nfs/dbraw/zinc/15/11/28/1127151128.db2.gz TVGLOKIECXTKRD-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C2CC2)C1 ZINC000589209277 1127216502 /nfs/dbraw/zinc/21/65/02/1127216502.db2.gz BQERHARHQDWWIM-HNNXBMFYSA-N 1 1 274.364 3.525 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@H](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000590378138 1127257019 /nfs/dbraw/zinc/25/70/19/1127257019.db2.gz IQNGWCQZFRHOQW-OAHLLOKOSA-N 1 1 274.364 3.525 20 5 CHBDMO CS[C@H]1CCCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000355216294 1127326098 /nfs/dbraw/zinc/32/60/98/1127326098.db2.gz UWYPFPZFZWALLC-AWEZNQCLSA-N 1 1 294.420 3.621 20 5 CHBDMO Cc1ccccc1C1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000592139398 1127338522 /nfs/dbraw/zinc/33/85/22/1127338522.db2.gz CZABYKQLBKOUML-UHFFFAOYSA-N 1 1 288.372 3.744 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595562813 1127465729 /nfs/dbraw/zinc/46/57/29/1127465729.db2.gz RCDXIWCSHGBELC-WHOFXGATSA-N 1 1 260.337 3.530 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)C1(C)CC1 ZINC000360027081 1127486755 /nfs/dbraw/zinc/48/67/55/1127486755.db2.gz DBBRQDHWRSERFX-SNVBAGLBSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000060562504 1127544727 /nfs/dbraw/zinc/54/47/27/1127544727.db2.gz WAOSZAWMZYFBEC-STQMWFEESA-N 1 1 276.380 3.994 20 5 CHBDMO Cc1cccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1F ZINC000295367920 1127638433 /nfs/dbraw/zinc/63/84/33/1127638433.db2.gz JQHMMMQGEJUREZ-GFCCVEGCSA-N 1 1 288.322 3.893 20 5 CHBDMO Cc1c(C[N@H+](CCC(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000061185906 1127663570 /nfs/dbraw/zinc/66/35/70/1127663570.db2.gz CCILQAKOMBEPLP-UHFFFAOYSA-N 1 1 276.380 3.914 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000603847294 1127676028 /nfs/dbraw/zinc/67/60/28/1127676028.db2.gz PDUKWLZXSQMMHV-KMFMINBZSA-N 1 1 288.391 3.995 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000599570100 1127679879 /nfs/dbraw/zinc/67/98/79/1127679879.db2.gz UJZIMNUUQBXXOC-KRWDZBQOSA-N 1 1 297.358 3.621 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553515 1127680232 /nfs/dbraw/zinc/68/02/32/1127680232.db2.gz XYXICHFNSNRDEX-GLQYFDAESA-N 1 1 292.404 3.626 20 5 CHBDMO CC[N@@H+](CCc1ccccc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000603889853 1127680641 /nfs/dbraw/zinc/68/06/41/1127680641.db2.gz ZPSYNIZEGDMRNI-UHFFFAOYSA-N 1 1 298.386 3.702 20 5 CHBDMO Cc1c(C[N@@H+]2CCC(F)(F)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000599624844 1127685432 /nfs/dbraw/zinc/68/54/32/1127685432.db2.gz ZWINNZOZXWRRSB-JTQLQIEISA-N 1 1 284.306 3.523 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012772 1127689646 /nfs/dbraw/zinc/68/96/46/1127689646.db2.gz YTFFGZSKAWOUGV-AWEZNQCLSA-N 1 1 292.379 3.628 20 5 CHBDMO CC(C)(C)C1=CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000535375154 1127913775 /nfs/dbraw/zinc/91/37/75/1127913775.db2.gz QDCPYBAYNOCACA-UHFFFAOYSA-N 1 1 274.364 3.773 20 5 CHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000466903939 1127949735 /nfs/dbraw/zinc/94/97/35/1127949735.db2.gz BALZSDCOPXRKLB-SMDDNHRTSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@]1(C)CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000468136755 1127994546 /nfs/dbraw/zinc/99/45/46/1127994546.db2.gz AMWIOQOJAWDAGU-IUODEOHRSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)CC1 ZINC000468148316 1127995198 /nfs/dbraw/zinc/99/51/98/1127995198.db2.gz VJCCREBXFCUBJF-OLZOCXBDSA-N 1 1 262.353 3.778 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000541774613 1128038780 /nfs/dbraw/zinc/03/87/80/1128038780.db2.gz XQQPQVCICLDXRA-CYBMUJFWSA-N 1 1 262.353 3.525 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCC1CC1 ZINC000470172509 1128064317 /nfs/dbraw/zinc/06/43/17/1128064317.db2.gz XWDXNXSKROGDGW-JLHYYAGUSA-N 1 1 274.364 3.730 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](C)C1 ZINC000470175901 1128064584 /nfs/dbraw/zinc/06/45/84/1128064584.db2.gz TUGRBAIGFWBRIG-FYQHACEVSA-N 1 1 274.364 3.730 20 5 CHBDMO CCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000470174974 1128065021 /nfs/dbraw/zinc/06/50/21/1128065021.db2.gz XGPYYVZQGVZBDT-JLHYYAGUSA-N 1 1 274.364 3.873 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC[C@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000492543308 1128102456 /nfs/dbraw/zinc/10/24/56/1128102456.db2.gz ZCCQPXOMLZKPCL-AWEZNQCLSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@@H](C)C[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492629930 1128106332 /nfs/dbraw/zinc/10/63/32/1128106332.db2.gz KZSJRYOLCYNSFO-JSGCOSHPSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](C2CC2)C1 ZINC000492785039 1128112927 /nfs/dbraw/zinc/11/29/27/1128112927.db2.gz RWKPQAQALHQXDJ-OCCSQVGLSA-N 1 1 274.364 3.696 20 5 CHBDMO CC(C)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761514360 1128133144 /nfs/dbraw/zinc/13/31/44/1128133144.db2.gz IACHBXXQHMSMDC-LBPRGKRZSA-N 1 1 282.771 3.726 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494189614 1128159824 /nfs/dbraw/zinc/15/98/24/1128159824.db2.gz STYIKJIYIYIZRD-SNVBAGLBSA-N 1 1 270.760 3.725 20 5 CHBDMO CC[N@H+](Cc1cccs1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000193589228 1128322204 /nfs/dbraw/zinc/32/22/04/1128322204.db2.gz MLMKLZHAVGDXGD-UHFFFAOYSA-N 1 1 294.351 3.818 20 5 CHBDMO CC[N@@H+](Cc1cccs1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000193589228 1128322209 /nfs/dbraw/zinc/32/22/09/1128322209.db2.gz MLMKLZHAVGDXGD-UHFFFAOYSA-N 1 1 294.351 3.818 20 5 CHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000915685330 1128334236 /nfs/dbraw/zinc/33/42/36/1128334236.db2.gz VEFPDVRKNMDXGB-RISCZKNCSA-N 1 1 280.343 3.744 20 5 CHBDMO C[N@H+]1CCCC[C@H]1CCOc1ccc(Cl)cc1[N+](=O)[O-] ZINC000915666825 1128333611 /nfs/dbraw/zinc/33/36/11/1128333611.db2.gz IZDSWOITWDYXGE-LBPRGKRZSA-N 1 1 298.770 3.501 20 5 CHBDMO O=[N+]([O-])c1cccc(CNc2cccc3cc[nH+]cc32)c1 ZINC000094967282 1128351696 /nfs/dbraw/zinc/35/16/96/1128351696.db2.gz DSOFJPHQBNIQBZ-UHFFFAOYSA-N 1 1 279.299 3.755 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000916152975 1128409159 /nfs/dbraw/zinc/40/91/59/1128409159.db2.gz ZYHVBMULOQJYLR-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO Cc1c(C[N@H+](C)[C@H]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000917096889 1128481309 /nfs/dbraw/zinc/48/13/09/1128481309.db2.gz HKIPXWYTNBDCGR-WFASDCNBSA-N 1 1 276.380 3.914 20 5 CHBDMO CCC(CC)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000570551741 1128625814 /nfs/dbraw/zinc/62/58/14/1128625814.db2.gz OHBPQUAYGPPYID-UHFFFAOYSA-N 1 1 264.369 3.505 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000556959515 1128652738 /nfs/dbraw/zinc/65/27/38/1128652738.db2.gz XDECYZPDIWANFE-AWEZNQCLSA-N 1 1 274.364 3.525 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2c2ccsc2)cc1 ZINC000046089184 1128658513 /nfs/dbraw/zinc/65/85/13/1128658513.db2.gz BTURIXHEKRAKOW-HNNXBMFYSA-N 1 1 288.372 3.993 20 5 CHBDMO CC1(C)C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]2CCC[C@H]21 ZINC000557055460 1128664194 /nfs/dbraw/zinc/66/41/94/1128664194.db2.gz NEUDQBYXNCUSSX-VXGBXAGGSA-N 1 1 280.393 3.667 20 5 CHBDMO Cc1ccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)o1 ZINC000047630685 1128672108 /nfs/dbraw/zinc/67/21/08/1128672108.db2.gz WFYBDLYWNQZCMW-UHFFFAOYSA-N 1 1 288.347 3.907 20 5 CHBDMO Cc1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000601304442 1128708761 /nfs/dbraw/zinc/70/87/61/1128708761.db2.gz OVISSGDLKOKZFS-GFCCVEGCSA-N 1 1 274.320 3.655 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609631873 1128721080 /nfs/dbraw/zinc/72/10/80/1128721080.db2.gz BPKRWLMLQKSMLZ-CYBMUJFWSA-N 1 1 294.370 3.992 20 5 CHBDMO CCC1CC[NH+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609705218 1128722607 /nfs/dbraw/zinc/72/26/07/1128722607.db2.gz HCSPRPHJECLTMQ-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H]1C1CC1 ZINC000609705065 1128722840 /nfs/dbraw/zinc/72/28/40/1128722840.db2.gz MOXUZTWYHLEEOT-CYBMUJFWSA-N 1 1 280.755 3.623 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000609766759 1128724794 /nfs/dbraw/zinc/72/47/94/1128724794.db2.gz OGRRFVRODVCYKG-AWEZNQCLSA-N 1 1 276.380 3.915 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609846135 1128728594 /nfs/dbraw/zinc/72/85/94/1128728594.db2.gz DTSJJXCUAUPRRI-XNRPHZJLSA-N 1 1 274.364 3.748 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000430193999 1117841368 /nfs/dbraw/zinc/84/13/68/1117841368.db2.gz HSARYLYYBFSMDN-JSGCOSHPSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2c2cccs2)cc1 ZINC000014672859 1117859705 /nfs/dbraw/zinc/85/97/05/1117859705.db2.gz ZGGOMNCXKHKFCT-CQSZACIVSA-N 1 1 288.372 3.993 20 5 CHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000610215370 1117882538 /nfs/dbraw/zinc/88/25/38/1117882538.db2.gz JETLCCMMILJNBH-CHWSQXEVSA-N 1 1 262.353 3.605 20 5 CHBDMO CC1(C)CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000610216319 1117883147 /nfs/dbraw/zinc/88/31/47/1117883147.db2.gz MMCCIEUUCGEKEG-UHFFFAOYSA-N 1 1 280.343 3.746 20 5 CHBDMO Cc1ccc(CNc2ccc(C3CCC3)c[nH+]2)cc1[N+](=O)[O-] ZINC000339567506 1117883898 /nfs/dbraw/zinc/88/38/98/1117883898.db2.gz UWNYWFDQVAUNSL-UHFFFAOYSA-N 1 1 297.358 3.600 20 5 CHBDMO C[C@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000359864335 1118006825 /nfs/dbraw/zinc/00/68/25/1118006825.db2.gz ABOSACPGDLRGCB-GUYCJALGSA-N 1 1 297.358 3.573 20 5 CHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000359864334 1118007493 /nfs/dbraw/zinc/00/74/93/1118007493.db2.gz ABOSACPGDLRGCB-DYVFJYSZSA-N 1 1 297.358 3.573 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1(C)C ZINC000801539817 1128759384 /nfs/dbraw/zinc/75/93/84/1128759384.db2.gz BEHAFUNFNLXLQZ-LLVKDONJSA-N 1 1 280.343 3.602 20 5 CHBDMO CC[C@@H](C)C[N@@H+](CC)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083243351 1118368142 /nfs/dbraw/zinc/36/81/42/1118368142.db2.gz OCANCBWFLPELBC-LLVKDONJSA-N 1 1 291.351 3.604 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)CC2CC2)cc1[N+](=O)[O-] ZINC000510410154 1118575393 /nfs/dbraw/zinc/57/53/93/1118575393.db2.gz GUUCPGJYPLCFOR-UHFFFAOYSA-N 1 1 262.353 3.560 20 5 CHBDMO C[N@@H+](CCCNc1sccc1[N+](=O)[O-])C1CCCCC1 ZINC000302001265 1118694708 /nfs/dbraw/zinc/69/47/08/1118694708.db2.gz RYLHHWPOPQZHET-UHFFFAOYSA-N 1 1 297.424 3.723 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C2CC2)C2CCCCC2)cc1 ZINC000047904771 1118708305 /nfs/dbraw/zinc/70/83/05/1118708305.db2.gz PMWVHEQICHRNNH-UHFFFAOYSA-N 1 1 274.364 3.892 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610580680 1118778280 /nfs/dbraw/zinc/77/82/80/1118778280.db2.gz BTRKVVWQOQEGHJ-NSHDSACASA-N 1 1 289.335 3.501 20 5 CHBDMO CC1=C[C@H](C)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000430882974 1118783533 /nfs/dbraw/zinc/78/35/33/1118783533.db2.gz NXZXLMZVOCNBNB-IYNGYCSASA-N 1 1 272.348 3.506 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC(C)=C[C@H](C)C1 ZINC000430884416 1118783549 /nfs/dbraw/zinc/78/35/49/1118783549.db2.gz WOVIVUADSIDVHU-LIOBOASVSA-N 1 1 286.375 3.896 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccccc1F ZINC000084439721 1118943075 /nfs/dbraw/zinc/94/30/75/1118943075.db2.gz AWKNGIHGTDRXFO-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO CCC[C@@]1(C)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001167508869 1118968691 /nfs/dbraw/zinc/96/86/91/1118968691.db2.gz JLUAUGADUSBKOL-INIZCTEOSA-N 1 1 276.380 3.997 20 5 CHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC1 ZINC000127450629 1118988542 /nfs/dbraw/zinc/98/85/42/1118988542.db2.gz MOKWTXBVULZIES-UHFFFAOYSA-N 1 1 286.331 3.839 20 5 CHBDMO CC(C)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001167655901 1119301266 /nfs/dbraw/zinc/30/12/66/1119301266.db2.gz CNNJDFCVSFQLTQ-NSHDSACASA-N 1 1 282.771 3.726 20 5 CHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000219701589 1119511448 /nfs/dbraw/zinc/51/14/48/1119511448.db2.gz GCPYBZDXSAHDSB-JSGCOSHPSA-N 1 1 262.353 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC2(CCC2)C1 ZINC000176928102 1119629804 /nfs/dbraw/zinc/62/98/04/1119629804.db2.gz IJEAVHCJYILOJG-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000466921101 1119819616 /nfs/dbraw/zinc/81/96/16/1119819616.db2.gz ILQYIWABUMYZKQ-OKILXGFUSA-N 1 1 292.379 3.627 20 5 CHBDMO C[C@H]([NH2+]Cc1cnc(Cl)s1)c1cccc([N+](=O)[O-])c1 ZINC000180456457 1119993820 /nfs/dbraw/zinc/99/38/20/1119993820.db2.gz VUUUFUSPKUCPKG-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO Cc1ccccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000542700462 1120123294 /nfs/dbraw/zinc/12/32/94/1120123294.db2.gz SSPMLYDMOVWPQM-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO CC[C@@H](Nc1cc(C)cc[nH+]1)c1cccc([N+](=O)[O-])c1 ZINC000301648289 1120245235 /nfs/dbraw/zinc/24/52/35/1120245235.db2.gz OUEVVJKIIUMHFT-CQSZACIVSA-N 1 1 271.320 3.861 20 5 CHBDMO C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]12 ZINC000542974918 1120304600 /nfs/dbraw/zinc/30/46/00/1120304600.db2.gz FWFFUPCSSBJMNE-XYPHTWIQSA-N 1 1 288.391 3.648 20 5 CHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000067661163 1120446547 /nfs/dbraw/zinc/44/65/47/1120446547.db2.gz OLUYLVTVCKNXLG-JTQLQIEISA-N 1 1 256.371 3.523 20 5 CHBDMO Cc1ccsc1C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000093338297 1120557981 /nfs/dbraw/zinc/55/79/81/1120557981.db2.gz TYHKGTRUBIEOQW-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1ccsc1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000093338297 1120557984 /nfs/dbraw/zinc/55/79/84/1120557984.db2.gz TYHKGTRUBIEOQW-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1cnc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000124319799 1120563678 /nfs/dbraw/zinc/56/36/78/1120563678.db2.gz XVDVMRILLBVJDH-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC000348540625 1120630937 /nfs/dbraw/zinc/63/09/37/1120630937.db2.gz ZXCWCIHUYRGPKS-INIZCTEOSA-N 1 1 268.316 3.542 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H]2c2ccccc2)c1 ZINC000348540625 1120630939 /nfs/dbraw/zinc/63/09/39/1120630939.db2.gz ZXCWCIHUYRGPKS-INIZCTEOSA-N 1 1 268.316 3.542 20 5 CHBDMO CC[N@H+](Cc1ccoc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000092935835 1120639125 /nfs/dbraw/zinc/63/91/25/1120639125.db2.gz MKAQJMPUOZJNJC-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO CC[N@@H+](Cc1ccoc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000092935835 1120639130 /nfs/dbraw/zinc/63/91/30/1120639130.db2.gz MKAQJMPUOZJNJC-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000511855394 1120665664 /nfs/dbraw/zinc/66/56/64/1120665664.db2.gz OAPZQBQDEIWROY-QVDQZQSHSA-N 1 1 286.375 3.873 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@@H]1CC1(C)C ZINC001174908299 1121086958 /nfs/dbraw/zinc/08/69/58/1121086958.db2.gz ZAACLRWAYGBKJU-OLZOCXBDSA-N 1 1 276.380 3.942 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000509535928 1121387863 /nfs/dbraw/zinc/38/78/63/1121387863.db2.gz AEDVNCQHEJFENM-VIIAAUOXSA-N 1 1 274.364 3.730 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000708505702 1121468463 /nfs/dbraw/zinc/46/84/63/1121468463.db2.gz ZVLURCZGZOHWCV-GFCCVEGCSA-N 1 1 280.343 3.746 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000512622156 1121495312 /nfs/dbraw/zinc/49/53/12/1121495312.db2.gz JRJCEUDGROMYBL-OAHLLOKOSA-N 1 1 274.364 3.668 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000543628694 1121535043 /nfs/dbraw/zinc/53/50/43/1121535043.db2.gz WFKTWDCVAMXVLX-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCc1ccccc1 ZINC000543630264 1121535477 /nfs/dbraw/zinc/53/54/77/1121535477.db2.gz KAUNNJZRQATDJU-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO CC(C)CC[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000611254179 1121631803 /nfs/dbraw/zinc/63/18/03/1121631803.db2.gz HBDHMYUXORMLBU-VURMDHGXSA-N 1 1 262.353 3.586 20 5 CHBDMO C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCc2ccccc21 ZINC000611549039 1121654959 /nfs/dbraw/zinc/65/49/59/1121654959.db2.gz KVGJFCPTDAXCGL-OAHLLOKOSA-N 1 1 296.370 3.757 20 5 CHBDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000544186768 1121683724 /nfs/dbraw/zinc/68/37/24/1121683724.db2.gz IYGSHXZHDCPYJP-QGZVFWFLSA-N 1 1 296.370 3.893 20 5 CHBDMO CCCC[N@@H+](CC)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000505908657 1122598621 /nfs/dbraw/zinc/59/86/21/1122598621.db2.gz ZJPIVEFDDLFJSA-NTMALXAHSA-N 1 1 262.353 3.730 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000516558729 1122611205 /nfs/dbraw/zinc/61/12/05/1122611205.db2.gz DGGZWXNVNYJHMI-VXGBXAGGSA-N 1 1 298.333 3.941 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000438338896 1122692112 /nfs/dbraw/zinc/69/21/12/1122692112.db2.gz LXTRFVYZSCOOCP-LBPRGKRZSA-N 1 1 268.382 3.524 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000506371346 1122726116 /nfs/dbraw/zinc/72/61/16/1122726116.db2.gz VBNGULGVMQKDFV-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2c2cccs2)c1 ZINC000015301339 1122800815 /nfs/dbraw/zinc/80/08/15/1122800815.db2.gz PNJTZRKGMVUFIE-AWEZNQCLSA-N 1 1 288.372 3.993 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001195808818 1122890277 /nfs/dbraw/zinc/89/02/77/1122890277.db2.gz CTNOQHCNJUICHA-CQSZACIVSA-N 1 1 296.370 3.757 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000507117228 1122927054 /nfs/dbraw/zinc/92/70/54/1122927054.db2.gz UYUHILYXJYMENR-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000507117228 1122927059 /nfs/dbraw/zinc/92/70/59/1122927059.db2.gz UYUHILYXJYMENR-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000507170377 1122934624 /nfs/dbraw/zinc/93/46/24/1122934624.db2.gz MXJUQFFOCSILQO-AWEZNQCLSA-N 1 1 262.353 3.605 20 5 CHBDMO CC[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000507230727 1122939822 /nfs/dbraw/zinc/93/98/22/1122939822.db2.gz KPALTIPKDNRSJN-UHFFFAOYSA-N 1 1 286.331 3.839 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000438338895 1122962528 /nfs/dbraw/zinc/96/25/28/1122962528.db2.gz LXTRFVYZSCOOCP-GFCCVEGCSA-N 1 1 268.382 3.524 20 5 CHBDMO C[N@@H+](CCCCNc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000840316909 1123526748 /nfs/dbraw/zinc/52/67/48/1123526748.db2.gz UVIQEYMMUFGVJC-UHFFFAOYSA-N 1 1 297.786 3.535 20 5 CHBDMO CCC[C@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000542631651 1129138950 /nfs/dbraw/zinc/13/89/50/1129138950.db2.gz HRMJHSREPIRWOJ-AWEZNQCLSA-N 1 1 262.353 3.749 20 5 CHBDMO CC(C)(C)c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)o1 ZINC000865814574 1124016173 /nfs/dbraw/zinc/01/61/73/1124016173.db2.gz LLKGOOPXWFHTLG-UHFFFAOYSA-N 1 1 288.347 3.775 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCC12CCC2 ZINC000446837113 1124124868 /nfs/dbraw/zinc/12/48/68/1124124868.db2.gz XWSIYIVAAPHCKV-CLTKARDFSA-N 1 1 272.348 3.627 20 5 CHBDMO C[C@@H]1Cc2ccccc2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000525637703 1124451188 /nfs/dbraw/zinc/45/11/88/1124451188.db2.gz ZEELYSGWZMDDDP-CQSZACIVSA-N 1 1 296.370 3.584 20 5 CHBDMO Cc1ccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872018173 1124658477 /nfs/dbraw/zinc/65/84/77/1124658477.db2.gz IQDFCNAMVJRULG-GFCCVEGCSA-N 1 1 288.322 3.893 20 5 CHBDMO Cc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])s1 ZINC000872025401 1124659290 /nfs/dbraw/zinc/65/92/90/1124659290.db2.gz MCKWFQVOFFJLDX-JTQLQIEISA-N 1 1 294.351 3.955 20 5 CHBDMO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C(C)(F)F ZINC000449414416 1124721167 /nfs/dbraw/zinc/72/11/67/1124721167.db2.gz LXWAFSSKHQPPOG-MNOVXSKESA-N 1 1 286.322 3.549 20 5 CHBDMO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000052074205 1125374350 /nfs/dbraw/zinc/37/43/50/1125374350.db2.gz RZFSRSWKCIPPQT-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1ccccc1F)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000052074205 1125374352 /nfs/dbraw/zinc/37/43/52/1125374352.db2.gz RZFSRSWKCIPPQT-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO CC[N@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000689121680 1129188033 /nfs/dbraw/zinc/18/80/33/1129188033.db2.gz JBRWMZUHAVEBAV-UHFFFAOYSA-N 1 1 294.248 3.508 20 5 CHBDMO CC[N@@H+](CCC(F)(F)F)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000689121680 1129188036 /nfs/dbraw/zinc/18/80/36/1129188036.db2.gz JBRWMZUHAVEBAV-UHFFFAOYSA-N 1 1 294.248 3.508 20 5 CHBDMO CCCCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000740874755 1129421687 /nfs/dbraw/zinc/42/16/87/1129421687.db2.gz GQYZQGNIHFSUIB-UHFFFAOYSA-N 1 1 250.342 3.607 20 5 CHBDMO C[N@H+](Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774429 1129451668 /nfs/dbraw/zinc/45/16/68/1129451668.db2.gz ZXOLKTUALGHKGY-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO C[N@@H+](Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774429 1129451669 /nfs/dbraw/zinc/45/16/69/1129451669.db2.gz ZXOLKTUALGHKGY-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000094774218 1129451691 /nfs/dbraw/zinc/45/16/91/1129451691.db2.gz FSURGGHNQMWUKY-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774232 1129451918 /nfs/dbraw/zinc/45/19/18/1129451918.db2.gz SBUMGANOESLVIA-UHFFFAOYSA-N 1 1 288.322 3.756 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC3(CCCC3)C2)c(F)c1 ZINC000795925894 1129457232 /nfs/dbraw/zinc/45/72/32/1129457232.db2.gz MTJQDBRDRILRSY-UHFFFAOYSA-N 1 1 296.317 3.639 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC3(CCCC3)C2)c(F)c1 ZINC000795925894 1129457235 /nfs/dbraw/zinc/45/72/35/1129457235.db2.gz MTJQDBRDRILRSY-UHFFFAOYSA-N 1 1 296.317 3.639 20 5 CHBDMO C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C1CCC(C(C)(C)C)CC1 ZINC001169036356 1129690440 /nfs/dbraw/zinc/69/04/40/1129690440.db2.gz FRBHNRGECUFPBK-PRLABOORSA-N 1 1 296.455 3.969 20 5 CHBDMO C[N@@H+](Cc1ccc2ccccc2c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046785 1129691259 /nfs/dbraw/zinc/69/12/59/1129691259.db2.gz NANWOJCGYNPXLE-CRAIPNDOSA-N 1 1 298.386 3.717 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC(C)(C)C1 ZINC000801539450 1129925628 /nfs/dbraw/zinc/92/56/28/1129925628.db2.gz GWQNJRWLHCYDQU-LLVKDONJSA-N 1 1 280.343 3.602 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC23CCC3)c1 ZINC000770004352 1129935325 /nfs/dbraw/zinc/93/53/25/1129935325.db2.gz VAOHHGWEWYAYKC-UHFFFAOYSA-N 1 1 280.755 3.767 20 5 CHBDMO C[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655631 1130136107 /nfs/dbraw/zinc/13/61/07/1130136107.db2.gz WKTIRWFSZSKYEX-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655631 1130136108 /nfs/dbraw/zinc/13/61/08/1130136108.db2.gz WKTIRWFSZSKYEX-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccccc1[N+](=O)[O-] ZINC000903341290 1130163048 /nfs/dbraw/zinc/16/30/48/1130163048.db2.gz XIOLEYCTMIPTMR-SJCJKPOMSA-N 1 1 297.358 3.792 20 5 CHBDMO CC1(C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1C1CC1 ZINC000811513766 1130620445 /nfs/dbraw/zinc/62/04/45/1130620445.db2.gz PLCUPYINFZXQRG-CQSZACIVSA-N 1 1 294.782 3.869 20 5 CHBDMO CC1(C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1C1CC1 ZINC000811513766 1130620447 /nfs/dbraw/zinc/62/04/47/1130620447.db2.gz PLCUPYINFZXQRG-CQSZACIVSA-N 1 1 294.782 3.869 20 5 CHBDMO C[C@H]1CNCC[N@@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001235362961 1130737856 /nfs/dbraw/zinc/73/78/56/1130737856.db2.gz SWEOIPXXOVRPTP-HNNXBMFYSA-N 1 1 290.410 3.787 20 5 CHBDMO C[C@H]1CNCC[N@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001235362961 1130737861 /nfs/dbraw/zinc/73/78/61/1130737861.db2.gz SWEOIPXXOVRPTP-HNNXBMFYSA-N 1 1 290.410 3.787 20 5 CHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783569077 1130839230 /nfs/dbraw/zinc/83/92/30/1130839230.db2.gz AZCDDLPPHGBXDZ-ZYHUDNBSSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783573913 1130839883 /nfs/dbraw/zinc/83/98/83/1130839883.db2.gz MYWKFHSUAPDFPR-AWEZNQCLSA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000217235693 1130922473 /nfs/dbraw/zinc/92/24/73/1130922473.db2.gz RKFZUTYUIVUFST-XUJVJEKNSA-N 1 1 292.354 3.887 20 5 CHBDMO C[N@H+]1CCC[C@@H](Oc2cccc3cc4ccccc4nc32)C1 ZINC001228175680 1131823971 /nfs/dbraw/zinc/82/39/71/1131823971.db2.gz GJABSLZTRKUJDV-MRXNPFEDSA-N 1 1 292.382 3.861 20 5 CHBDMO CCOc1cc(C[N@H+]2CC[C@@H](C)C[C@H]2C)ccc1[N+](=O)[O-] ZINC001171381481 1131942835 /nfs/dbraw/zinc/94/28/35/1131942835.db2.gz MEDADSJNLAATHD-CHWSQXEVSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[NH+]1CC(Oc2c3ccccc3c(O)c3ccccc32)C1 ZINC001229025548 1132001573 /nfs/dbraw/zinc/00/15/73/1132001573.db2.gz SOBHLMQCHMEEMY-UHFFFAOYSA-N 1 1 293.366 3.782 20 5 CHBDMO CCC(CC)[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172920989 1132362167 /nfs/dbraw/zinc/36/21/67/1132362167.db2.gz NGGWUMRTWLJPMZ-INIZCTEOSA-N 1 1 290.407 3.963 20 5 CHBDMO CC[C@@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172913018 1132371943 /nfs/dbraw/zinc/37/19/43/1132371943.db2.gz OGTPLPJZIRFFDK-CZUORRHYSA-N 1 1 288.391 3.574 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC(C)(C)C ZINC001173227253 1132412649 /nfs/dbraw/zinc/41/26/49/1132412649.db2.gz OYBXFHUPMXBJAG-GFCCVEGCSA-N 1 1 264.369 3.504 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCCC1(F)F ZINC001173236110 1132415056 /nfs/dbraw/zinc/41/50/56/1132415056.db2.gz WSBMQPHBOUMTRG-SMDDNHRTSA-N 1 1 298.333 3.693 20 5 CHBDMO Cc1c(C[N@H+]2C[C@H](C3CC3)[C@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001205875830 1133625579 /nfs/dbraw/zinc/62/55/79/1133625579.db2.gz PNHOAPBNFIKFGD-NVXWUHKLSA-N 1 1 286.375 3.524 20 5 CHBDMO C[C@@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)C[C@H]1N ZINC001206065263 1133652338 /nfs/dbraw/zinc/65/23/38/1133652338.db2.gz RNGKSBPXCWTTST-JLTOFOAXSA-N 1 1 290.410 3.772 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@H]1N ZINC001206065263 1133652341 /nfs/dbraw/zinc/65/23/41/1133652341.db2.gz RNGKSBPXCWTTST-JLTOFOAXSA-N 1 1 290.410 3.772 20 5 CHBDMO CC(C)[N@H+]1CCC[C@@H](O[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC001223428018 1135344366 /nfs/dbraw/zinc/34/43/66/1135344366.db2.gz YSSXLPJBVAOMDR-XJKSGUPXSA-N 1 1 292.379 3.545 20 5 CHBDMO C[C@H]([NH2+][C@H]1CCCc2occc21)c1ccccc1[N+](=O)[O-] ZINC000020526285 171239353 /nfs/dbraw/zinc/23/93/53/171239353.db2.gz AFMOFTMRAQXSGV-FZMZJTMJSA-N 1 1 286.331 3.916 20 5 CHBDMO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000035010710 171928234 /nfs/dbraw/zinc/92/82/34/171928234.db2.gz HYWZBHMIDYGULB-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)o1 ZINC000035699694 172367878 /nfs/dbraw/zinc/36/78/78/172367878.db2.gz PGOAILQSEPMYSC-UHFFFAOYSA-N 1 1 294.738 3.782 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)o1 ZINC000035699694 172367880 /nfs/dbraw/zinc/36/78/80/172367880.db2.gz PGOAILQSEPMYSC-UHFFFAOYSA-N 1 1 294.738 3.782 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC=C(c3ccco3)C2)cc1 ZINC000352571200 227073011 /nfs/dbraw/zinc/07/30/11/227073011.db2.gz RLGMKDVPYSUDSC-UHFFFAOYSA-N 1 1 298.342 3.520 20 5 CHBDMO C[C@H]1c2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000353870519 228161240 /nfs/dbraw/zinc/16/12/40/228161240.db2.gz RVBLCIGEESVELB-LBPRGKRZSA-N 1 1 268.316 3.672 20 5 CHBDMO C[C@H]1c2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000353870519 228161241 /nfs/dbraw/zinc/16/12/41/228161241.db2.gz RVBLCIGEESVELB-LBPRGKRZSA-N 1 1 268.316 3.672 20 5 CHBDMO CC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000080263538 260178639 /nfs/dbraw/zinc/17/86/39/260178639.db2.gz PNJIGQGDUFZUGW-ZWNOBZJWSA-N 1 1 291.376 3.853 20 5 CHBDMO Cc1cnc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000177959826 261373282 /nfs/dbraw/zinc/37/32/82/261373282.db2.gz GEPUDIGRQBNGBH-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2C2CCCC2)c(F)c1 ZINC000313868535 261534147 /nfs/dbraw/zinc/53/41/47/261534147.db2.gz YIMVJLZQEWVHCG-INIZCTEOSA-N 1 1 292.354 3.889 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](CC1CC1)C1CCC1 ZINC000475673485 264335454 /nfs/dbraw/zinc/33/54/54/264335454.db2.gz NYTAEKXKAVRTNZ-XQRVVYSFSA-N 1 1 286.375 3.873 20 5 CHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(F)cc(F)c1 ZINC000094827369 265259566 /nfs/dbraw/zinc/25/95/66/265259566.db2.gz KHOHVESZZSCDOP-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO CCOc1cc(C[N@@H+](C)[C@H](C)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000571398739 328118873 /nfs/dbraw/zinc/11/88/73/328118873.db2.gz UVGVHONTXVWGKN-GFCCVEGCSA-N 1 1 294.395 3.860 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)cs1 ZINC000049442845 328362803 /nfs/dbraw/zinc/36/28/03/328362803.db2.gz GPGQFIYZYYZSJS-KCXRBIIJSA-N 1 1 292.404 3.667 20 5 CHBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000532038423 328398385 /nfs/dbraw/zinc/39/83/85/328398385.db2.gz ASPZKMDTEVBEAR-SFHVURJKSA-N 1 1 296.370 3.758 20 5 CHBDMO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000175125549 329163381 /nfs/dbraw/zinc/16/33/81/329163381.db2.gz FCQYJIMQESQRPZ-KRWDZBQOSA-N 1 1 299.374 3.661 20 5 CHBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000175125549 329163383 /nfs/dbraw/zinc/16/33/83/329163383.db2.gz FCQYJIMQESQRPZ-KRWDZBQOSA-N 1 1 299.374 3.661 20 5 CHBDMO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000175125566 329163422 /nfs/dbraw/zinc/16/34/22/329163422.db2.gz FCQYJIMQESQRPZ-QGZVFWFLSA-N 1 1 299.374 3.661 20 5 CHBDMO Cn1cccc1[C@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000175125566 329163424 /nfs/dbraw/zinc/16/34/24/329163424.db2.gz FCQYJIMQESQRPZ-QGZVFWFLSA-N 1 1 299.374 3.661 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC000580491067 330348581 /nfs/dbraw/zinc/34/85/81/330348581.db2.gz CUQHYJQNFRHHSC-HNNXBMFYSA-N 1 1 274.364 3.524 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CC(C)(C)C ZINC000463358397 331346538 /nfs/dbraw/zinc/34/65/38/331346538.db2.gz CXUXMYWGFDUBIJ-UHFFFAOYSA-N 1 1 264.369 3.771 20 5 CHBDMO CCCC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C1CC1 ZINC000463481343 331348476 /nfs/dbraw/zinc/34/84/76/331348476.db2.gz CRHADQLNMWLXRN-UHFFFAOYSA-N 1 1 296.342 3.507 20 5 CHBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000463520001 331348992 /nfs/dbraw/zinc/34/89/92/331348992.db2.gz WATFYKDVRBPNJH-LLVKDONJSA-N 1 1 298.358 3.609 20 5 CHBDMO CC(C)[C@H]1C[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CCS1 ZINC000464774710 331367324 /nfs/dbraw/zinc/36/73/24/331367324.db2.gz PZZIPVWKMKMHTI-IUODEOHRSA-N 1 1 294.420 3.729 20 5 CHBDMO CC(C)[C@@H]1C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CCS1 ZINC000464779743 331367978 /nfs/dbraw/zinc/36/79/78/331367978.db2.gz ZJZHMMDEWFFGRY-DOMZBBRYSA-N 1 1 294.420 3.729 20 5 CHBDMO CC/C=C/CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000466235020 331391439 /nfs/dbraw/zinc/39/14/39/331391439.db2.gz KKOAAYZJGFUAIW-ONEGZZNKSA-N 1 1 274.364 3.916 20 5 CHBDMO CC[C@@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000490010392 332076529 /nfs/dbraw/zinc/07/65/29/332076529.db2.gz BCSNTBOEMISIJV-CHWSQXEVSA-N 1 1 262.353 3.696 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C)[C@H]1C ZINC000490067160 332079753 /nfs/dbraw/zinc/07/97/53/332079753.db2.gz MGHMCNSXHMFOMY-RTXFEEFZSA-N 1 1 262.353 3.695 20 5 CHBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522466261 333287445 /nfs/dbraw/zinc/28/74/45/333287445.db2.gz IGCYBEARAOFYAP-WMLDXEAASA-N 1 1 296.370 3.973 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(Cl)ccc1F ZINC000125210150 333564843 /nfs/dbraw/zinc/56/48/43/333564843.db2.gz XLEILYYWLMTMGF-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO Cc1csc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)n1 ZINC000126241840 333595324 /nfs/dbraw/zinc/59/53/24/333595324.db2.gz AFPALCVQNPKWHZ-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CCC(C)(C)C ZINC000548935751 334180742 /nfs/dbraw/zinc/18/07/42/334180742.db2.gz WEKAVNAYYLLNER-UHFFFAOYSA-N 1 1 264.369 3.505 20 5 CHBDMO CCCC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549344023 334190413 /nfs/dbraw/zinc/19/04/13/334190413.db2.gz SQUXYRLKLKMPQC-UHFFFAOYSA-N 1 1 290.285 3.846 20 5 CHBDMO C[C@H](Cc1ccsc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000081598493 334198823 /nfs/dbraw/zinc/19/88/23/334198823.db2.gz SZAXPCWZHBHQGB-GFCCVEGCSA-N 1 1 290.388 3.719 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000550079267 334212588 /nfs/dbraw/zinc/21/25/88/334212588.db2.gz LFTFTJIESUGHNM-HIFRSBDPSA-N 1 1 274.364 3.605 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000581196060 336022977 /nfs/dbraw/zinc/02/29/77/336022977.db2.gz CZQYNBNKOPLIMW-MRXNPFEDSA-N 1 1 296.370 3.974 20 5 CHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000383626628 336115954 /nfs/dbraw/zinc/11/59/54/336115954.db2.gz UIFHWZUPYNSXFD-AAEUAGOBSA-N 1 1 280.343 3.744 20 5 CHBDMO CC(C)([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000292110061 519325957 /nfs/dbraw/zinc/32/59/57/519325957.db2.gz IXVHNIPOSFQVOQ-UHFFFAOYSA-N 1 1 288.322 3.759 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2coc3ccccc23)cs1 ZINC000339407056 527330716 /nfs/dbraw/zinc/33/07/16/527330716.db2.gz KKVGNFYTYNPBKE-UHFFFAOYSA-N 1 1 288.328 3.692 20 5 CHBDMO CC1CCC([N@@H+](C)Cc2csc([N+](=O)[O-])c2)CC1 ZINC000054153225 1121721187 /nfs/dbraw/zinc/72/11/87/1121721187.db2.gz RPHPWFFRFXVILZ-UHFFFAOYSA-N 1 1 268.382 3.667 20 5 CHBDMO C[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872064015 1124670866 /nfs/dbraw/zinc/67/08/66/1124670866.db2.gz VIJBJFUMGWVRLA-YUMQZZPRSA-N 1 1 294.248 3.725 20 5 CHBDMO Cc1occc1C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000138382287 1125539253 /nfs/dbraw/zinc/53/92/53/1125539253.db2.gz LLABEYLNTKSJTK-NSHDSACASA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1occc1C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000138382287 1125539258 /nfs/dbraw/zinc/53/92/58/1125539258.db2.gz LLABEYLNTKSJTK-NSHDSACASA-N 1 1 274.320 3.689 20 5 CHBDMO CC[C@@H](C)[N@@H+](Cc1ccccc1)Cc1cccnc1[N+](=O)[O-] ZINC000885944841 1125628418 /nfs/dbraw/zinc/62/84/18/1125628418.db2.gz VYJQQNMHHSYQOU-CQSZACIVSA-N 1 1 299.374 3.791 20 5 CHBDMO C[C@@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886205088 1125661420 /nfs/dbraw/zinc/66/14/20/1125661420.db2.gz ZLNNMXKYECYVTL-CJNGLKHVSA-N 1 1 297.358 3.573 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000076342865 1125677406 /nfs/dbraw/zinc/67/74/06/1125677406.db2.gz JQJWDFDVDYFZQV-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])s1 ZINC000076342865 1125677409 /nfs/dbraw/zinc/67/74/09/1125677409.db2.gz JQJWDFDVDYFZQV-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000886540830 1125686945 /nfs/dbraw/zinc/68/69/45/1125686945.db2.gz LNABQOLEXMUDMI-CZUORRHYSA-N 1 1 297.358 3.573 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccncc1F)c1ccc([N+](=O)[O-])cc1 ZINC000338015394 1126710793 /nfs/dbraw/zinc/71/07/93/1126710793.db2.gz SAMVRRDXEHPAQN-GHMZBOCLSA-N 1 1 289.310 3.541 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000138894115 1126793401 /nfs/dbraw/zinc/79/34/01/1126793401.db2.gz IKPKJXOOVXHJJT-QGZVFWFLSA-N 1 1 298.342 3.638 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[NH+]2CCC3(CCC3)CC2)c(F)c1 ZINC000586783207 1127140220 /nfs/dbraw/zinc/14/02/20/1127140220.db2.gz FQWJSNDOBFEQAI-UHFFFAOYSA-N 1 1 296.317 3.639 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2C2CCCC2)cs1 ZINC000055927214 1127183164 /nfs/dbraw/zinc/18/31/64/1127183164.db2.gz LEUSZEUDAUMYJE-CYBMUJFWSA-N 1 1 280.393 3.811 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@H](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000588977835 1127208994 /nfs/dbraw/zinc/20/89/94/1127208994.db2.gz AMUOMXYLAJVBSR-HNNXBMFYSA-N 1 1 274.364 3.525 20 5 CHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000353896214 1127276731 /nfs/dbraw/zinc/27/67/31/1127276731.db2.gz HBRMQERBLZRUJP-GFCCVEGCSA-N 1 1 268.382 3.667 20 5 CHBDMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC001168400614 1127298524 /nfs/dbraw/zinc/29/85/24/1127298524.db2.gz BZSOBHUPGSWDDL-BPUTZDHNSA-N 1 1 288.391 3.914 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1C[C@H]1c1ccccc1 ZINC000355218370 1127326436 /nfs/dbraw/zinc/32/64/36/1127326436.db2.gz HTDDJLDHQPRIQI-RDJZCZTQSA-N 1 1 282.343 3.583 20 5 CHBDMO Cc1noc(C[N@@H+]2CC[C@@H](C(C)(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC000595497497 1127464387 /nfs/dbraw/zinc/46/43/87/1127464387.db2.gz OOMVEWZUAQBGFU-ZYHUDNBSSA-N 1 1 295.383 3.538 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CC1=CCSC1 ZINC000595889687 1127480055 /nfs/dbraw/zinc/48/00/55/1127480055.db2.gz VKNHAMRTMAKPEY-GFCCVEGCSA-N 1 1 292.404 3.569 20 5 CHBDMO CN(Cc1ccccc1[N+](=O)[O-])c1cc[nH+]c2ccsc21 ZINC000360535075 1127501539 /nfs/dbraw/zinc/50/15/39/1127501539.db2.gz NOTXZUHCTCIFLK-UHFFFAOYSA-N 1 1 299.355 3.841 20 5 CHBDMO C[C@H]1c2ccccc2C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000361085665 1127537272 /nfs/dbraw/zinc/53/72/72/1127537272.db2.gz FHZNMEDCWUBTKH-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@H]1c2ccccc2C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000361085665 1127537275 /nfs/dbraw/zinc/53/72/75/1127537275.db2.gz FHZNMEDCWUBTKH-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO Cc1cnccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000294545040 1127581707 /nfs/dbraw/zinc/58/17/07/1127581707.db2.gz JPLDFFRPNWYSGI-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C(F)F ZINC000603428619 1127648906 /nfs/dbraw/zinc/64/89/06/1127648906.db2.gz KOHQTEYGOVHEJR-DMDPSCGWSA-N 1 1 298.333 3.549 20 5 CHBDMO Cc1ccccc1C[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000603838173 1127673805 /nfs/dbraw/zinc/67/38/05/1127673805.db2.gz DEKRQQRXPIZMHJ-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]12 ZINC000603847293 1127676136 /nfs/dbraw/zinc/67/61/36/1127676136.db2.gz PDUKWLZXSQMMHV-FRFSOERESA-N 1 1 288.391 3.995 20 5 CHBDMO CCc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000061760741 1127716263 /nfs/dbraw/zinc/71/62/63/1127716263.db2.gz DYTMIAFINAZGQE-UHFFFAOYSA-N 1 1 284.359 3.789 20 5 CHBDMO CCc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000061760741 1127716266 /nfs/dbraw/zinc/71/62/66/1127716266.db2.gz DYTMIAFINAZGQE-UHFFFAOYSA-N 1 1 284.359 3.789 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC2(CCCC2)C1 ZINC000174268320 1127885047 /nfs/dbraw/zinc/88/50/47/1127885047.db2.gz KESVQBRSDTWGOA-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO CCCC[C@H](CC)C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000545517337 1128018419 /nfs/dbraw/zinc/01/84/19/1128018419.db2.gz LFGBOJYMVIYUCD-ZDUSSCGKSA-N 1 1 291.395 3.564 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)CC1(C)C ZINC000541771859 1128038750 /nfs/dbraw/zinc/03/87/50/1128038750.db2.gz RWMASAPNIZTRPO-NSHDSACASA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000542315456 1128062817 /nfs/dbraw/zinc/06/28/17/1128062817.db2.gz HTLJJXOBEHAVDP-QGZVFWFLSA-N 1 1 296.370 3.893 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C2CC2)C1 ZINC000470179225 1128065237 /nfs/dbraw/zinc/06/52/37/1128065237.db2.gz URHSLBGGJUBKFZ-OVHOFWQVSA-N 1 1 286.375 3.730 20 5 CHBDMO CCOc1cc(C[N@@H+](CC(C)C)C(C)C)ccc1[N+](=O)[O-] ZINC000492534867 1128101419 /nfs/dbraw/zinc/10/14/19/1128101419.db2.gz KUGJWPRRVCSHGT-UHFFFAOYSA-N 1 1 294.395 3.860 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC[C@H](CC)C2)ccc1[N+](=O)[O-] ZINC000492542638 1128102612 /nfs/dbraw/zinc/10/26/12/1128102612.db2.gz XGEUFIOKWUQPGQ-ZDUSSCGKSA-N 1 1 292.379 3.616 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@H](C)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000492788326 1128112978 /nfs/dbraw/zinc/11/29/78/1128112978.db2.gz IFNVYXNOICICCG-CHWSQXEVSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@H+]2CC[C@H](C)[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492816884 1128113994 /nfs/dbraw/zinc/11/39/94/1128113994.db2.gz JKZRDAPAURMGMC-GXTWGEPZSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@H+]2CCCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000492819596 1128114039 /nfs/dbraw/zinc/11/40/39/1128114039.db2.gz SUCSYSFSGVQXCY-CYBMUJFWSA-N 1 1 292.379 3.616 20 5 CHBDMO Cc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000035368149 1128328665 /nfs/dbraw/zinc/32/86/65/1128328665.db2.gz WEBOYQXDZNSHGU-UHFFFAOYSA-N 1 1 290.750 3.846 20 5 CHBDMO O=[N+]([O-])c1cc(CNc2cccc3cc[nH+]cc32)cs1 ZINC000094967197 1128350881 /nfs/dbraw/zinc/35/08/81/1128350881.db2.gz LZHWDICTUDDUTN-UHFFFAOYSA-N 1 1 285.328 3.817 20 5 CHBDMO Cc1ncsc1C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000171750947 1128359043 /nfs/dbraw/zinc/35/90/43/1128359043.db2.gz OYRNQQYBCAQFIA-NSHDSACASA-N 1 1 291.376 3.553 20 5 CHBDMO Cc1ncsc1C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000171750947 1128359048 /nfs/dbraw/zinc/35/90/48/1128359048.db2.gz OYRNQQYBCAQFIA-NSHDSACASA-N 1 1 291.376 3.553 20 5 CHBDMO Cc1c([C@@H](C)[NH2+][C@@H](C)c2nccs2)cccc1[N+](=O)[O-] ZINC000153361835 1128373506 /nfs/dbraw/zinc/37/35/06/1128373506.db2.gz SURONXQWKCMTCU-MNOVXSKESA-N 1 1 291.376 3.772 20 5 CHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000917835794 1128521840 /nfs/dbraw/zinc/52/18/40/1128521840.db2.gz JLFQXDLKBWJPNQ-OAHLLOKOSA-N 1 1 292.354 3.889 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000046089168 1128658054 /nfs/dbraw/zinc/65/80/54/1128658054.db2.gz DGXZDEIPHGUYHJ-HNNXBMFYSA-N 1 1 288.372 3.993 20 5 CHBDMO C[C@@H]1C[C@H](C)C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000609704832 1128723213 /nfs/dbraw/zinc/72/32/13/1128723213.db2.gz QVYWFUWIZAGBRX-PHIMTYICSA-N 1 1 282.771 3.726 20 5 CHBDMO CC[C@@H](C)[C@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610001921 1128734290 /nfs/dbraw/zinc/73/42/90/1128734290.db2.gz LZHPQYKFSHOUEW-UKRRQHHQSA-N 1 1 276.380 3.995 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215363 1117882234 /nfs/dbraw/zinc/88/22/34/1117882234.db2.gz HJLWBGMZXAOIMM-KGLIPLIRSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccco2)C1 ZINC000610369523 1118362014 /nfs/dbraw/zinc/36/20/14/1118362014.db2.gz KUFNWEVDXSFLNZ-STQMWFEESA-N 1 1 286.331 3.738 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC=C(c2ccco2)C1 ZINC000348676166 1118644868 /nfs/dbraw/zinc/64/48/68/1118644868.db2.gz RYYVMNHAZIPUOV-UHFFFAOYSA-N 1 1 298.342 3.786 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)(C)C ZINC000610581098 1118777856 /nfs/dbraw/zinc/77/78/56/1118777856.db2.gz IRQSLNXYNYLFOU-SNVBAGLBSA-N 1 1 291.351 3.602 20 5 CHBDMO C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)CC[C@@H]1C ZINC000129725387 1118889607 /nfs/dbraw/zinc/88/96/07/1118889607.db2.gz DPQGGDZLHAZHML-QWRGUYRKSA-N 1 1 282.771 3.726 20 5 CHBDMO CC[C@H](C)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000215663698 1118915854 /nfs/dbraw/zinc/91/58/54/1118915854.db2.gz BCYTUWDFYXRLTQ-LBPRGKRZSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000091959804 1118933497 /nfs/dbraw/zinc/93/34/97/1118933497.db2.gz IALPRXRJMFNUBK-UWVGGRQHSA-N 1 1 289.335 3.611 20 5 CHBDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000091959802 1118933611 /nfs/dbraw/zinc/93/36/11/1118933611.db2.gz IALPRXRJMFNUBK-VHSXEESVSA-N 1 1 289.335 3.611 20 5 CHBDMO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000248241895 1119336575 /nfs/dbraw/zinc/33/65/75/1119336575.db2.gz HLOCLQHTWUBMNR-UHFFFAOYSA-N 1 1 262.353 3.749 20 5 CHBDMO CS[C@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000349958251 1119436230 /nfs/dbraw/zinc/43/62/30/1119436230.db2.gz ARDJFBYENJDQQY-HNNXBMFYSA-N 1 1 294.420 3.621 20 5 CHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000219697552 1119511197 /nfs/dbraw/zinc/51/11/97/1119511197.db2.gz FINOUWLVCUQVAS-IUODEOHRSA-N 1 1 262.353 3.605 20 5 CHBDMO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CC1 ZINC000122904646 1120028504 /nfs/dbraw/zinc/02/85/04/1120028504.db2.gz PSCHNTPMXMMFCJ-UHFFFAOYSA-N 1 1 286.331 3.697 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F)C(C)(C)C ZINC000311865464 1120112254 /nfs/dbraw/zinc/11/22/54/1120112254.db2.gz KSIZSJJTDUUPPA-SNVBAGLBSA-N 1 1 268.332 3.600 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)C(C)(C)C ZINC000542703550 1120124302 /nfs/dbraw/zinc/12/43/02/1120124302.db2.gz QKAUCBLUZSTWCQ-GFCCVEGCSA-N 1 1 264.369 3.770 20 5 CHBDMO Cc1c(C[N@@H+](C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000051122456 1120216040 /nfs/dbraw/zinc/21/60/40/1120216040.db2.gz JCGNARARQRJODL-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO C[C@@H]1CC[C@@]2(CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542882662 1120220596 /nfs/dbraw/zinc/22/05/96/1120220596.db2.gz CENHLVYXYMNLBE-RHSMWYFYSA-N 1 1 288.391 3.649 20 5 CHBDMO Cc1ccc([C@@H]2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000541392602 1120313516 /nfs/dbraw/zinc/31/35/16/1120313516.db2.gz ISZDOCQVMLCVDW-MRXNPFEDSA-N 1 1 296.370 3.893 20 5 CHBDMO Cc1ccc([C@H]2CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1 ZINC000541392599 1120314326 /nfs/dbraw/zinc/31/43/26/1120314326.db2.gz ISZDOCQVMLCVDW-INIZCTEOSA-N 1 1 296.370 3.893 20 5 CHBDMO CSCC[C@H](C)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255173093 1120340176 /nfs/dbraw/zinc/34/01/76/1120340176.db2.gz JBKZEONLYGMVAS-WOLRVDTOSA-N 1 1 294.420 3.681 20 5 CHBDMO Cc1ccc(C[N@H+](C)C2Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000511650579 1120501437 /nfs/dbraw/zinc/50/14/37/1120501437.db2.gz XJWBHAHRTAKGFH-UHFFFAOYSA-N 1 1 296.370 3.502 20 5 CHBDMO CC(C)c1[nH+]ccn1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000070423118 1120531652 /nfs/dbraw/zinc/53/16/52/1120531652.db2.gz BQDCVKIXMFVZPU-UHFFFAOYSA-N 1 1 279.727 3.616 20 5 CHBDMO C[C@@H]1CCCCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509141973 1120671669 /nfs/dbraw/zinc/67/16/69/1120671669.db2.gz VTCQGTGPXQRXTK-SNVBAGLBSA-N 1 1 284.306 3.638 20 5 CHBDMO C[C@@H]1CCCCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509141973 1120671670 /nfs/dbraw/zinc/67/16/70/1120671670.db2.gz VTCQGTGPXQRXTK-SNVBAGLBSA-N 1 1 284.306 3.638 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H]1C1CCC1 ZINC000544612166 1120864171 /nfs/dbraw/zinc/86/41/71/1120864171.db2.gz UJBYBLWDYVKOBA-MRXNPFEDSA-N 1 1 274.364 3.668 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493002273 1120965489 /nfs/dbraw/zinc/96/54/89/1120965489.db2.gz IFBOMATWYUKCFZ-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO CC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)[C@H](C)C(C)C ZINC000509295199 1121518569 /nfs/dbraw/zinc/51/85/69/1121518569.db2.gz UHCPGYAEQMYZDR-SNVBAGLBSA-N 1 1 286.322 3.739 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC1CCCC1 ZINC000512672047 1121521639 /nfs/dbraw/zinc/52/16/39/1121521639.db2.gz FNCOXQVVTJOFJW-POHAHGRESA-N 1 1 274.364 3.730 20 5 CHBDMO C[C@@H]1CC[C@H]([N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000433037398 1121532689 /nfs/dbraw/zinc/53/26/89/1121532689.db2.gz FACAXIAXFLZVDJ-DOMBMUJNSA-N 1 1 274.364 3.728 20 5 CHBDMO CSCC[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000093509540 1121616623 /nfs/dbraw/zinc/61/66/23/1121616623.db2.gz IZLONPLRYADPIQ-UHFFFAOYSA-N 1 1 282.409 3.513 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611516987 1121653786 /nfs/dbraw/zinc/65/37/86/1121653786.db2.gz QLRXZECDDVRUCY-XUJVJEKNSA-N 1 1 280.343 3.644 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C)[C@@H](F)C1 ZINC000611516987 1121653788 /nfs/dbraw/zinc/65/37/88/1121653788.db2.gz QLRXZECDDVRUCY-XUJVJEKNSA-N 1 1 280.343 3.644 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000182338519 1121784909 /nfs/dbraw/zinc/78/49/09/1121784909.db2.gz FIGXYBWKSSBZSX-GFCCVEGCSA-N 1 1 288.322 3.893 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])cc1 ZINC000182338619 1121785495 /nfs/dbraw/zinc/78/54/95/1121785495.db2.gz FIGXYBWKSSBZSX-LBPRGKRZSA-N 1 1 288.322 3.893 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC(C)(C)C1(C)C ZINC001180203376 1121963652 /nfs/dbraw/zinc/96/36/52/1121963652.db2.gz QOKOSMIGVRHGBA-UHFFFAOYSA-N 1 1 276.380 3.832 20 5 CHBDMO CC(C)[C@@H]1[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CC12CCC2 ZINC000430095690 1122403381 /nfs/dbraw/zinc/40/33/81/1122403381.db2.gz NPHAVFSNIZWWMY-HNNXBMFYSA-N 1 1 292.354 3.744 20 5 CHBDMO CC(C)[C@@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC12CCC2 ZINC000430095690 1122403383 /nfs/dbraw/zinc/40/33/83/1122403383.db2.gz NPHAVFSNIZWWMY-HNNXBMFYSA-N 1 1 292.354 3.744 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000506741888 1122819512 /nfs/dbraw/zinc/81/95/12/1122819512.db2.gz CARHOOMEKFPMDU-ZIAGYGMSSA-N 1 1 274.364 3.944 20 5 CHBDMO CC(C)[C@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507187522 1122845388 /nfs/dbraw/zinc/84/53/88/1122845388.db2.gz KUCUGMFMZULRPZ-SBJJXXPASA-N 1 1 274.364 3.728 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000507026621 1122920162 /nfs/dbraw/zinc/92/01/62/1122920162.db2.gz PFRAGUODDUWZHW-LBPRGKRZSA-N 1 1 250.342 3.524 20 5 CHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000507140836 1122928922 /nfs/dbraw/zinc/92/89/22/1122928922.db2.gz DYYUDNAEPDQIFY-GFCCVEGCSA-N 1 1 268.382 3.667 20 5 CHBDMO Cc1cccc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1C ZINC000507146010 1122929571 /nfs/dbraw/zinc/92/95/71/1122929571.db2.gz VCCCGPOQCQQIAQ-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000507672308 1122983146 /nfs/dbraw/zinc/98/31/46/1122983146.db2.gz JZCWEZKCBMAHOO-KRWDZBQOSA-N 1 1 296.370 3.659 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000507673608 1122983778 /nfs/dbraw/zinc/98/37/78/1122983778.db2.gz OZPUWMCMZSKUSQ-KRWDZBQOSA-N 1 1 296.370 3.659 20 5 CHBDMO Cc1cccc2c1CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000729477008 1122992446 /nfs/dbraw/zinc/99/24/46/1122992446.db2.gz JTUGQVSYIGWLTF-UHFFFAOYSA-N 1 1 296.370 3.504 20 5 CHBDMO Cc1c(C[N@H+](C)C2Cc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000141373794 1123080268 /nfs/dbraw/zinc/08/02/68/1123080268.db2.gz VUFNTVLPLRDWJA-UHFFFAOYSA-N 1 1 296.370 3.502 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000025938366 1123843897 /nfs/dbraw/zinc/84/38/97/1123843897.db2.gz RUPVGUYRZFWLAR-QGZVFWFLSA-N 1 1 282.343 3.714 20 5 CHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC1CCC1 ZINC000475547608 1124007529 /nfs/dbraw/zinc/00/75/29/1124007529.db2.gz JYDMIZHYEHUALR-UXBLZVDNSA-N 1 1 274.364 3.730 20 5 CHBDMO Cc1c(C[N@H+](CC2CCC2)C(C)C)cccc1[N+](=O)[O-] ZINC000444781552 1124059313 /nfs/dbraw/zinc/05/93/13/1124059313.db2.gz IPXOKVGIFAAGAS-UHFFFAOYSA-N 1 1 276.380 3.914 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](CC1CCC1)C(C)C ZINC000444788249 1124065547 /nfs/dbraw/zinc/06/55/47/1124065547.db2.gz ZRZWXKUGMGPKNH-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H]3C3CC3)o2)c1 ZINC000449423987 1124730183 /nfs/dbraw/zinc/73/01/83/1124730183.db2.gz ITUJLGZWKNIMLX-MRXNPFEDSA-N 1 1 298.342 3.839 20 5 CHBDMO CCC(CC)[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000531344700 1125211014 /nfs/dbraw/zinc/21/10/14/1125211014.db2.gz WKYPDCGLYZBMMV-UHFFFAOYSA-N 1 1 280.343 3.887 20 5 CHBDMO CC(C)(C)C(=[NH2+])Nc1ccc2cccc([N+](=O)[O-])c2n1 ZINC001155181027 1129444451 /nfs/dbraw/zinc/44/44/51/1129444451.db2.gz DDJDIGZRJOGHEW-UHFFFAOYSA-N 1 1 272.308 3.578 20 5 CHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774663 1129451656 /nfs/dbraw/zinc/45/16/56/1129451656.db2.gz NQHNAHCIITZFIK-BXUZGUMPSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035129 1129690865 /nfs/dbraw/zinc/69/08/65/1129690865.db2.gz AJWRXJWHXMXWQL-LALPHHSUSA-N 1 1 296.798 3.778 20 5 CHBDMO Cc1ccccc1[C@H]1CCC[N@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169055872 1129693410 /nfs/dbraw/zinc/69/34/10/1129693410.db2.gz QXBXTIXSMMUYRF-ZMSDIMECSA-N 1 1 288.391 3.577 20 5 CHBDMO Cc1ccc(C[N@H+]2CCc3cccc(C)c3C2)cc1[N+](=O)[O-] ZINC001169233320 1129711209 /nfs/dbraw/zinc/71/12/09/1129711209.db2.gz MWLDLMLZNQCFPI-UHFFFAOYSA-N 1 1 296.370 3.770 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]2CCCC[C@H]21 ZINC000801539205 1129925306 /nfs/dbraw/zinc/92/53/06/1129925306.db2.gz CXSQAJBAXYGXFR-OSAQELSMSA-N 1 1 292.354 3.744 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C[C@H]1CC=CCC1 ZINC000801539782 1129925774 /nfs/dbraw/zinc/92/57/74/1129925774.db2.gz PSUGUWRCFNXZNK-LBPRGKRZSA-N 1 1 278.327 3.522 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CCCC3)C2)cc1F ZINC000801544753 1129926356 /nfs/dbraw/zinc/92/63/56/1129926356.db2.gz ACQYHCGUWYRDBP-UHFFFAOYSA-N 1 1 292.354 3.890 20 5 CHBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000746662962 1130139636 /nfs/dbraw/zinc/13/96/36/1130139636.db2.gz IZYYPFFVODKCDS-UHFFFAOYSA-N 1 1 294.782 3.869 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC000782502357 1130780583 /nfs/dbraw/zinc/78/05/83/1130780583.db2.gz FQYSQQLOPCQYIP-DJSGYFEHSA-N 1 1 292.354 3.744 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000694469814 1130787859 /nfs/dbraw/zinc/78/78/59/1130787859.db2.gz REKYYNHICJYGLS-CYBMUJFWSA-N 1 1 280.343 3.602 20 5 CHBDMO CC(C)[C@@H]1CCCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000217229247 1130920357 /nfs/dbraw/zinc/92/03/57/1130920357.db2.gz DEVLHQRZMIDTFA-AWEZNQCLSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CCC2)C1 ZINC000348191944 1131895209 /nfs/dbraw/zinc/89/52/09/1131895209.db2.gz GIPQHGGUBZJNNX-ZDUSSCGKSA-N 1 1 274.364 3.922 20 5 CHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCC1 ZINC000037092740 1131993599 /nfs/dbraw/zinc/99/35/99/1131993599.db2.gz ANVIKFNANQAGKH-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CC[C@@H](C)[N@@H+](CC)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001171916483 1132110152 /nfs/dbraw/zinc/11/01/52/1132110152.db2.gz MIHFCDRDZBJQEH-GFCCVEGCSA-N 1 1 250.342 3.524 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC3(C2)CCCC3)cc1Cl ZINC000839104004 1132181210 /nfs/dbraw/zinc/18/12/10/1132181210.db2.gz FUWMSELNWPYLDO-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO OC[C@@H]1CCC[N@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001141722697 1132239507 /nfs/dbraw/zinc/23/95/07/1132239507.db2.gz FJSIXFKFLYAQQT-KRWDZBQOSA-N 1 1 291.394 3.950 20 5 CHBDMO C[N@@H+](CCC1CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172919124 1132362253 /nfs/dbraw/zinc/36/22/53/1132362253.db2.gz DPUMDCJHBBFWAE-INIZCTEOSA-N 1 1 288.391 3.574 20 5 CHBDMO C[N@@H+]([C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)(C)C ZINC001172910331 1132372669 /nfs/dbraw/zinc/37/26/69/1132372669.db2.gz LQEKPLULDHCAKC-AWEZNQCLSA-N 1 1 276.380 3.573 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@](C)(F)C1 ZINC001173221384 1132411898 /nfs/dbraw/zinc/41/18/98/1132411898.db2.gz HWZZSYPPQUDEEH-CZUORRHYSA-N 1 1 294.370 3.740 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H]2CCC[C@H]21 ZINC001173233715 1132413886 /nfs/dbraw/zinc/41/38/86/1132413886.db2.gz MLBDIBLCQIOCAQ-FRFSOERESA-N 1 1 288.391 3.790 20 5 CHBDMO Cc1cccc(C[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173229189 1132414032 /nfs/dbraw/zinc/41/40/32/1132414032.db2.gz RISAZNYEYFHJRI-HNNXBMFYSA-N 1 1 298.386 3.966 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCCC12CC2 ZINC001173235745 1132415136 /nfs/dbraw/zinc/41/51/36/1132415136.db2.gz ZAZNJTCGPJPMPK-CYBMUJFWSA-N 1 1 274.364 3.544 20 5 CHBDMO CC[NH+](CC)c1ccc(Nc2ccc([N+](=O)[O-])nc2)cc1 ZINC001203572019 1133341389 /nfs/dbraw/zinc/34/13/89/1133341389.db2.gz RBNORHPRLIAPKM-UHFFFAOYSA-N 1 1 286.335 3.580 20 5 CHBDMO Cc1[nH+]c2c(Nc3ccc(C)cc3[N+](=O)[O-])cccn2c1C ZINC001214169218 1134515353 /nfs/dbraw/zinc/51/53/53/1134515353.db2.gz BIQOJEZMEMLQHS-UHFFFAOYSA-N 1 1 296.330 3.911 20 5 CHBDMO C[C@@H]1C[C@H](C)[C@H](C)[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355078911 227376742 /nfs/dbraw/zinc/37/67/42/227376742.db2.gz BVVKVBWRXAHYFW-VWYCJHECSA-N 1 1 268.382 3.523 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CCCCCF)C1CC1 ZINC000341925872 130129399 /nfs/dbraw/zinc/12/93/99/130129399.db2.gz VEERKPNLLDALDW-UHFFFAOYSA-N 1 1 280.343 3.699 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000035140406 172008142 /nfs/dbraw/zinc/00/81/42/172008142.db2.gz IKGVWSFUTIZWCN-WDEREUQCSA-N 1 1 260.293 3.600 20 5 CHBDMO C[C@H]1Cc2ccccc2C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000353664064 228141671 /nfs/dbraw/zinc/14/16/71/228141671.db2.gz FQXJDRUBFASGTF-ZDUSSCGKSA-N 1 1 282.343 3.542 20 5 CHBDMO C[C@@H]1c2ccsc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000015144755 260039558 /nfs/dbraw/zinc/03/95/58/260039558.db2.gz FQPKIGPBGCTTQT-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000015144755 260039560 /nfs/dbraw/zinc/03/95/60/260039560.db2.gz FQPKIGPBGCTTQT-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO Cc1csc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000080274750 260179731 /nfs/dbraw/zinc/17/97/31/260179731.db2.gz GLYCHHWZHSBVKF-MNOVXSKESA-N 1 1 291.376 3.772 20 5 CHBDMO C[C@H](CNc1ccc([N+](=O)[O-])cc1)[N@@H+](C)Cc1ccccc1 ZINC000301228835 261331675 /nfs/dbraw/zinc/33/16/75/261331675.db2.gz DIFMNFAWCKRBGC-CQSZACIVSA-N 1 1 299.374 3.527 20 5 CHBDMO Cc1ccnc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000285496534 263093554 /nfs/dbraw/zinc/09/35/54/263093554.db2.gz APIMMMTZXDQPJQ-CHWSQXEVSA-N 1 1 285.347 3.710 20 5 CHBDMO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(Cl)cc2F)c1 ZINC000157307208 264306488 /nfs/dbraw/zinc/30/64/88/264306488.db2.gz JMOYSUOFWQREQC-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)C1 ZINC000519001672 265289812 /nfs/dbraw/zinc/28/98/12/265289812.db2.gz MOAGPHGKKHPOTJ-GXTWGEPZSA-N 1 1 262.353 3.605 20 5 CHBDMO COCCCC[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000418134140 267359647 /nfs/dbraw/zinc/35/96/47/267359647.db2.gz MBLKCWIFIDADQY-UHFFFAOYSA-N 1 1 294.395 3.577 20 5 CHBDMO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)o1 ZINC000048327094 328051783 /nfs/dbraw/zinc/05/17/83/328051783.db2.gz INFCYQQFYITNDL-IAQYHMDHSA-N 1 1 286.331 3.601 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000051016699 328451962 /nfs/dbraw/zinc/45/19/62/328451962.db2.gz GLBJYOVSWYKJIT-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC=C(c2ccccc2)C1 ZINC000560170682 327288423 /nfs/dbraw/zinc/28/84/23/327288423.db2.gz SFQFYRJPKXIPSD-UHFFFAOYSA-N 1 1 294.354 3.884 20 5 CHBDMO CCSCC[C@@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000174026228 329157207 /nfs/dbraw/zinc/15/72/07/329157207.db2.gz XMNOANIIGUFVBQ-GFCCVEGCSA-N 1 1 282.409 3.558 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000179705890 329208012 /nfs/dbraw/zinc/20/80/12/329208012.db2.gz BYDKOAOHBCJEBN-MRXNPFEDSA-N 1 1 299.374 3.579 20 5 CHBDMO CC(C)c1ccc(C[N@H+](C)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000182028451 329238908 /nfs/dbraw/zinc/23/89/08/329238908.db2.gz ATTFLTZSSDEQNJ-UHFFFAOYSA-N 1 1 299.374 3.745 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)Cc2cccnc2)cc1[N+](=O)[O-] ZINC000182028451 329238910 /nfs/dbraw/zinc/23/89/10/329238910.db2.gz ATTFLTZSSDEQNJ-UHFFFAOYSA-N 1 1 299.374 3.745 20 5 CHBDMO Cc1c(C[N@H+](C)C2CCC(F)(F)CC2)cccc1[N+](=O)[O-] ZINC000580467330 330143814 /nfs/dbraw/zinc/14/38/14/330143814.db2.gz NQFDBPHHPUTZLX-UHFFFAOYSA-N 1 1 298.333 3.913 20 5 CHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCF)o2)c(Cl)c1 ZINC000437256879 330696176 /nfs/dbraw/zinc/69/61/76/330696176.db2.gz PJPOATBJBHELOG-UHFFFAOYSA-N 1 1 298.701 3.567 20 5 CHBDMO CC[C@H]1CCC[N@H+]1C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470173823 331033432 /nfs/dbraw/zinc/03/34/32/331033432.db2.gz GCONPAXSKGHBMN-VOMSXAGXSA-N 1 1 274.364 3.873 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000464780608 331367811 /nfs/dbraw/zinc/36/78/11/331367811.db2.gz RLXJLTFDZNWUJJ-MRXNPFEDSA-N 1 1 276.380 3.915 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000464780607 331367948 /nfs/dbraw/zinc/36/79/48/331367948.db2.gz RLXJLTFDZNWUJJ-INIZCTEOSA-N 1 1 276.380 3.915 20 5 CHBDMO CCSCC[C@@H](C)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000464856935 331371498 /nfs/dbraw/zinc/37/14/98/331371498.db2.gz MZGSJBROOSATMV-CYBMUJFWSA-N 1 1 296.436 3.601 20 5 CHBDMO CC[N@@H+](Cc1ccccc1C)Cc1ccccc1[N+](=O)[O-] ZINC000488388172 332003398 /nfs/dbraw/zinc/00/33/98/332003398.db2.gz GCSXILUQYZUXGR-UHFFFAOYSA-N 1 1 284.359 3.925 20 5 CHBDMO COc1cc(C[N@H+]2CCC[C@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000489140073 332042396 /nfs/dbraw/zinc/04/23/96/332042396.db2.gz PFTNKWQDCYXVOG-AWEZNQCLSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CC(C)(C)C ZINC000489142077 332042419 /nfs/dbraw/zinc/04/24/19/332042419.db2.gz UVGUAEXOOWXDCC-GFCCVEGCSA-N 1 1 264.369 3.942 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CC1CCC1 ZINC000489233485 332044076 /nfs/dbraw/zinc/04/40/76/332044076.db2.gz PZJPUJJDFUVNPF-LBPRGKRZSA-N 1 1 262.353 3.696 20 5 CHBDMO CCCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)C1CC1 ZINC000492458408 332398393 /nfs/dbraw/zinc/39/83/93/332398393.db2.gz CKGWJAQNYJJFFZ-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000195670006 336058184 /nfs/dbraw/zinc/05/81/84/336058184.db2.gz OKKHOSUIYOCYDE-CJNGLKHVSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000381386861 336061131 /nfs/dbraw/zinc/06/11/31/336061131.db2.gz LVAUVDLMQIQQPN-ABAIWWIYSA-N 1 1 280.343 3.744 20 5 CHBDMO COc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000352540217 533825806 /nfs/dbraw/zinc/82/58/06/533825806.db2.gz IJORSXIDXSUOQE-HNNXBMFYSA-N 1 1 298.342 3.550 20 5 CHBDMO COc1cc(C[N@H+]2CC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000352540217 533825813 /nfs/dbraw/zinc/82/58/13/533825813.db2.gz IJORSXIDXSUOQE-HNNXBMFYSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000353657913 534073430 /nfs/dbraw/zinc/07/34/30/534073430.db2.gz VFHYDXQYHKPLFT-CYBMUJFWSA-N 1 1 282.343 3.542 20 5 CHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000290300083 522965449 /nfs/dbraw/zinc/96/54/49/522965449.db2.gz BEBUIMUQFRQEKG-MRXNPFEDSA-N 1 1 299.374 3.881 20 5 CHBDMO CO[C@@]1(C)CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000280495954 523807387 /nfs/dbraw/zinc/80/73/87/523807387.db2.gz MOKFQNORUOMEGB-BBRMVZONSA-N 1 1 292.379 3.547 20 5 CHBDMO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccsc1 ZINC000061363020 525433113 /nfs/dbraw/zinc/43/31/13/525433113.db2.gz RKBLNLJBPVWZCD-VIFPVBQESA-N 1 1 280.324 3.646 20 5 CHBDMO Cc1csc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000038090860 526360727 /nfs/dbraw/zinc/36/07/27/526360727.db2.gz YKNIPTZIPSWJFY-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO Cc1csc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)n1 ZINC000126242657 526362031 /nfs/dbraw/zinc/36/20/31/526362031.db2.gz KWOOTJUWTKZGSS-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000353589529 528091939 /nfs/dbraw/zinc/09/19/39/528091939.db2.gz QFMDYFNDDLYXNH-GFCCVEGCSA-N 1 1 262.353 3.703 20 5 CHBDMO CC1(C)CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000353666160 528939530 /nfs/dbraw/zinc/93/95/30/528939530.db2.gz NZPMNSGIJNJKMJ-UHFFFAOYSA-N 1 1 268.382 3.668 20 5 CHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000353584113 529206249 /nfs/dbraw/zinc/20/62/49/529206249.db2.gz FACQWLHKDUCVDV-OAHLLOKOSA-N 1 1 294.420 3.702 20 5 CHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678032 1125181532 /nfs/dbraw/zinc/18/15/32/1125181532.db2.gz BCZSWMOMLCIVPU-ZWNOBZJWSA-N 1 1 282.771 3.869 20 5 CHBDMO CC(C)[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000886215060 1125660981 /nfs/dbraw/zinc/66/09/81/1125660981.db2.gz CQWNYGWDGAMZFB-AWEZNQCLSA-N 1 1 299.374 3.961 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000886540828 1125687427 /nfs/dbraw/zinc/68/74/27/1125687427.db2.gz LNABQOLEXMUDMI-BBRMVZONSA-N 1 1 297.358 3.573 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000485733617 1126948309 /nfs/dbraw/zinc/94/83/09/1126948309.db2.gz BMBCJBQFKPEEOI-TZMCWYRMSA-N 1 1 292.379 3.614 20 5 CHBDMO C[N@@H+](CCCCC(F)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC000269913404 1127048463 /nfs/dbraw/zinc/04/84/63/1127048463.db2.gz WHIBJDCWXKKGDB-UHFFFAOYSA-N 1 1 290.285 3.759 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](C)CC1 ZINC000349975658 1127170001 /nfs/dbraw/zinc/17/00/01/1127170001.db2.gz OETHAEFBJSJAFY-GFCCVEGCSA-N 1 1 262.353 3.525 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2C2CCCC2)cs1 ZINC000055927215 1127183207 /nfs/dbraw/zinc/18/32/07/1127183207.db2.gz LEUSZEUDAUMYJE-ZDUSSCGKSA-N 1 1 280.393 3.811 20 5 CHBDMO CC(C)[N@@H+](CC[C@H](C)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000351843772 1127211069 /nfs/dbraw/zinc/21/10/69/1127211069.db2.gz HQFQTUAUNKCUES-LBPRGKRZSA-N 1 1 268.332 3.553 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000589209375 1127216010 /nfs/dbraw/zinc/21/60/10/1127216010.db2.gz IZSDTPAKBZIXLF-OAHLLOKOSA-N 1 1 274.364 3.525 20 5 CHBDMO CC[C@H]1CC[C@@H](C)[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573046309 1127281332 /nfs/dbraw/zinc/28/13/32/1127281332.db2.gz XFKRKANPCKCJCA-OCCSQVGLSA-N 1 1 262.353 3.666 20 5 CHBDMO C[N@@H+](CCC(C)(C)C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000592144447 1127339165 /nfs/dbraw/zinc/33/91/65/1127339165.db2.gz IJSNCXKLJRXIGG-UHFFFAOYSA-N 1 1 291.351 3.604 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C(F)(F)F)C1 ZINC000761053948 1127413313 /nfs/dbraw/zinc/41/33/13/1127413313.db2.gz IFKIOJYXSLACPQ-GXSJLCMTSA-N 1 1 288.269 3.540 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000138894238 1127429797 /nfs/dbraw/zinc/42/97/97/1127429797.db2.gz IKPKJXOOVXHJJT-KRWDZBQOSA-N 1 1 298.342 3.638 20 5 CHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000359303811 1127457629 /nfs/dbraw/zinc/45/76/29/1127457629.db2.gz PTNWVJMWCGBYRL-SMDDNHRTSA-N 1 1 280.393 3.668 20 5 CHBDMO Cc1noc(C[N@@H+]2CCCC[C@@H]2CCC(C)C)c1[N+](=O)[O-] ZINC000595385401 1127461783 /nfs/dbraw/zinc/46/17/83/1127461783.db2.gz VGSDTMUKGGVWGO-CYBMUJFWSA-N 1 1 295.383 3.682 20 5 CHBDMO Cc1noc(C[N@H+](C)[C@H]2CCC[C@H]2C(C)(C)C)c1[N+](=O)[O-] ZINC000595553258 1127466828 /nfs/dbraw/zinc/46/68/28/1127466828.db2.gz WKWBBUIYEFISAH-NEPJUHHUSA-N 1 1 295.383 3.538 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](CCF)C1 ZINC000595754355 1127474833 /nfs/dbraw/zinc/47/48/33/1127474833.db2.gz ACKRLZNFXOEFEI-STQMWFEESA-N 1 1 280.343 3.727 20 5 CHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H]4C[C@@H]4C3)o2)cc1 ZINC000597222449 1127536009 /nfs/dbraw/zinc/53/60/09/1127536009.db2.gz CMZYBDVSSKRDQH-ZIAGYGMSSA-N 1 1 298.342 3.697 20 5 CHBDMO C[C@H](Nc1cc(C2CC2)cc[nH+]1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294127489 1127551482 /nfs/dbraw/zinc/55/14/82/1127551482.db2.gz LDALRGCLZBHSND-JTQLQIEISA-N 1 1 298.346 3.623 20 5 CHBDMO CC(C)(C)C[C@@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000060890060 1127614350 /nfs/dbraw/zinc/61/43/50/1127614350.db2.gz KTFZIIKVUCQOLE-AWEZNQCLSA-N 1 1 276.380 3.995 20 5 CHBDMO C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C(F)F ZINC000603428620 1127649437 /nfs/dbraw/zinc/64/94/37/1127649437.db2.gz KOHQTEYGOVHEJR-GMXVVIOVSA-N 1 1 298.333 3.549 20 5 CHBDMO CCC(F)(F)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000599069327 1127655456 /nfs/dbraw/zinc/65/54/56/1127655456.db2.gz VTVFAHXUFUILEH-NSHDSACASA-N 1 1 286.322 3.551 20 5 CHBDMO Cc1c(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000599512461 1127676766 /nfs/dbraw/zinc/67/67/66/1127676766.db2.gz JXJIOGIIIKFJHS-PHIMTYICSA-N 1 1 298.333 3.626 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cccc(F)c1 ZINC000061780716 1127716753 /nfs/dbraw/zinc/71/67/53/1127716753.db2.gz GGIHEFFQJHUVPN-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539827556 1127943971 /nfs/dbraw/zinc/94/39/71/1127943971.db2.gz IKYAZRWARYTEQS-BXUZGUMPSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000539826809 1127944329 /nfs/dbraw/zinc/94/43/29/1127944329.db2.gz ZBVOIPDTGWRQGG-CFNZNRNTSA-N 1 1 274.364 3.728 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)c(Cl)c1 ZINC000543859678 1127950365 /nfs/dbraw/zinc/95/03/65/1127950365.db2.gz RTIRHSSILIJWAQ-TXEJJXNPSA-N 1 1 294.782 3.870 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]12 ZINC000543897984 1127952749 /nfs/dbraw/zinc/95/27/49/1127952749.db2.gz GHBHNVSRHPIAHA-WQVCFCJDSA-N 1 1 274.364 3.605 20 5 CHBDMO Cc1ccc(C[N@@H+](C)C[C@H]2CC=CCC2)cc1[N+](=O)[O-] ZINC000544368199 1127970832 /nfs/dbraw/zinc/97/08/32/1127970832.db2.gz IZOFTHMRDMUWNE-AWEZNQCLSA-N 1 1 274.364 3.691 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H]1C1CCC1 ZINC000544612165 1127979126 /nfs/dbraw/zinc/97/91/26/1127979126.db2.gz UJBYBLWDYVKOBA-INIZCTEOSA-N 1 1 274.364 3.668 20 5 CHBDMO CC[C@@]1(C)CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000468136754 1127994729 /nfs/dbraw/zinc/99/47/29/1127994729.db2.gz AMWIOQOJAWDAGU-DOMZBBRYSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@H]1c2ccccc2OCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609145473 1128050552 /nfs/dbraw/zinc/05/05/52/1128050552.db2.gz FGVVEXSHQVAQOD-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609145473 1128050555 /nfs/dbraw/zinc/05/05/55/1128050555.db2.gz FGVVEXSHQVAQOD-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000609145516 1128050607 /nfs/dbraw/zinc/05/06/07/1128050607.db2.gz HFVWQHUMQLBODE-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000609145516 1128050610 /nfs/dbraw/zinc/05/06/10/1128050610.db2.gz HFVWQHUMQLBODE-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H](C)C(C)C ZINC000470169062 1128063740 /nfs/dbraw/zinc/06/37/40/1128063740.db2.gz BCJHJOKMTWWYTF-XXYUJHKVSA-N 1 1 276.380 3.974 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)CCC1CC1 ZINC000470172510 1128063955 /nfs/dbraw/zinc/06/39/55/1128063955.db2.gz XWDXNXSKROGDGW-RAXLEYEMSA-N 1 1 274.364 3.730 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H](C)C1CC1 ZINC000470176945 1128065192 /nfs/dbraw/zinc/06/51/92/1128065192.db2.gz ZFZILGASWFLYQI-CNELAYHGSA-N 1 1 274.364 3.728 20 5 CHBDMO CCOc1cc(C[N@@H+](C)CC2CCCC2)ccc1[N+](=O)[O-] ZINC000492656714 1128107304 /nfs/dbraw/zinc/10/73/04/1128107304.db2.gz RIJVODLBNRCRFR-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO C[C@H]1CCCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494196734 1128159384 /nfs/dbraw/zinc/15/93/84/1128159384.db2.gz ZCVDZFIVXNRLOF-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@H]1CCCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494196734 1128159387 /nfs/dbraw/zinc/15/93/87/1128159387.db2.gz ZCVDZFIVXNRLOF-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@H](c1cccs1)[N@H+](CC[N+](=O)[O-])Cc1ccccc1 ZINC000929401926 1128272519 /nfs/dbraw/zinc/27/25/19/1128272519.db2.gz LKBIIXGKQUHPSA-CYBMUJFWSA-N 1 1 290.388 3.588 20 5 CHBDMO C[C@H](c1cccs1)[N@@H+](CC[N+](=O)[O-])Cc1ccccc1 ZINC000929401926 1128272522 /nfs/dbraw/zinc/27/25/22/1128272522.db2.gz LKBIIXGKQUHPSA-CYBMUJFWSA-N 1 1 290.388 3.588 20 5 CHBDMO Cc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000035368197 1128329247 /nfs/dbraw/zinc/32/92/47/1128329247.db2.gz DUNXSIRRMZQULP-UHFFFAOYSA-N 1 1 290.750 3.846 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000562058752 1128374865 /nfs/dbraw/zinc/37/48/65/1128374865.db2.gz QFFGWLMOZZKLGK-GFCCVEGCSA-N 1 1 280.368 3.614 20 5 CHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C/C=C/Cl)C2)cc1 ZINC000831534527 1128517077 /nfs/dbraw/zinc/51/70/77/1128517077.db2.gz PCRWKCZFSMNRGS-DRQXCOHGSA-N 1 1 280.755 3.527 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](CC2CC2)C1 ZINC000556959517 1128652716 /nfs/dbraw/zinc/65/27/16/1128652716.db2.gz XDECYZPDIWANFE-CQSZACIVSA-N 1 1 274.364 3.525 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1c1ccsc1 ZINC000046088100 1128658498 /nfs/dbraw/zinc/65/84/98/1128658498.db2.gz ZFIHAVUDJMZDDQ-CQSZACIVSA-N 1 1 288.372 3.993 20 5 CHBDMO C[N@@H+](CCCc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000046599286 1128663635 /nfs/dbraw/zinc/66/36/35/1128663635.db2.gz ODBHVYHEJJBBLX-UHFFFAOYSA-N 1 1 284.359 3.659 20 5 CHBDMO CCC(CC)[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CC1 ZINC000920409842 1128680520 /nfs/dbraw/zinc/68/05/20/1128680520.db2.gz OJADDAUVBIZYMJ-UHFFFAOYSA-N 1 1 280.343 3.887 20 5 CHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609767166 1128724703 /nfs/dbraw/zinc/72/47/03/1128724703.db2.gz SXTJCVKAIXWRDA-CQSZACIVSA-N 1 1 280.343 3.744 20 5 CHBDMO O=[N+]([O-])c1ccccc1CNc1ccc(C2CCC2)c[nH+]1 ZINC000339560779 1117863553 /nfs/dbraw/zinc/86/35/53/1117863553.db2.gz GCIMQVGCELZCDN-UHFFFAOYSA-N 1 1 283.331 3.869 20 5 CHBDMO C[C@@H]1CCC[C@H](C)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000610215364 1117882128 /nfs/dbraw/zinc/88/21/28/1117882128.db2.gz HJLWBGMZXAOIMM-UONOGXRCSA-N 1 1 276.380 3.648 20 5 CHBDMO Cc1c(C[N@H+]2CC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000471170667 1117917561 /nfs/dbraw/zinc/91/75/61/1117917561.db2.gz XCBPWALCAABWTP-QGZVFWFLSA-N 1 1 282.343 3.850 20 5 CHBDMO CC[N@@H+](CCc1ccccn1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000764313242 1118082820 /nfs/dbraw/zinc/08/28/20/1118082820.db2.gz FKDAWPGONQTTPG-AWEZNQCLSA-N 1 1 299.374 3.615 20 5 CHBDMO Cc1ccc(CC[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000536003457 1118276915 /nfs/dbraw/zinc/27/69/15/1118276915.db2.gz KNCOAESTVIXTNK-UHFFFAOYSA-N 1 1 296.370 3.504 20 5 CHBDMO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CO2 ZINC000090452336 1118327865 /nfs/dbraw/zinc/32/78/65/1118327865.db2.gz MFYVQQURUZUIES-WBMJQRKESA-N 1 1 298.342 3.688 20 5 CHBDMO CC(C)[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)CC1CCC1 ZINC000510765662 1118810886 /nfs/dbraw/zinc/81/08/86/1118810886.db2.gz ODVFUVUGZZXRTL-UHFFFAOYSA-N 1 1 298.333 3.884 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000033394617 1118965068 /nfs/dbraw/zinc/96/50/68/1118965068.db2.gz POPOFVNWGIWNGF-VIHMKRCTSA-N 1 1 274.364 3.873 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511128045 1119084362 /nfs/dbraw/zinc/08/43/62/1119084362.db2.gz WHOQIOQKLPPNJQ-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000479565361 1119124610 /nfs/dbraw/zinc/12/46/10/1119124610.db2.gz IMWFCADLAXTKBE-INIZCTEOSA-N 1 1 282.343 3.584 20 5 CHBDMO CC[N@H+](Cc1ccoc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000612578221 1119801898 /nfs/dbraw/zinc/80/18/98/1119801898.db2.gz KPMXOXYSXLFMDK-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO CC[N@@H+](Cc1ccoc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000612578221 1119801903 /nfs/dbraw/zinc/80/19/03/1119801903.db2.gz KPMXOXYSXLFMDK-UHFFFAOYSA-N 1 1 274.320 3.518 20 5 CHBDMO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000181362754 1120041954 /nfs/dbraw/zinc/04/19/54/1120041954.db2.gz MVLFIXAHHUPLGB-LLVKDONJSA-N 1 1 297.314 3.587 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000066696204 1120047712 /nfs/dbraw/zinc/04/77/12/1120047712.db2.gz DTGIMHMPQKWEKB-CYBMUJFWSA-N 1 1 270.332 3.788 20 5 CHBDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000091437159 1120171948 /nfs/dbraw/zinc/17/19/48/1120171948.db2.gz DAAHKBFQOMWELW-VHSXEESVSA-N 1 1 289.335 3.611 20 5 CHBDMO CC[N@H+](Cc1ccncc1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271000466 1120220937 /nfs/dbraw/zinc/22/09/37/1120220937.db2.gz JYVZEMKYULLWIG-ZDUSSCGKSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271000466 1120220940 /nfs/dbraw/zinc/22/09/40/1120220940.db2.gz JYVZEMKYULLWIG-ZDUSSCGKSA-N 1 1 285.347 3.573 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H]1CC=CCC1 ZINC000543179074 1120452501 /nfs/dbraw/zinc/45/25/01/1120452501.db2.gz WICLCHQMHWGXCR-LBPRGKRZSA-N 1 1 278.327 3.522 20 5 CHBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000053422731 1120494875 /nfs/dbraw/zinc/49/48/75/1120494875.db2.gz MRLRDXSVHVYIKY-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1ccc(F)cc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000053422364 1120495133 /nfs/dbraw/zinc/49/51/33/1120495133.db2.gz PFFMAAJDSWBYGE-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO CC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555417159 1120596229 /nfs/dbraw/zinc/59/62/29/1120596229.db2.gz YKAHFQGFPUQCKR-SECBINFHSA-N 1 1 290.285 3.844 20 5 CHBDMO C[C@@H](C[N@@H+](C)Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000066853533 1120596299 /nfs/dbraw/zinc/59/62/99/1120596299.db2.gz HSAQBXUTDARBIR-LBPRGKRZSA-N 1 1 290.388 3.892 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCc2occc2C1 ZINC000344232930 1121126582 /nfs/dbraw/zinc/12/65/82/1121126582.db2.gz GVRUNLIBYJHVHY-LBPRGKRZSA-N 1 1 286.331 3.697 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCc2occc2C1 ZINC000344232930 1121126584 /nfs/dbraw/zinc/12/65/84/1121126584.db2.gz GVRUNLIBYJHVHY-LBPRGKRZSA-N 1 1 286.331 3.697 20 5 CHBDMO C[C@H]1c2sccc2CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001175828547 1121467784 /nfs/dbraw/zinc/46/77/84/1121467784.db2.gz BNFIHKRWKXGTTP-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H]1c2sccc2CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001175828547 1121467786 /nfs/dbraw/zinc/46/77/86/1121467786.db2.gz BNFIHKRWKXGTTP-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO Cc1cc[nH+]c(C)c1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175899648 1121493356 /nfs/dbraw/zinc/49/33/56/1121493356.db2.gz ZZBHXTIPKULHCW-CSKARUKUSA-N 1 1 269.304 3.689 20 5 CHBDMO Cc1ccc(C)c(Nc2ccc(/C=C/[N+](=O)[O-])cc2)[nH+]1 ZINC001175900692 1121493565 /nfs/dbraw/zinc/49/35/65/1121493565.db2.gz CXAPHUKXAGTEAU-MDZDMXLPSA-N 1 1 269.304 3.689 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]1C1CCC1 ZINC000512653361 1121510281 /nfs/dbraw/zinc/51/02/81/1121510281.db2.gz WNNFKPHLMQHFSS-SGNXQUTQSA-N 1 1 286.375 3.873 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCOC(C)(C)C ZINC000611516523 1121654106 /nfs/dbraw/zinc/65/41/06/1121654106.db2.gz OPJNZHWQIOILQP-ZDUSSCGKSA-N 1 1 294.395 3.711 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[Si](C)(C)C ZINC000731211899 1121854003 /nfs/dbraw/zinc/85/40/03/1121854003.db2.gz HLAZWUDANWKAAK-UHFFFAOYSA-N 1 1 280.444 3.683 20 5 CHBDMO C[N@@H+](CCCCNc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000413346160 1122013462 /nfs/dbraw/zinc/01/34/62/1122013462.db2.gz HOSLQPVLPMFSRF-UHFFFAOYSA-N 1 1 297.786 3.535 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2Cc2ccccc2)c1 ZINC000501871519 1122019262 /nfs/dbraw/zinc/01/92/62/1122019262.db2.gz PKBRQVOIVRKTHQ-QGZVFWFLSA-N 1 1 296.370 3.802 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CC[C@H](C)C1 ZINC000429591127 1122142882 /nfs/dbraw/zinc/14/28/82/1122142882.db2.gz QQQSEONJPUQIDO-GXTWGEPZSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H]1CC(C)(C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001182396495 1122151469 /nfs/dbraw/zinc/15/14/69/1122151469.db2.gz IDACLUPCMJUWPA-SNVBAGLBSA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1ccc(C[N@H+]([C@@H](C)C(C)C)C2CC2)cc1[N+](=O)[O-] ZINC000505256304 1122352184 /nfs/dbraw/zinc/35/21/84/1122352184.db2.gz ZHURRNIXHTUBAI-ZDUSSCGKSA-N 1 1 276.380 3.912 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCSC(C)(C)CC1 ZINC000434683732 1122396178 /nfs/dbraw/zinc/39/61/78/1122396178.db2.gz FOJRIOSABQBCEF-GFCCVEGCSA-N 1 1 294.420 3.873 20 5 CHBDMO Cc1cc(C)c(COc2cccc([N+](=O)[O-])c2C)c(C)[nH+]1 ZINC001188650308 1122470719 /nfs/dbraw/zinc/47/07/19/1122470719.db2.gz LSTMWYLCNCNALP-UHFFFAOYSA-N 1 1 286.331 3.802 20 5 CHBDMO CC[C@H](C)C[N@@H+](CC)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001191374866 1122598014 /nfs/dbraw/zinc/59/80/14/1122598014.db2.gz KJNLVGKPXUDXFP-AWEZNQCLSA-N 1 1 294.395 3.732 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001191986091 1122623167 /nfs/dbraw/zinc/62/31/67/1122623167.db2.gz IWDNXXQUHHNSJR-OAHLLOKOSA-N 1 1 276.380 3.649 20 5 CHBDMO CCCCC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194466964 1122776454 /nfs/dbraw/zinc/77/64/54/1122776454.db2.gz MIFZRDSAPFCRGM-HNNXBMFYSA-N 1 1 276.380 3.964 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H]2CCC[C@H]21 ZINC000426488826 1122804316 /nfs/dbraw/zinc/80/43/16/1122804316.db2.gz XYWRPEXWKYCUAJ-ZWNOBZJWSA-N 1 1 280.755 3.623 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C1(C)CCCC1 ZINC000426513380 1122811549 /nfs/dbraw/zinc/81/15/49/1122811549.db2.gz IIJWHJZXVGDJLQ-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@H]1CC1(C)C ZINC000426569506 1122823210 /nfs/dbraw/zinc/82/32/10/1122823210.db2.gz AVTREXFKFFIJSA-JQVXPOPVSA-N 1 1 274.364 3.728 20 5 CHBDMO CC(C)[C@@H]1CCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507187521 1122845257 /nfs/dbraw/zinc/84/52/57/1122845257.db2.gz KUCUGMFMZULRPZ-PXTSUWAFSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1ccc(C)c(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000507166953 1122932162 /nfs/dbraw/zinc/93/21/62/1122932162.db2.gz GKFQQAULIOWZIB-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H]1CC=CCC1)C1CC1 ZINC000507168992 1122935255 /nfs/dbraw/zinc/93/52/55/1122935255.db2.gz GQVZZYLZHZYZKK-AWEZNQCLSA-N 1 1 286.375 3.916 20 5 CHBDMO C[C@@H]([NH2+]Cc1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1 ZINC001197647281 1122962891 /nfs/dbraw/zinc/96/28/91/1122962891.db2.gz PNXJZFSOWYCYEF-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1occc1C[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000048912768 1122991386 /nfs/dbraw/zinc/99/13/86/1122991386.db2.gz IYMDOOXOAGIWAQ-UHFFFAOYSA-N 1 1 294.738 3.782 20 5 CHBDMO Cc1occc1C[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000048912768 1122991389 /nfs/dbraw/zinc/99/13/89/1122991389.db2.gz IYMDOOXOAGIWAQ-UHFFFAOYSA-N 1 1 294.738 3.782 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]21 ZINC000543897981 1123108729 /nfs/dbraw/zinc/10/87/29/1123108729.db2.gz GHBHNVSRHPIAHA-DAXOMENPSA-N 1 1 274.364 3.605 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@H]3CCC[C@H]32)cccc1[N+](=O)[O-] ZINC000441432671 1123116562 /nfs/dbraw/zinc/11/65/62/1123116562.db2.gz FBGVBRHDFBIHML-CZUORRHYSA-N 1 1 274.364 3.668 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000852220786 1123400655 /nfs/dbraw/zinc/40/06/55/1123400655.db2.gz XXDLFDMNIVUFCI-GWCFXTLKSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000852220786 1123400656 /nfs/dbraw/zinc/40/06/56/1123400656.db2.gz XXDLFDMNIVUFCI-GWCFXTLKSA-N 1 1 280.755 3.623 20 5 CHBDMO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])oc1C ZINC000281974113 1123764478 /nfs/dbraw/zinc/76/44/78/1123764478.db2.gz BQEGULYUPNEWPW-LLVKDONJSA-N 1 1 274.320 3.655 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000144085559 1124095449 /nfs/dbraw/zinc/09/54/49/1124095449.db2.gz YXZHQEQJPNYHOV-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509648562 1124133506 /nfs/dbraw/zinc/13/35/06/1124133506.db2.gz CHWCPZOVZDLKPR-CQSZACIVSA-N 1 1 298.333 3.884 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509648562 1124133507 /nfs/dbraw/zinc/13/35/07/1124133507.db2.gz CHWCPZOVZDLKPR-CQSZACIVSA-N 1 1 298.333 3.884 20 5 CHBDMO C[C@H]1Cc2ccccc2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000525637702 1124451561 /nfs/dbraw/zinc/45/15/61/1124451561.db2.gz ZEELYSGWZMDDDP-AWEZNQCLSA-N 1 1 296.370 3.584 20 5 CHBDMO C[C@@H](c1ccc(F)cc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000053422728 1124609742 /nfs/dbraw/zinc/60/97/42/1124609742.db2.gz MRLRDXSVHVYIKY-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccco1 ZINC000872016930 1124657181 /nfs/dbraw/zinc/65/71/81/1124657181.db2.gz QQGSQQTYFASJKS-JTQLQIEISA-N 1 1 292.360 3.761 20 5 CHBDMO Cc1ccsc1C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872028178 1124660303 /nfs/dbraw/zinc/66/03/03/1124660303.db2.gz PQTNVGVJWQEASC-JTQLQIEISA-N 1 1 294.351 3.955 20 5 CHBDMO C[C@@H]1[C@@H](c2ccccc2)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000531441468 1125218941 /nfs/dbraw/zinc/21/89/41/1125218941.db2.gz NOXYHJJFFXODIL-KDOFPFPSSA-N 1 1 296.370 3.973 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[NH+]2CCCCCCC2)c(F)c1 ZINC000795851755 1129452861 /nfs/dbraw/zinc/45/28/61/1129452861.db2.gz VRRCYNWLCPCNRO-UHFFFAOYSA-N 1 1 284.306 3.639 20 5 CHBDMO CC1=C(C)C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000796020580 1129463225 /nfs/dbraw/zinc/46/32/25/1129463225.db2.gz OYBMHJHOADOWQV-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO CC1=C(C)C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000796020580 1129463227 /nfs/dbraw/zinc/46/32/27/1129463227.db2.gz OYBMHJHOADOWQV-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO CC(C)(C)[N@@H+](Cc1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169005755 1129689357 /nfs/dbraw/zinc/68/93/57/1129689357.db2.gz CSMCRMXTEJMECB-JKSUJKDBSA-N 1 1 290.407 3.733 20 5 CHBDMO C[C@H](c1ccccc1Cl)[N@@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169049592 1129691881 /nfs/dbraw/zinc/69/18/81/1129691881.db2.gz WQKLLLDQLUOGOR-JHJVBQTASA-N 1 1 296.798 3.778 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC2(CCCC2)C1 ZINC000769395143 1129909759 /nfs/dbraw/zinc/90/97/59/1129909759.db2.gz NDVCJDBGXSGDJL-FNORWQNLSA-N 1 1 286.375 3.874 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801518480 1129923733 /nfs/dbraw/zinc/92/37/33/1129923733.db2.gz JLATUTWSMUQJOQ-OAHLLOKOSA-N 1 1 280.343 3.746 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@H]2CCCC[C@@H]12 ZINC000801539207 1129925784 /nfs/dbraw/zinc/92/57/84/1129925784.db2.gz CXSQAJBAXYGXFR-ZLDLUXBVSA-N 1 1 292.354 3.744 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H]2CCCC[C@@H]21 ZINC000801539206 1129925796 /nfs/dbraw/zinc/92/57/96/1129925796.db2.gz CXSQAJBAXYGXFR-UXIGCNINSA-N 1 1 292.354 3.744 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCCC2(CC2)C1 ZINC000770672624 1129955111 /nfs/dbraw/zinc/95/51/11/1129955111.db2.gz AYKJUCQOXLNJKV-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCCC2(CC2)C1 ZINC000770672624 1129955114 /nfs/dbraw/zinc/95/51/14/1129955114.db2.gz AYKJUCQOXLNJKV-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO C[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1C ZINC000050564682 1129971719 /nfs/dbraw/zinc/97/17/19/1129971719.db2.gz XVKOUWJXNCMXHX-GHMZBOCLSA-N 1 1 282.771 3.869 20 5 CHBDMO CCC(C)(C)CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001170196058 1130461018 /nfs/dbraw/zinc/46/10/18/1130461018.db2.gz XWDDCZGHJQQQCQ-UHFFFAOYSA-N 1 1 278.396 3.895 20 5 CHBDMO N[C@]12C[C@H]1C[N@@H+](Cc1c3ccccc3cc3ccccc31)C2 ZINC001235146522 1130714161 /nfs/dbraw/zinc/71/41/61/1130714161.db2.gz MVZANKXCFWNNDN-JXFKEZNVSA-N 1 1 288.394 3.526 20 5 CHBDMO [NH3+][C@]12C[C@H]1CN(Cc1c3ccccc3cc3ccccc31)C2 ZINC001235146522 1130714167 /nfs/dbraw/zinc/71/41/67/1130714167.db2.gz MVZANKXCFWNNDN-JXFKEZNVSA-N 1 1 288.394 3.526 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000781982671 1130750919 /nfs/dbraw/zinc/75/09/19/1130750919.db2.gz PQWDDMHULVXSIT-LBPRGKRZSA-N 1 1 280.343 3.602 20 5 CHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 ZINC000782107227 1130755224 /nfs/dbraw/zinc/75/52/24/1130755224.db2.gz LFQHECREIDQWIP-BLLLJJGKSA-N 1 1 292.354 3.746 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+]([C@@H]1CCc3ccccc31)C2 ZINC000782181903 1130757643 /nfs/dbraw/zinc/75/76/43/1130757643.db2.gz JMMJKVYXTNHYHC-QGZVFWFLSA-N 1 1 294.354 3.640 20 5 CHBDMO CC(C)[NH+]1CC(Oc2cccc3ccc4cccnc4c32)C1 ZINC001227765784 1131739467 /nfs/dbraw/zinc/73/94/67/1131739467.db2.gz ZENICQYRXCASNA-UHFFFAOYSA-N 1 1 292.382 3.859 20 5 CHBDMO C[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036964874 1131983260 /nfs/dbraw/zinc/98/32/60/1131983260.db2.gz IELMACCZOXTRMB-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036964874 1131983267 /nfs/dbraw/zinc/98/32/67/1131983267.db2.gz IELMACCZOXTRMB-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccns1 ZINC000716015613 1132008462 /nfs/dbraw/zinc/00/84/62/1132008462.db2.gz QZGJEGSJRRHEHJ-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO Cc1[nH+]ccn1-c1ccc(Nc2ccccc2[N+](=O)[O-])cc1 ZINC001206164329 1132198492 /nfs/dbraw/zinc/19/84/92/1132198492.db2.gz HANQCOUPYARPNY-UHFFFAOYSA-N 1 1 294.314 3.833 20 5 CHBDMO CC1(C)CCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172904950 1132347326 /nfs/dbraw/zinc/34/73/26/1132347326.db2.gz BNJQLJKHROIINF-HNNXBMFYSA-N 1 1 288.391 3.717 20 5 CHBDMO C[N@@H+](CC(C)(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914198 1132359865 /nfs/dbraw/zinc/35/98/65/1132359865.db2.gz DYYKJMWZVPHMCK-OAHLLOKOSA-N 1 1 290.407 3.820 20 5 CHBDMO C[N@@H+](CC(C)(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914197 1132359912 /nfs/dbraw/zinc/35/99/12/1132359912.db2.gz DYYKJMWZVPHMCK-HNNXBMFYSA-N 1 1 290.407 3.820 20 5 CHBDMO C[C@H]1CCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172909385 1132371904 /nfs/dbraw/zinc/37/19/04/1132371904.db2.gz RJXKRMMNARCDSE-XJKSGUPXSA-N 1 1 288.391 3.574 20 5 CHBDMO CC1(C)CCC[N@H+]1CCNc1ccc(Cl)cc1[N+](=O)[O-] ZINC001163480709 1133152034 /nfs/dbraw/zinc/15/20/34/1133152034.db2.gz LZHXJAOOPWNPLE-UHFFFAOYSA-N 1 1 297.786 3.535 20 5 CHBDMO O=[N+]([O-])c1ccccc1Nc1ccc2c[nH+]ccc2c1 ZINC001206157901 1133665499 /nfs/dbraw/zinc/66/54/99/1133665499.db2.gz IVAABJNTJKBCGQ-UHFFFAOYSA-N 1 1 265.272 3.887 20 5 CHBDMO C[NH2+]CC1CN(Cc2c3ccccc3cc3ccccc32)C1 ZINC001210560932 1134249416 /nfs/dbraw/zinc/24/94/16/1134249416.db2.gz FTBAFQCHNHNTHM-UHFFFAOYSA-N 1 1 290.410 3.644 20 5 CHBDMO Cc1cc(C)[nH+]c(Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC001211284855 1134403081 /nfs/dbraw/zinc/40/30/81/1134403081.db2.gz PWNUEEYUOMEDDU-UHFFFAOYSA-N 1 1 257.293 3.659 20 5 CHBDMO C[C@@H]([NH2+]CC=C(Cl)Cl)c1ccccc1[N+](=O)[O-] ZINC000407074426 1135091609 /nfs/dbraw/zinc/09/16/09/1135091609.db2.gz VSJNXRYYWSNJNS-MRVPVSSYSA-N 1 1 275.135 3.564 20 5 CHBDMO CC[NH+]1CC(OCc2c3ccccc3nc3ccccc32)C1 ZINC001223332862 1135329512 /nfs/dbraw/zinc/32/95/12/1135329512.db2.gz WORAMUJHVWFITQ-UHFFFAOYSA-N 1 1 292.382 3.609 20 5 CHBDMO CC(C)[N@H+]1CCC[C@H](O[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC001223428016 1135344599 /nfs/dbraw/zinc/34/45/99/1135344599.db2.gz YSSXLPJBVAOMDR-CJNGLKHVSA-N 1 1 292.379 3.545 20 5 CHBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355078908 227377340 /nfs/dbraw/zinc/37/73/40/227377340.db2.gz BVVKVBWRXAHYFW-GMTAPVOTSA-N 1 1 268.382 3.523 20 5 CHBDMO Cc1c(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000426768929 260279273 /nfs/dbraw/zinc/27/92/73/260279273.db2.gz DKWYRDNHYHUSAV-GASCZTMLSA-N 1 1 274.364 3.525 20 5 CHBDMO CC(C)C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000525786426 262236070 /nfs/dbraw/zinc/23/60/70/262236070.db2.gz GYZYNYWSQXHHGW-UHFFFAOYSA-N 1 1 268.382 3.524 20 5 CHBDMO C[C@@H](c1ccco1)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119175527 267304925 /nfs/dbraw/zinc/30/49/25/267304925.db2.gz SXCVLETWJLWMNR-LBPRGKRZSA-N 1 1 286.331 3.913 20 5 CHBDMO C[C@@H](c1ccco1)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000119175527 267304927 /nfs/dbraw/zinc/30/49/27/267304927.db2.gz SXCVLETWJLWMNR-LBPRGKRZSA-N 1 1 286.331 3.913 20 5 CHBDMO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)o1 ZINC000048327096 328051796 /nfs/dbraw/zinc/05/17/96/328051796.db2.gz INFCYQQFYITNDL-XHDPSFHLSA-N 1 1 286.331 3.601 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cn1 ZINC000271805513 328197283 /nfs/dbraw/zinc/19/72/83/328197283.db2.gz PZXASVDDQNRHRR-QWRGUYRKSA-N 1 1 289.310 3.541 20 5 CHBDMO Cc1ccc(N[C@@H]2C[N@H+](C)Cc3ccccc32)c([N+](=O)[O-])c1 ZINC000534530367 328305155 /nfs/dbraw/zinc/30/51/55/328305155.db2.gz BCSWMDNQGFACHJ-MRXNPFEDSA-N 1 1 297.358 3.502 20 5 CHBDMO CCc1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])o1 ZINC000089512370 327170833 /nfs/dbraw/zinc/17/08/33/327170833.db2.gz MRKKKKLNMNDYHW-NSHDSACASA-N 1 1 274.320 3.601 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(Cl)cc2)cs1 ZINC000037562670 329550487 /nfs/dbraw/zinc/55/04/87/329550487.db2.gz XEEWSYPQKUFSSS-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO CCC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000089512086 330385727 /nfs/dbraw/zinc/38/57/27/330385727.db2.gz CZIJSWOQCKXFBU-CQSZACIVSA-N 1 1 285.347 3.621 20 5 CHBDMO Cc1c(C[N@H+]2C[C@H](C)CC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000464815899 331369440 /nfs/dbraw/zinc/36/94/40/331369440.db2.gz VIWAXFUZDCPGQG-NEPJUHHUSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000464822214 331369742 /nfs/dbraw/zinc/36/97/42/331369742.db2.gz KXGIUFYLDKHJPN-QWRGUYRKSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490551770 332091331 /nfs/dbraw/zinc/09/13/31/332091331.db2.gz ZJQKRJKTPPJZNU-WQGACYEGSA-N 1 1 292.354 3.887 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000523701994 333340208 /nfs/dbraw/zinc/34/02/08/333340208.db2.gz KWWRKWPTGAVPIV-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO CC(C)[C@@H]1[N@H+](Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000576010858 335141438 /nfs/dbraw/zinc/14/14/38/335141438.db2.gz RBPQDXWWHXSIHN-LBPRGKRZSA-N 1 1 268.382 3.523 20 5 CHBDMO CC(C)[C@@H]1[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000576010858 335141439 /nfs/dbraw/zinc/14/14/39/335141439.db2.gz RBPQDXWWHXSIHN-LBPRGKRZSA-N 1 1 268.382 3.523 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000576021257 335142439 /nfs/dbraw/zinc/14/24/39/335142439.db2.gz WSYYFIBKHHIYAU-MTENODCZSA-N 1 1 274.364 3.871 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCS[C@H](C)CC1 ZINC000249014157 334324632 /nfs/dbraw/zinc/32/46/32/334324632.db2.gz JXUUGIIWKZZXEB-CHWSQXEVSA-N 1 1 294.420 3.792 20 5 CHBDMO Cc1ccoc1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000267220443 334695992 /nfs/dbraw/zinc/69/59/92/334695992.db2.gz CXWJCOJKOWCJIJ-LBPRGKRZSA-N 1 1 274.320 3.655 20 5 CHBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000066561428 524398448 /nfs/dbraw/zinc/39/84/48/524398448.db2.gz FGFIULXYDYXLKD-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000066561428 524398456 /nfs/dbraw/zinc/39/84/56/524398456.db2.gz FGFIULXYDYXLKD-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289687884 526084757 /nfs/dbraw/zinc/08/47/57/526084757.db2.gz GUMNJFRGMQRDEA-GHMZBOCLSA-N 1 1 284.306 3.633 20 5 CHBDMO Cc1sccc1C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000353360639 526911866 /nfs/dbraw/zinc/91/18/66/526911866.db2.gz JNZACDWLCAZBNY-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO Cc1c(C[N@H+](CC2CC2)C(C)C)cccc1[N+](=O)[O-] ZINC000532665319 1125477229 /nfs/dbraw/zinc/47/72/29/1125477229.db2.gz MIJAAEZJDCBDRS-UHFFFAOYSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000302754087 1120656745 /nfs/dbraw/zinc/65/67/45/1120656745.db2.gz ZNOODGQOSSLVAM-FRRDWIJNSA-N 1 1 262.353 3.634 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCC[C@H]2F)c(Cl)c1 ZINC000414507053 1122084549 /nfs/dbraw/zinc/08/45/49/1122084549.db2.gz ABYIHDOPPKQXRV-CHWSQXEVSA-N 1 1 286.734 3.619 20 5 CHBDMO CCCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000507243287 1122943824 /nfs/dbraw/zinc/94/38/24/1122943824.db2.gz LDTDITTXIWMOCT-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccncc1F ZINC000338020070 1126711202 /nfs/dbraw/zinc/71/12/02/1126711202.db2.gz PUBRDDPNKWNHHY-WDEREUQCSA-N 1 1 289.310 3.541 20 5 CHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000482507475 1126762120 /nfs/dbraw/zinc/76/21/20/1126762120.db2.gz JNLYCRAWSMKSHQ-GXTWGEPZSA-N 1 1 262.353 3.524 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)(C)C ZINC000045073473 1127179276 /nfs/dbraw/zinc/17/92/76/1127179276.db2.gz XQHSADDWSFYRBZ-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO C[C@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000571890688 1127179460 /nfs/dbraw/zinc/17/94/60/1127179460.db2.gz YPEDMPCVCOIYKL-OAHLLOKOSA-N 1 1 298.386 3.873 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2C[C@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000816646777 1131119677 /nfs/dbraw/zinc/11/96/77/1131119677.db2.gz IYCGQDQGAPHAPP-RYUDHWBXSA-N 1 1 262.353 3.558 20 5 CHBDMO CCC[N@H+](Cc1csc([N+](=O)[O-])c1)CC(C)C ZINC000351604282 1127197348 /nfs/dbraw/zinc/19/73/48/1127197348.db2.gz TVHULYCNVISKFK-UHFFFAOYSA-N 1 1 256.371 3.524 20 5 CHBDMO CC1(C)C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCC[C@H]21 ZINC000590204417 1127251620 /nfs/dbraw/zinc/25/16/20/1127251620.db2.gz IEXOXACGTIRLIE-DOMZBBRYSA-N 1 1 292.354 3.744 20 5 CHBDMO Cc1ccc[nH+]c1NCc1ccc([N+](=O)[O-])cc1Cl ZINC000353252606 1127265797 /nfs/dbraw/zinc/26/57/97/1127265797.db2.gz SQOPNAMVKMXENY-UHFFFAOYSA-N 1 1 277.711 3.564 20 5 CHBDMO CC(C)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000045751704 1127292924 /nfs/dbraw/zinc/29/29/24/1127292924.db2.gz ULLKCBCKUOSJBG-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1C[C@@H]1c1ccccc1 ZINC000355218371 1127326250 /nfs/dbraw/zinc/32/62/50/1127326250.db2.gz HTDDJLDHQPRIQI-WBVHZDCISA-N 1 1 282.343 3.583 20 5 CHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@H]1CCC(C)(C)C1 ZINC000355582364 1127350899 /nfs/dbraw/zinc/35/08/99/1127350899.db2.gz LLNKRPBHJHUDHC-NSHDSACASA-N 1 1 268.382 3.667 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(Cl)o1 ZINC000594513372 1127420258 /nfs/dbraw/zinc/42/02/58/1127420258.db2.gz NHUWHHKMMRASLG-LBPRGKRZSA-N 1 1 292.722 3.618 20 5 CHBDMO C[C@H](c1ccccc1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595289540 1127458110 /nfs/dbraw/zinc/45/81/10/1127458110.db2.gz UBCDVDUYBADAKB-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595289540 1127458112 /nfs/dbraw/zinc/45/81/12/1127458112.db2.gz UBCDVDUYBADAKB-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO CC[N@H+](Cc1cccs1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595287758 1127458272 /nfs/dbraw/zinc/45/82/72/1127458272.db2.gz HRZKHVUTCYDVGQ-UHFFFAOYSA-N 1 1 294.351 3.818 20 5 CHBDMO CC[N@@H+](Cc1cccs1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595287758 1127458274 /nfs/dbraw/zinc/45/82/74/1127458274.db2.gz HRZKHVUTCYDVGQ-UHFFFAOYSA-N 1 1 294.351 3.818 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC3CC2(c2ccccc2)C3)cc1 ZINC000595911620 1127479943 /nfs/dbraw/zinc/47/99/43/1127479943.db2.gz QMFZLYPGWBEQMI-UHFFFAOYSA-N 1 1 294.354 3.716 20 5 CHBDMO Cc1ccc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)nc1 ZINC000603430692 1127649340 /nfs/dbraw/zinc/64/93/40/1127649340.db2.gz CHNGIOHKCPTFQQ-UHFFFAOYSA-N 1 1 299.374 3.711 20 5 CHBDMO CCC(F)(F)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000599069326 1127655427 /nfs/dbraw/zinc/65/54/27/1127655427.db2.gz VTVFAHXUFUILEH-LLVKDONJSA-N 1 1 286.322 3.551 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000603582124 1127660814 /nfs/dbraw/zinc/66/08/14/1127660814.db2.gz UMHVGIFGUIUMGN-TZMCWYRMSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000603836685 1127675112 /nfs/dbraw/zinc/67/51/12/1127675112.db2.gz AKYZTTMVYBCJAE-AWEZNQCLSA-N 1 1 262.353 3.668 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccc([N+](=O)[O-])s1 ZINC000604409326 1127703075 /nfs/dbraw/zinc/70/30/75/1127703075.db2.gz ZJPWOZSOIHNDSI-GFCCVEGCSA-N 1 1 297.424 3.723 20 5 CHBDMO CCC(CC)[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000604434793 1127705548 /nfs/dbraw/zinc/70/55/48/1127705548.db2.gz KDZFXPYYRARPGU-UHFFFAOYSA-N 1 1 262.353 3.748 20 5 CHBDMO CCc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])nc1 ZINC000411763581 1127872535 /nfs/dbraw/zinc/87/25/35/1127872535.db2.gz ZHWBOWIKNQHNDR-UHFFFAOYSA-N 1 1 299.374 3.577 20 5 CHBDMO CC(C)(C)C1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000535403597 1127915075 /nfs/dbraw/zinc/91/50/75/1127915075.db2.gz RVLGJNOURARFDH-UHFFFAOYSA-N 1 1 274.364 3.773 20 5 CHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539827558 1127944617 /nfs/dbraw/zinc/94/46/17/1127944617.db2.gz IKYAZRWARYTEQS-RISCZKNCSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000540055012 1127959108 /nfs/dbraw/zinc/95/91/08/1127959108.db2.gz AUJZCXUHJYUXAD-BXUZGUMPSA-N 1 1 262.353 3.666 20 5 CHBDMO CC[C@H]1C[C@@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000544612066 1127979191 /nfs/dbraw/zinc/97/91/91/1127979191.db2.gz XCLWUGLXMADCNQ-RISCZKNCSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@@]1(C)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000468136738 1127994704 /nfs/dbraw/zinc/99/47/04/1127994704.db2.gz AIXQRXXTNGOSSU-HNNXBMFYSA-N 1 1 262.353 3.525 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH+]2CCC(c3ccco3)CC2)cs1 ZINC000595619087 1128011650 /nfs/dbraw/zinc/01/16/50/1128011650.db2.gz ZUHNWQNFVIFYJS-UHFFFAOYSA-N 1 1 292.360 3.629 20 5 CHBDMO Cc1cccc([C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000541388674 1128019916 /nfs/dbraw/zinc/01/99/16/1128019916.db2.gz CMLJBHTZMKEULQ-KRWDZBQOSA-N 1 1 296.370 3.893 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)[C@H](C)C1 ZINC000470182431 1128064849 /nfs/dbraw/zinc/06/48/49/1128064849.db2.gz LFLQSCROYNBAGZ-SOVRZDNNSA-N 1 1 274.364 3.586 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC(C)C ZINC000470173287 1128065258 /nfs/dbraw/zinc/06/52/58/1128065258.db2.gz AJMIRXTWTXYPOL-JYRVWZFOSA-N 1 1 262.353 3.586 20 5 CHBDMO CC[C@@H]1CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000470182636 1128065412 /nfs/dbraw/zinc/06/54/12/1128065412.db2.gz MHPHNKSZKIWHQU-RNQWEJQRSA-N 1 1 274.364 3.730 20 5 CHBDMO CCOc1cc(C[N@H+]2[C@H](C)CC[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492603724 1128105997 /nfs/dbraw/zinc/10/59/97/1128105997.db2.gz CGQNTPDDSIPKTK-OCCSQVGLSA-N 1 1 292.379 3.756 20 5 CHBDMO C[N@H+](Cc1ccc(CF)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000777540069 1128118228 /nfs/dbraw/zinc/11/82/28/1128118228.db2.gz JTTYCVDCHYQHMR-UHFFFAOYSA-N 1 1 288.322 3.696 20 5 CHBDMO C[N@@H+](Cc1ccc(CF)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000777540069 1128118229 /nfs/dbraw/zinc/11/82/29/1128118229.db2.gz JTTYCVDCHYQHMR-UHFFFAOYSA-N 1 1 288.322 3.696 20 5 CHBDMO O=[N+]([O-])c1ccc(CNc2cccc3cc[nH+]cc32)cc1 ZINC000094966857 1128350744 /nfs/dbraw/zinc/35/07/44/1128350744.db2.gz TUTZZUROYVBKJF-UHFFFAOYSA-N 1 1 279.299 3.755 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCCc2ccccc2C1 ZINC000498921974 1128620846 /nfs/dbraw/zinc/62/08/46/1128620846.db2.gz AGLFAMCWLBMJRY-UHFFFAOYSA-N 1 1 282.343 3.543 20 5 CHBDMO CC(C)CC[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705287 1128722550 /nfs/dbraw/zinc/72/25/50/1128722550.db2.gz QYMJQAAFZUGABH-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000609766778 1128724749 /nfs/dbraw/zinc/72/47/49/1128724749.db2.gz PWDOEMJEMXGKRA-ZDUSSCGKSA-N 1 1 262.353 3.607 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609846136 1128728449 /nfs/dbraw/zinc/72/84/49/1128728449.db2.gz DTSJJXCUAUPRRI-XPKDYRNWSA-N 1 1 274.364 3.748 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000072630850 1117781444 /nfs/dbraw/zinc/78/14/44/1117781444.db2.gz ABDXCMVHHVKULL-RYUDHWBXSA-N 1 1 250.342 3.634 20 5 CHBDMO Cc1c(C[N@H+]2C[C@@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000610215381 1117882242 /nfs/dbraw/zinc/88/22/42/1117882242.db2.gz JQAJFDHREYJADX-STQMWFEESA-N 1 1 276.380 3.914 20 5 CHBDMO Cc1c(C[N@H+]2C[C@H](C)CCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000610215379 1117882761 /nfs/dbraw/zinc/88/27/61/1117882761.db2.gz JQAJFDHREYJADX-OLZOCXBDSA-N 1 1 276.380 3.914 20 5 CHBDMO CC1=C[C@H](C)C[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000430272078 1117974041 /nfs/dbraw/zinc/97/40/41/1117974041.db2.gz ZOBVCJGMLDAVPL-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@H](C)C[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000430272078 1117974044 /nfs/dbraw/zinc/97/40/44/1117974044.db2.gz ZOBVCJGMLDAVPL-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@H](C)C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000430280757 1117989679 /nfs/dbraw/zinc/98/96/79/1117989679.db2.gz YCORPJFFMDXTRF-WCQYABFASA-N 1 1 260.337 3.554 20 5 CHBDMO CC[N@@H+](CCc1ccccn1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000764313244 1118082704 /nfs/dbraw/zinc/08/27/04/1118082704.db2.gz FKDAWPGONQTTPG-CQSZACIVSA-N 1 1 299.374 3.615 20 5 CHBDMO CC1(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)CCC1 ZINC000340288976 1118132192 /nfs/dbraw/zinc/13/21/92/1118132192.db2.gz DSKFLMHHBJRIGA-UHFFFAOYSA-N 1 1 274.364 3.749 20 5 CHBDMO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccoc1 ZINC000765287535 1118142366 /nfs/dbraw/zinc/14/23/66/1118142366.db2.gz VBPVIUSZEOEWMR-VIFPVBQESA-N 1 1 280.711 3.692 20 5 CHBDMO C[C@@H](c1ccccc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536000683 1118271966 /nfs/dbraw/zinc/27/19/66/1118271966.db2.gz HVBYUIVZNXIOTC-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000253060989 1118288788 /nfs/dbraw/zinc/28/87/88/1118288788.db2.gz DPQGGDZLHAZHML-WDEREUQCSA-N 1 1 282.771 3.726 20 5 CHBDMO CCC[C@H](C)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000579458370 1118379544 /nfs/dbraw/zinc/37/95/44/1118379544.db2.gz FLQMKMZSNOGHIO-ZDUSSCGKSA-N 1 1 264.369 3.505 20 5 CHBDMO CC[C@@H]1CCCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000004612448 1118436980 /nfs/dbraw/zinc/43/69/80/1118436980.db2.gz POPOFVNWGIWNGF-SOIVGHGOSA-N 1 1 274.364 3.873 20 5 CHBDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394943965 1118563097 /nfs/dbraw/zinc/56/30/97/1118563097.db2.gz HNSFGQBOUVXDPS-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000394943965 1118563100 /nfs/dbraw/zinc/56/31/00/1118563100.db2.gz HNSFGQBOUVXDPS-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000038956078 1118611923 /nfs/dbraw/zinc/61/19/23/1118611923.db2.gz QHMZROXSBLJJOC-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO Cc1c(C[N@@H+](C)Cc2cccs2)cccc1[N+](=O)[O-] ZINC000051383021 1118989682 /nfs/dbraw/zinc/98/96/82/1118989682.db2.gz MDWZDRUIXNTUKY-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO C[C@@H](c1cccs1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051501841 1119031878 /nfs/dbraw/zinc/03/18/78/1119031878.db2.gz ANKAUJSOCBOZTF-JTQLQIEISA-N 1 1 294.351 3.988 20 5 CHBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051501841 1119031882 /nfs/dbraw/zinc/03/18/82/1119031882.db2.gz ANKAUJSOCBOZTF-JTQLQIEISA-N 1 1 294.351 3.988 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000051686149 1119084596 /nfs/dbraw/zinc/08/45/96/1119084596.db2.gz LXZRLEBZHDDOHK-NSHDSACASA-N 1 1 250.342 3.524 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2C2CC2)c(Cl)c1 ZINC000611780492 1119191608 /nfs/dbraw/zinc/19/16/08/1119191608.db2.gz IGYXWLLTRIMGDF-CQSZACIVSA-N 1 1 280.755 3.623 20 5 CHBDMO Cc1cc(N[C@@H]2C[N@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000536021136 1119357344 /nfs/dbraw/zinc/35/73/44/1119357344.db2.gz BBHQKJBIJVHULZ-MRXNPFEDSA-N 1 1 297.358 3.502 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000061779152 1119650529 /nfs/dbraw/zinc/65/05/29/1119650529.db2.gz BCMJXCNGFRWQAR-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000061779152 1119650530 /nfs/dbraw/zinc/65/05/30/1119650530.db2.gz BCMJXCNGFRWQAR-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO Cc1ncccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000179320594 1119710104 /nfs/dbraw/zinc/71/01/04/1119710104.db2.gz ZWJLCALLODQCDH-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO CC(C)(C)[C@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000612177725 1119744382 /nfs/dbraw/zinc/74/43/82/1119744382.db2.gz WOECVAQDCSOWES-NSHDSACASA-N 1 1 280.343 3.602 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]2CCCC[C@@H]12 ZINC000541111791 1120147556 /nfs/dbraw/zinc/14/75/56/1120147556.db2.gz SLLAIUKFRXSVJR-KCXAZCMYSA-N 1 1 274.364 3.605 20 5 CHBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000053428449 1120497439 /nfs/dbraw/zinc/49/74/39/1120497439.db2.gz CLWIUNZMVOCVIC-LLVKDONJSA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000053428465 1120497718 /nfs/dbraw/zinc/49/77/18/1120497718.db2.gz IYFGTEMPODXBFK-LLVKDONJSA-N 1 1 276.361 3.849 20 5 CHBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532293346 1120499247 /nfs/dbraw/zinc/49/92/47/1120499247.db2.gz UWIDGHRFABLGNF-SFHVURJKSA-N 1 1 296.370 3.758 20 5 CHBDMO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000092328215 1120541176 /nfs/dbraw/zinc/54/11/76/1120541176.db2.gz XTAQETAOWVSBRD-UWVGGRQHSA-N 1 1 289.335 3.611 20 5 CHBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000508991387 1120578128 /nfs/dbraw/zinc/57/81/28/1120578128.db2.gz NIDNFDAVSFHQML-SNVBAGLBSA-N 1 1 298.333 3.741 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(Cl)o1 ZINC000555341576 1120582388 /nfs/dbraw/zinc/58/23/88/1120582388.db2.gz HSWJOLPTMMNNES-UHFFFAOYSA-N 1 1 294.738 3.516 20 5 CHBDMO COc1ccc(C[N@@H+](C(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000108365474 1120748397 /nfs/dbraw/zinc/74/83/97/1120748397.db2.gz MLMMWPAMHKWXLG-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO C[N@@H+](CCNc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000109406860 1120779423 /nfs/dbraw/zinc/77/94/23/1120779423.db2.gz JDCKMJQYYUUDLL-UHFFFAOYSA-N 1 1 297.786 3.535 20 5 CHBDMO CC[N@H+](Cc1ccoc1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000075684219 1120807161 /nfs/dbraw/zinc/80/71/61/1120807161.db2.gz PKLVBZKCINYRRV-GFCCVEGCSA-N 1 1 274.320 3.771 20 5 CHBDMO CC[N@@H+](Cc1ccoc1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000075684219 1120807163 /nfs/dbraw/zinc/80/71/63/1120807163.db2.gz PKLVBZKCINYRRV-GFCCVEGCSA-N 1 1 274.320 3.771 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000511911043 1120844821 /nfs/dbraw/zinc/84/48/21/1120844821.db2.gz ODMHXBHJYORKLP-LBPRGKRZSA-N 1 1 286.331 3.697 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541999807 1121013094 /nfs/dbraw/zinc/01/30/94/1121013094.db2.gz ATYAABMWIOZASY-JTQLQIEISA-N 1 1 270.760 3.725 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C(C)(C)c1ccccc1 ZINC000585754594 1121030794 /nfs/dbraw/zinc/03/07/94/1121030794.db2.gz RMELDYPDKPEEJE-UHFFFAOYSA-N 1 1 284.359 3.962 20 5 CHBDMO CCCCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000059385020 1121062248 /nfs/dbraw/zinc/06/22/48/1121062248.db2.gz ZLBOUKKJPLZSJH-UHFFFAOYSA-N 1 1 264.369 3.995 20 5 CHBDMO Cc1cccc2c1C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000429583205 1121341326 /nfs/dbraw/zinc/34/13/26/1121341326.db2.gz ABWYLXPCQNRIFA-UHFFFAOYSA-N 1 1 296.370 3.504 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC2(CCC2)C[C@H]1C ZINC000432814561 1121379016 /nfs/dbraw/zinc/37/90/16/1121379016.db2.gz AUVUOYHLPDVQGE-CYBMUJFWSA-N 1 1 274.364 3.668 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)C(C)C ZINC000706418028 1121428895 /nfs/dbraw/zinc/42/88/95/1121428895.db2.gz DZPJOOZBOSXJKZ-NSHDSACASA-N 1 1 268.332 3.600 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)ccc1Cl ZINC000706759309 1121438698 /nfs/dbraw/zinc/43/86/98/1121438698.db2.gz MWDISCJPWXYTDA-AAEUAGOBSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3CCCC[C@@H]32)ccc1Cl ZINC000706759309 1121438701 /nfs/dbraw/zinc/43/87/01/1121438701.db2.gz MWDISCJPWXYTDA-AAEUAGOBSA-N 1 1 280.755 3.623 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CC(C)(C)OC(C)(C)C1 ZINC000408428000 1121457466 /nfs/dbraw/zinc/45/74/66/1121457466.db2.gz BATFAYUFYWKFDM-GFCCVEGCSA-N 1 1 292.379 3.545 20 5 CHBDMO Cn1c[nH+]c2cccc(Nc3ccc(/C=C/[N+](=O)[O-])cc3)c21 ZINC001175905645 1121495723 /nfs/dbraw/zinc/49/57/23/1121495723.db2.gz ATQLOADTBCLBGQ-MDZDMXLPSA-N 1 1 294.314 3.564 20 5 CHBDMO CC[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCCC1 ZINC000509278537 1121506415 /nfs/dbraw/zinc/50/64/15/1121506415.db2.gz YXYOHUKKNTYZFU-UHFFFAOYSA-N 1 1 284.306 3.638 20 5 CHBDMO CC[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCCC1 ZINC000509278537 1121506424 /nfs/dbraw/zinc/50/64/24/1121506424.db2.gz YXYOHUKKNTYZFU-UHFFFAOYSA-N 1 1 284.306 3.638 20 5 CHBDMO CC(C)C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C(C)C ZINC000509388878 1121565334 /nfs/dbraw/zinc/56/53/34/1121565334.db2.gz SINNEDCIQVTCQN-CLFYSBASSA-N 1 1 276.380 3.974 20 5 CHBDMO Cc1ccoc1C[N@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000429409177 1121567033 /nfs/dbraw/zinc/56/70/33/1121567033.db2.gz QYRZACOKYKCVKW-ZDUSSCGKSA-N 1 1 288.347 3.998 20 5 CHBDMO CC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000047264395 1121618308 /nfs/dbraw/zinc/61/83/08/1121618308.db2.gz LVCQBCDGZJCRDD-UHFFFAOYSA-N 1 1 276.361 3.678 20 5 CHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000047264395 1121618313 /nfs/dbraw/zinc/61/83/13/1121618313.db2.gz LVCQBCDGZJCRDD-UHFFFAOYSA-N 1 1 276.361 3.678 20 5 CHBDMO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1ccccc1[N+](=O)[O-] ZINC000619611486 1128999581 /nfs/dbraw/zinc/99/95/81/1128999581.db2.gz IXPAZOIGOPGELL-DOMZBBRYSA-N 1 1 297.358 3.718 20 5 CHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1CCc2ccccc21 ZINC000611549756 1121655574 /nfs/dbraw/zinc/65/55/74/1121655574.db2.gz RXGZPHFRTLZJGI-MRXNPFEDSA-N 1 1 296.370 3.757 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)o1 ZINC000182627437 1121815987 /nfs/dbraw/zinc/81/59/87/1121815987.db2.gz YCIUGFOQFYADAR-ZDUSSCGKSA-N 1 1 288.347 3.998 20 5 CHBDMO COC(C)(C)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000345724120 1121910976 /nfs/dbraw/zinc/91/09/76/1121910976.db2.gz OVAYSUSNUGZFEF-UHFFFAOYSA-N 1 1 294.395 3.620 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180261872 1121970200 /nfs/dbraw/zinc/97/02/00/1121970200.db2.gz CBWTYKFGXPJLBK-LLVKDONJSA-N 1 1 264.369 3.690 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@@H](C)C1 ZINC000501787996 1122007493 /nfs/dbraw/zinc/00/74/93/1122007493.db2.gz BWMXTCVJPCFJPS-AGIUHOORSA-N 1 1 262.353 3.634 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC(C3CCCC3)C2)c(Cl)c1 ZINC001182216860 1122123170 /nfs/dbraw/zinc/12/31/70/1122123170.db2.gz VEIKZFAIEYXDTG-UHFFFAOYSA-N 1 1 294.782 3.870 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000035013447 1122147822 /nfs/dbraw/zinc/14/78/22/1122147822.db2.gz CPUFAZCQJOZTNU-GFCCVEGCSA-N 1 1 274.320 3.655 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C2CC2)C2CCCCC2)c1 ZINC000047903720 1122167303 /nfs/dbraw/zinc/16/73/03/1122167303.db2.gz WAZUGSJVGWCJHJ-UHFFFAOYSA-N 1 1 274.364 3.892 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000505605132 1122434933 /nfs/dbraw/zinc/43/49/33/1122434933.db2.gz GDCZOMLDKNLAKD-DAXSKMNVSA-N 1 1 288.372 3.802 20 5 CHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505629602 1122443088 /nfs/dbraw/zinc/44/30/88/1122443088.db2.gz BGZQURSKWCLZKL-SMDDNHRTSA-N 1 1 280.343 3.744 20 5 CHBDMO CCC(CC)C[N@@H+](CC)Cc1csc([N+](=O)[O-])c1 ZINC000515781038 1122538693 /nfs/dbraw/zinc/53/86/93/1122538693.db2.gz JEBNDVICWQEJHM-UHFFFAOYSA-N 1 1 270.398 3.914 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)CCC[C@@H]1C ZINC001191070303 1122568353 /nfs/dbraw/zinc/56/83/53/1122568353.db2.gz KCQGVHJGDCZCOV-STQMWFEESA-N 1 1 292.379 3.614 20 5 CHBDMO CC(C)C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC001192198577 1122632083 /nfs/dbraw/zinc/63/20/83/1122632083.db2.gz LFDKOCBJIKHOHQ-CYBMUJFWSA-N 1 1 294.370 3.992 20 5 CHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1(C)CCCC1 ZINC000426496173 1122805849 /nfs/dbraw/zinc/80/58/49/1122805849.db2.gz JIHHUDNGXPKLMZ-VQHVLOKHSA-N 1 1 274.364 3.873 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](C3CCC3)C2)c(F)c1 ZINC001196253850 1122912822 /nfs/dbraw/zinc/91/28/22/1122912822.db2.gz HZFSBRDHRLEYQD-ZDUSSCGKSA-N 1 1 292.354 3.746 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC000507146699 1122929371 /nfs/dbraw/zinc/92/93/71/1122929371.db2.gz WZPOLTKWBTVEET-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000507166139 1122932816 /nfs/dbraw/zinc/93/28/16/1122932816.db2.gz CYEXJMQMZOSDSO-AWEZNQCLSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1ccccc1[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000507182057 1122935235 /nfs/dbraw/zinc/93/52/35/1122935235.db2.gz PCRCTOJLEZHZGU-MRXNPFEDSA-N 1 1 296.370 3.893 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)c1ccccc1[N+](=O)[O-] ZINC001197513965 1122958107 /nfs/dbraw/zinc/95/81/07/1122958107.db2.gz HEAZYQUQBYVUQR-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCC1CC1 ZINC000544940783 1123506653 /nfs/dbraw/zinc/50/66/53/1123506653.db2.gz UAPYKTQHRZWBPE-ALCCZGGFSA-N 1 1 274.364 3.730 20 5 CHBDMO C[C@H](c1cccs1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000121648996 1124111254 /nfs/dbraw/zinc/11/12/54/1124111254.db2.gz FEVBBOBANLQCBI-GFCCVEGCSA-N 1 1 290.388 3.892 20 5 CHBDMO Cc1cccc(C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872017530 1124657085 /nfs/dbraw/zinc/65/70/85/1124657085.db2.gz BGRAUWXDYQQKHN-GFCCVEGCSA-N 1 1 288.322 3.893 20 5 CHBDMO C[C@H]([NH2+]Cc1scnc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000878659398 1125170976 /nfs/dbraw/zinc/17/09/76/1125170976.db2.gz CSYJPHZYSKKCLC-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532326839 1125249113 /nfs/dbraw/zinc/24/91/13/1125249113.db2.gz LMIVVCIVXBYBJG-CYBMUJFWSA-N 1 1 262.353 3.607 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001168146849 1125263533 /nfs/dbraw/zinc/26/35/33/1125263533.db2.gz SUSDHCPLOGGVLN-AWEZNQCLSA-N 1 1 276.380 3.853 20 5 CHBDMO C[C@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774662 1129451631 /nfs/dbraw/zinc/45/16/31/1129451631.db2.gz NQHNAHCIITZFIK-FZMZJTMJSA-N 1 1 280.343 3.744 20 5 CHBDMO CC(C)[C@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303648516 1129550417 /nfs/dbraw/zinc/55/04/17/1129550417.db2.gz DDMZQFAAAGQWOE-MRXNPFEDSA-N 1 1 276.380 3.648 20 5 CHBDMO CC(C)(C)[N@@H+](Cc1ccccc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169005753 1129689435 /nfs/dbraw/zinc/68/94/35/1129689435.db2.gz CSMCRMXTEJMECB-HOTGVXAUSA-N 1 1 290.407 3.733 20 5 CHBDMO CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169039776 1129690758 /nfs/dbraw/zinc/69/07/58/1129690758.db2.gz TWABAGUDJOHTAM-DZGCQCFKSA-N 1 1 296.798 3.607 20 5 CHBDMO CC[N@@H+](Cc1cccc(Cl)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169042786 1129690828 /nfs/dbraw/zinc/69/08/28/1129690828.db2.gz FSCBNWDRFPANNW-HIFRSBDPSA-N 1 1 296.798 3.607 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)c(C)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169050089 1129691792 /nfs/dbraw/zinc/69/17/92/1129691792.db2.gz YLRCWSAUWKJNFP-IRXDYDNUSA-N 1 1 290.407 3.571 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C2CC2)C2CCCC2)cc1F ZINC000801516323 1129923484 /nfs/dbraw/zinc/92/34/84/1129923484.db2.gz BXSMHYAQXOHAJZ-UHFFFAOYSA-N 1 1 278.327 3.641 20 5 CHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801517200 1129923804 /nfs/dbraw/zinc/92/38/04/1129923804.db2.gz BHFVYVKSCQFPDI-VXGBXAGGSA-N 1 1 280.343 3.744 20 5 CHBDMO C[N@@H+](CCSC(C)(C)C)CCc1cccc([N+](=O)[O-])c1 ZINC000801955400 1129963495 /nfs/dbraw/zinc/96/34/95/1129963495.db2.gz SCWVATXSNDNHMK-UHFFFAOYSA-N 1 1 296.436 3.601 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@H]1C1CC1 ZINC000746667098 1130144048 /nfs/dbraw/zinc/14/40/48/1130144048.db2.gz VOJOANQTTLLEFU-ZDUSSCGKSA-N 1 1 280.755 3.623 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)O[NH+]=C(N)CC(C)C ZINC000789591097 1130262460 /nfs/dbraw/zinc/26/24/60/1130262460.db2.gz YZCKNWTYFKWRTL-NSHDSACASA-N 1 1 279.340 3.509 20 5 CHBDMO CCCC[N@@H+](CC)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329556 1130483315 /nfs/dbraw/zinc/48/33/15/1130483315.db2.gz RIQSEGHULUTKSJ-CYBMUJFWSA-N 1 1 294.395 3.656 20 5 CHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC1CC1 ZINC000783533287 1130834911 /nfs/dbraw/zinc/83/49/11/1130834911.db2.gz WRBBMIWRKSFKHD-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@H]1[C@@H](C)CC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678026 1130846459 /nfs/dbraw/zinc/84/64/59/1130846459.db2.gz BCZSWMOMLCIVPU-GWCFXTLKSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000217235698 1130923124 /nfs/dbraw/zinc/92/31/24/1130923124.db2.gz RKFZUTYUIVUFST-JMSVASOKSA-N 1 1 292.354 3.887 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799193236 1131075225 /nfs/dbraw/zinc/07/52/25/1131075225.db2.gz MFESSYTUKCUMPJ-KBPBESRZSA-N 1 1 297.358 3.540 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCC1CCCCC1)C2 ZINC001116753662 1131162093 /nfs/dbraw/zinc/16/20/93/1131162093.db2.gz QYJIVSVODHFTEF-UHFFFAOYSA-N 1 1 274.364 3.881 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCC1CCCCC1)C2 ZINC001116753662 1131162097 /nfs/dbraw/zinc/16/20/97/1131162097.db2.gz QYJIVSVODHFTEF-UHFFFAOYSA-N 1 1 274.364 3.881 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437066 1131563445 /nfs/dbraw/zinc/56/34/45/1131563445.db2.gz SCJROEOKMWIUEV-FZMZJTMJSA-N 1 1 296.317 3.777 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](C2CCCC2)C1 ZINC001171331664 1131853674 /nfs/dbraw/zinc/85/36/74/1131853674.db2.gz KIHFFURCNOWPDL-CQSZACIVSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccns1 ZINC000716013713 1132008401 /nfs/dbraw/zinc/00/84/01/1132008401.db2.gz HHFGJRBSNGZMMW-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccns1 ZINC000716012435 1132008919 /nfs/dbraw/zinc/00/89/19/1132008919.db2.gz APEBUOHLNIGBEP-QMMMGPOBSA-N 1 1 297.767 3.556 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914557 1132359751 /nfs/dbraw/zinc/35/97/51/1132359751.db2.gz HSOCFMNMDUJHPA-CVEARBPZSA-N 1 1 288.391 3.717 20 5 CHBDMO CC[C@H]1CCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914562 1132360125 /nfs/dbraw/zinc/36/01/25/1132360125.db2.gz HSOCFMNMDUJHPA-JKSUJKDBSA-N 1 1 288.391 3.717 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC12CCCC2 ZINC001173220739 1132411920 /nfs/dbraw/zinc/41/19/20/1132411920.db2.gz CCLGFAIKYOAVQY-ZDUSSCGKSA-N 1 1 274.364 3.544 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)[C@H](C)C1 ZINC001173230495 1132413771 /nfs/dbraw/zinc/41/37/71/1132413771.db2.gz YJKMVHSBWKVOHC-RBSFLKMASA-N 1 1 290.407 3.894 20 5 CHBDMO CSCC[N@@H+](C)Cc1ccc2ccc3cccnc3c2n1 ZINC001232229008 1132439268 /nfs/dbraw/zinc/43/92/68/1132439268.db2.gz XBPIACGAPYEIPL-UHFFFAOYSA-N 1 1 297.427 3.578 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](C2CCC2)C1 ZINC001174705307 1132960267 /nfs/dbraw/zinc/96/02/67/1132960267.db2.gz UFXRJWYAHLKHSB-CQSZACIVSA-N 1 1 274.364 3.607 20 5 CHBDMO CSC(C)(C)CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC001205755825 1133608787 /nfs/dbraw/zinc/60/87/87/1133608787.db2.gz OCXLYEZRPCPNDX-UHFFFAOYSA-N 1 1 296.436 3.601 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000035738533 172391588 /nfs/dbraw/zinc/39/15/88/172391588.db2.gz APUAQAUABKFODD-QWRGUYRKSA-N 1 1 260.293 3.600 20 5 CHBDMO CSC1(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)CC1 ZINC000347615737 226202726 /nfs/dbraw/zinc/20/27/26/226202726.db2.gz QWGBLTVSZYYENW-UHFFFAOYSA-N 1 1 294.420 3.701 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000080266570 260179229 /nfs/dbraw/zinc/17/92/29/260179229.db2.gz LVOGURVSNGLRHA-MNOVXSKESA-N 1 1 291.376 3.772 20 5 CHBDMO C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000301984758 261345119 /nfs/dbraw/zinc/34/51/19/261345119.db2.gz CEOBQYQQYWOYDH-CQSZACIVSA-N 1 1 299.374 3.527 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(F)cc(F)c1 ZINC000094827370 265260614 /nfs/dbraw/zinc/26/06/14/265260614.db2.gz KHOHVESZZSCDOP-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC12CCC2 ZINC000357022466 266233629 /nfs/dbraw/zinc/23/36/29/266233629.db2.gz JUVWEABDGAAESX-CYBMUJFWSA-N 1 1 274.364 3.607 20 5 CHBDMO CCC(CC)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000571228728 328093907 /nfs/dbraw/zinc/09/39/07/328093907.db2.gz PTHGABKUYQGUFH-UHFFFAOYSA-N 1 1 264.369 3.505 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+](CCC(F)(F)F)C2CC2)c1 ZINC000269091046 328189541 /nfs/dbraw/zinc/18/95/41/328189541.db2.gz LAXATAMQZPDPPS-UHFFFAOYSA-N 1 1 288.269 3.512 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCC(F)(F)F)C2CC2)c1 ZINC000269091046 328189542 /nfs/dbraw/zinc/18/95/42/328189542.db2.gz LAXATAMQZPDPPS-UHFFFAOYSA-N 1 1 288.269 3.512 20 5 CHBDMO CC[N@@H+](CCC1CC1)Cc1cccc([N+](=O)[O-])c1C ZINC000546225123 328232465 /nfs/dbraw/zinc/23/24/65/328232465.db2.gz ACACLCVVHOVUCF-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[N@H+](C/C=C\c1ccccc1)C2 ZINC000534511748 328305062 /nfs/dbraw/zinc/30/50/62/328305062.db2.gz KMDIQVROMDTSJS-YVMONPNESA-N 1 1 294.354 3.666 20 5 CHBDMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C/C=C\c1ccccc1)C2 ZINC000534511748 328305063 /nfs/dbraw/zinc/30/50/63/328305063.db2.gz KMDIQVROMDTSJS-YVMONPNESA-N 1 1 294.354 3.666 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCCC12CCCCC2 ZINC000534666773 328345304 /nfs/dbraw/zinc/34/53/04/328345304.db2.gz VFQWMDDTGLLARV-UHFFFAOYSA-N 1 1 274.364 3.894 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CC2CCCC2)C2CC2)c1 ZINC000532021488 328393192 /nfs/dbraw/zinc/39/31/92/328393192.db2.gz LVYOSHGKLKKHPF-UHFFFAOYSA-N 1 1 274.364 3.749 20 5 CHBDMO C[C@]1(c2ccccc2)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532038689 328396976 /nfs/dbraw/zinc/39/69/76/328396976.db2.gz XUCGICOLXWAWFJ-SFHVURJKSA-N 1 1 296.370 3.758 20 5 CHBDMO C[N@H+](C/C=C/c1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000558737088 327118514 /nfs/dbraw/zinc/11/85/14/327118514.db2.gz WZHJJZJUCZQUJC-UXBLZVDNSA-N 1 1 296.370 3.783 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000533821139 327203539 /nfs/dbraw/zinc/20/35/39/327203539.db2.gz XLCHQPJRQYIOMJ-KRWDZBQOSA-N 1 1 297.358 3.502 20 5 CHBDMO Cn1cccc1[C@@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000175139799 329163374 /nfs/dbraw/zinc/16/33/74/329163374.db2.gz LSJMLBNGCIBNKJ-KRWDZBQOSA-N 1 1 299.374 3.661 20 5 CHBDMO Cn1cccc1[C@@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000175139799 329163376 /nfs/dbraw/zinc/16/33/76/329163376.db2.gz LSJMLBNGCIBNKJ-KRWDZBQOSA-N 1 1 299.374 3.661 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000182061439 329239183 /nfs/dbraw/zinc/23/91/83/329239183.db2.gz UXDAXIFTBXUWQL-UHFFFAOYSA-N 1 1 268.744 3.621 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)C1CC1 ZINC000582921343 329288890 /nfs/dbraw/zinc/28/88/90/329288890.db2.gz XQKHGBKWGZUHMT-LBPRGKRZSA-N 1 1 292.379 3.612 20 5 CHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000396778910 330225938 /nfs/dbraw/zinc/22/59/38/330225938.db2.gz LIYFWUQQOVMKOZ-CYBMUJFWSA-N 1 1 280.343 3.744 20 5 CHBDMO CC(C)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000445436430 330342609 /nfs/dbraw/zinc/34/26/09/330342609.db2.gz RBVJCHYPCCCBOQ-STQMWFEESA-N 1 1 262.353 3.634 20 5 CHBDMO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000107929179 330351355 /nfs/dbraw/zinc/35/13/55/330351355.db2.gz RFKIICJROFBICU-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1cccc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000046598967 330354652 /nfs/dbraw/zinc/35/46/52/330354652.db2.gz XXMGBOJWQSILTL-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000046598967 330354653 /nfs/dbraw/zinc/35/46/53/330354653.db2.gz XXMGBOJWQSILTL-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO COc1cc(C[N@@H+](C)C2(C)CCCC2)c([N+](=O)[O-])cc1F ZINC000489854136 332070399 /nfs/dbraw/zinc/07/03/99/332070399.db2.gz UJCWNGAFXMXZAH-UHFFFAOYSA-N 1 1 296.342 3.507 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C2CC2)[C@@H]2C=CCCC2)c1 ZINC000490043758 332078161 /nfs/dbraw/zinc/07/81/61/332078161.db2.gz KLFMSKVIIDZERL-CQSZACIVSA-N 1 1 272.348 3.668 20 5 CHBDMO Cc1c(C[N@H+](C)C2(C)CCCC2)cccc1[N+](=O)[O-] ZINC000490161830 332083170 /nfs/dbraw/zinc/08/31/70/332083170.db2.gz BHXYEFVWGXPTJM-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000182842686 333117858 /nfs/dbraw/zinc/11/78/58/333117858.db2.gz LCKGTBWBHRWFFD-MCIONIFRSA-N 1 1 274.364 3.696 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC2(CCC2)C1 ZINC000182844548 333117885 /nfs/dbraw/zinc/11/78/85/333117885.db2.gz JEJPFOFTWSCUMT-CYBMUJFWSA-N 1 1 274.364 3.840 20 5 CHBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000523438806 333326773 /nfs/dbraw/zinc/32/67/73/333326773.db2.gz REWABNYJPKOJIG-OAHLLOKOSA-N 1 1 298.386 3.966 20 5 CHBDMO CCC[C@H]([NH2+]Cc1cnc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000397901193 333430419 /nfs/dbraw/zinc/43/04/19/333430419.db2.gz SMLTUWPMOSSLLQ-HNNXBMFYSA-N 1 1 289.335 3.522 20 5 CHBDMO CS[C@H]1CCCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000134596622 334096478 /nfs/dbraw/zinc/09/64/78/334096478.db2.gz LUTILWQSUCVTOI-WFASDCNBSA-N 1 1 294.420 3.873 20 5 CHBDMO Cc1cnc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000134910286 334108180 /nfs/dbraw/zinc/10/81/80/334108180.db2.gz HWMKHCPGNVJAAM-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000550079270 334212459 /nfs/dbraw/zinc/21/24/59/334212459.db2.gz LFTFTJIESUGHNM-ZFWWWQNUSA-N 1 1 274.364 3.605 20 5 CHBDMO Cc1nsc(C)c1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000566415379 334647006 /nfs/dbraw/zinc/64/70/06/334647006.db2.gz DAFSZDWUOIJPPZ-SECBINFHSA-N 1 1 291.376 3.519 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000577418798 335351148 /nfs/dbraw/zinc/35/11/48/335351148.db2.gz KBJRFNVGSGDOLW-UHFFFAOYSA-N 1 1 298.358 3.753 20 5 CHBDMO CC(C)([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1F ZINC000291704661 519324492 /nfs/dbraw/zinc/32/44/92/519324492.db2.gz KNCDRQWHBWQVCF-UHFFFAOYSA-N 1 1 294.351 3.820 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](C)c1cccnc1 ZINC000290535795 521305120 /nfs/dbraw/zinc/30/51/20/521305120.db2.gz QWUDSMCHOUCRLM-AWEZNQCLSA-N 1 1 299.374 3.881 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1cccc(O)c1 ZINC000037151292 525662108 /nfs/dbraw/zinc/66/21/08/525662108.db2.gz RSZZHWDHBLQZLS-VXGBXAGGSA-N 1 1 286.331 3.712 20 5 CHBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774590 526145532 /nfs/dbraw/zinc/14/55/32/526145532.db2.gz WAJMFFJFRLVPRL-JTQLQIEISA-N 1 1 294.351 3.988 20 5 CHBDMO O=[N+]([O-])c1ccc(CNc2cc(C3CC3)cc[nH+]2)c(F)c1 ZINC000353159543 527353217 /nfs/dbraw/zinc/35/32/17/527353217.db2.gz ZGEJTOSESRCEIS-UHFFFAOYSA-N 1 1 287.294 3.618 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)C1(C)CC1 ZINC000355083162 528612052 /nfs/dbraw/zinc/61/20/52/528612052.db2.gz SIMBJVBMMBLFNT-LBPRGKRZSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000533504895 1125611471 /nfs/dbraw/zinc/61/14/71/1125611471.db2.gz IVRHKXSQFOXBAE-GFCCVEGCSA-N 1 1 280.368 3.612 20 5 CHBDMO CC(C)(C)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000159440064 1126741329 /nfs/dbraw/zinc/74/13/29/1126741329.db2.gz ZUFCEQUHIKADQX-GFCCVEGCSA-N 1 1 280.343 3.602 20 5 CHBDMO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc([N+](=O)[O-])cc2)n1 ZINC000159723422 1126751342 /nfs/dbraw/zinc/75/13/42/1126751342.db2.gz PGVCRDFOLJPGKR-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO C[C@@H]1CCCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000482314780 1126751481 /nfs/dbraw/zinc/75/14/81/1126751481.db2.gz WIIWIRSVNUCTJB-VIIAAUOXSA-N 1 1 274.364 3.730 20 5 CHBDMO CCCCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000483953789 1126806048 /nfs/dbraw/zinc/80/60/48/1126806048.db2.gz JJPYDJLWOXTMCT-UHFFFAOYSA-N 1 1 262.353 3.749 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2c2ccccc2)c1 ZINC000054669779 1127086099 /nfs/dbraw/zinc/08/60/99/1127086099.db2.gz ZCVOVGXPQOBCSQ-QGZVFWFLSA-N 1 1 282.343 3.932 20 5 CHBDMO C[C@@H](Nc1ccc2c(c1)[nH+]cn2C)c1ccc([N+](=O)[O-])cc1 ZINC000348806163 1127128432 /nfs/dbraw/zinc/12/84/32/1127128432.db2.gz SMEMPFVEOYGORW-LLVKDONJSA-N 1 1 296.330 3.655 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000029482274 1127124109 /nfs/dbraw/zinc/12/41/09/1127124109.db2.gz DGLKHFKSEQXVOB-QGZVFWFLSA-N 1 1 282.343 3.714 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cccs1 ZINC000349837091 1127165078 /nfs/dbraw/zinc/16/50/78/1127165078.db2.gz UIHCHTCVEQMHSW-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO CC(C)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000045751752 1127293119 /nfs/dbraw/zinc/29/31/19/1127293119.db2.gz OBLNIZOUPPRPQO-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C[C@H](C)C1 ZINC000355108026 1127317425 /nfs/dbraw/zinc/31/74/25/1127317425.db2.gz KBYJZIVHXZCVIQ-WDEREUQCSA-N 1 1 268.382 3.524 20 5 CHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1 ZINC000359293517 1127456858 /nfs/dbraw/zinc/45/68/58/1127456858.db2.gz FPFTUFGXWWVTIJ-XJKSGUPXSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@H](c1cccs1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595292833 1127457670 /nfs/dbraw/zinc/45/76/70/1127457670.db2.gz BNMUTCRABREBSI-SNVBAGLBSA-N 1 1 294.351 3.988 20 5 CHBDMO C[C@H](c1cccs1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595292833 1127457671 /nfs/dbraw/zinc/45/76/71/1127457671.db2.gz BNMUTCRABREBSI-SNVBAGLBSA-N 1 1 294.351 3.988 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595566805 1127465620 /nfs/dbraw/zinc/46/56/20/1127465620.db2.gz NXIZQZDLEMLLPS-GWCFXTLKSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595566805 1127465622 /nfs/dbraw/zinc/46/56/22/1127465622.db2.gz NXIZQZDLEMLLPS-GWCFXTLKSA-N 1 1 280.755 3.623 20 5 CHBDMO Cc1ccncc1C[N@H+](C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000361434022 1127563312 /nfs/dbraw/zinc/56/33/12/1127563312.db2.gz KKHJNCFRIKMZFT-CQSZACIVSA-N 1 1 299.374 3.800 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CC1CCCCC1 ZINC000603491034 1127652988 /nfs/dbraw/zinc/65/29/88/1127652988.db2.gz XGTBDVQHNLBJCW-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO CC[N@@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000603852337 1127676707 /nfs/dbraw/zinc/67/67/07/1127676707.db2.gz UEHUXHWSBPQQDL-UHFFFAOYSA-N 1 1 284.359 3.659 20 5 CHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000603873872 1127679546 /nfs/dbraw/zinc/67/95/46/1127679546.db2.gz JAXMJRSVWSNIIP-CZUORRHYSA-N 1 1 276.380 3.648 20 5 CHBDMO CC(C)[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000172175038 1127748544 /nfs/dbraw/zinc/74/85/44/1127748544.db2.gz RMKFETJXTFIMRN-UHFFFAOYSA-N 1 1 268.744 3.621 20 5 CHBDMO CC(C)[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CC1 ZINC000172175038 1127748548 /nfs/dbraw/zinc/74/85/48/1127748548.db2.gz RMKFETJXTFIMRN-UHFFFAOYSA-N 1 1 268.744 3.621 20 5 CHBDMO Cc1ccc(C[N@@H+]2C[C@H](C)CC2(C)C)cc1[N+](=O)[O-] ZINC000539828082 1127945671 /nfs/dbraw/zinc/94/56/71/1127945671.db2.gz GIIBXRHRXIBZPT-LLVKDONJSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H]1CC=CCC1 ZINC000544116847 1127958970 /nfs/dbraw/zinc/95/89/70/1127958970.db2.gz KKGCFDFTKBKRJQ-KGLIPLIRSA-N 1 1 274.364 3.944 20 5 CHBDMO CC[C@@]1(C)CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468138130 1127994788 /nfs/dbraw/zinc/99/47/88/1127994788.db2.gz KHUBSAJGCZYWAD-DOMZBBRYSA-N 1 1 262.353 3.778 20 5 CHBDMO CCC(CC)[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)C1CC1 ZINC000540910831 1128000737 /nfs/dbraw/zinc/00/07/37/1128000737.db2.gz BNYABPSZMAGOGZ-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO CCCC[N@@H+](C)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470176658 1128063647 /nfs/dbraw/zinc/06/36/47/1128063647.db2.gz XUOGSYODSJADPD-JLHYYAGUSA-N 1 1 262.353 3.730 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)C[C@@H]1C ZINC000470178875 1128065248 /nfs/dbraw/zinc/06/52/48/1128065248.db2.gz PDVKLXBYYFDULY-SUHDFKPZSA-N 1 1 274.364 3.728 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@H](C)C[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492629933 1128106261 /nfs/dbraw/zinc/10/62/61/1128106261.db2.gz KZSJRYOLCYNSFO-TZMCWYRMSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@H+]2CCCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000492819598 1128113558 /nfs/dbraw/zinc/11/35/58/1128113558.db2.gz SUCSYSFSGVQXCY-ZDUSSCGKSA-N 1 1 292.379 3.616 20 5 CHBDMO CCCC[N@@H+](CC)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761509956 1128132358 /nfs/dbraw/zinc/13/23/58/1128132358.db2.gz DSFDEDWNSCDNFP-UHFFFAOYSA-N 1 1 270.760 3.870 20 5 CHBDMO CC(C)[C@@H]1CCC[N@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493333131 1128138344 /nfs/dbraw/zinc/13/83/44/1128138344.db2.gz FDFYXFKACJATAB-ZDUSSCGKSA-N 1 1 282.771 3.869 20 5 CHBDMO CC(C)[N@H+](Cc1csc([N+](=O)[O-])c1)CC1CCC1 ZINC000193209146 1128242762 /nfs/dbraw/zinc/24/27/62/1128242762.db2.gz ZPVHPDGLEFGBGU-UHFFFAOYSA-N 1 1 268.382 3.667 20 5 CHBDMO CC(F)(F)CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000930060235 1128298794 /nfs/dbraw/zinc/29/87/94/1128298794.db2.gz IABFXZJNZSWEGP-UHFFFAOYSA-N 1 1 298.333 3.995 20 5 CHBDMO CC[N@@H+](Cc1ccncc1)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000272507327 1128350173 /nfs/dbraw/zinc/35/01/73/1128350173.db2.gz OJLISWCLDGJXFC-AWEZNQCLSA-N 1 1 299.374 3.881 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-])C(C)(C)C ZINC000917099011 1128479205 /nfs/dbraw/zinc/47/92/05/1128479205.db2.gz ZYXGRPFQRXPGRB-SNVBAGLBSA-N 1 1 268.332 3.600 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000556958666 1128651933 /nfs/dbraw/zinc/65/19/33/1128651933.db2.gz JZJFWKVQMFEKTO-UJAVWCLSSA-N 1 1 286.375 3.730 20 5 CHBDMO CC1(C)C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@H]2CCC[C@@H]21 ZINC000557055459 1128664377 /nfs/dbraw/zinc/66/43/77/1128664377.db2.gz NEUDQBYXNCUSSX-RYUDHWBXSA-N 1 1 280.393 3.667 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](C)CCC[C@H]1C ZINC000610215384 1117882224 /nfs/dbraw/zinc/88/22/24/1117882224.db2.gz KQEVFCWLXABPRH-CHWSQXEVSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1cc(NC[C@H](C)[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000510095999 1117882366 /nfs/dbraw/zinc/88/23/66/1117882366.db2.gz VQUJWRPEDIFWKW-KBPBESRZSA-N 1 1 291.395 3.578 20 5 CHBDMO Cc1c(C[N@@H+]2Cc3ccccc3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000610216315 1117883798 /nfs/dbraw/zinc/88/37/98/1117883798.db2.gz LJMFGEIPDJZBLL-ZDUSSCGKSA-N 1 1 296.370 3.850 20 5 CHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001307686304 1117928656 /nfs/dbraw/zinc/92/86/56/1117928656.db2.gz SPJRODKFXSNRBZ-ZUZCIYMTSA-N 1 1 298.333 3.884 20 5 CHBDMO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CO2 ZINC000130747423 1118194842 /nfs/dbraw/zinc/19/48/42/1118194842.db2.gz QENKVXICCJCTAM-LRDDRELGSA-N 1 1 298.342 3.688 20 5 CHBDMO CC(C)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)C ZINC000083168427 1118243185 /nfs/dbraw/zinc/24/31/85/1118243185.db2.gz NNLSIHRALJNHMY-UHFFFAOYSA-N 1 1 291.351 3.602 20 5 CHBDMO CC[N@@H+](CCc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000058506541 1118289802 /nfs/dbraw/zinc/28/98/02/1118289802.db2.gz ZTMGFYARAKXIOJ-UHFFFAOYSA-N 1 1 284.359 3.659 20 5 CHBDMO O[C@@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000179950748 1128768567 /nfs/dbraw/zinc/76/85/67/1128768567.db2.gz OTBAFWFIUQXIGJ-MRXNPFEDSA-N 1 1 277.367 3.560 20 5 CHBDMO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC1CC1 ZINC000051281346 1118727236 /nfs/dbraw/zinc/72/72/36/1118727236.db2.gz NUTQGBMEEBOEHM-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000065533558 1118964882 /nfs/dbraw/zinc/96/48/82/1118964882.db2.gz CYHWURBHFKVNDL-UHFFFAOYSA-N 1 1 292.379 3.628 20 5 CHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000071951766 1118978050 /nfs/dbraw/zinc/97/80/50/1118978050.db2.gz JWKHAXNWBUZZEV-AWEZNQCLSA-N 1 1 284.359 3.830 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccccc2)C2CC2)cc1 ZINC000071969019 1118987988 /nfs/dbraw/zinc/98/79/88/1118987988.db2.gz RMXIBQUJIDTDSF-UHFFFAOYSA-N 1 1 296.370 3.802 20 5 CHBDMO C[C@@H](c1ccccc1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511062925 1118996388 /nfs/dbraw/zinc/99/63/88/1118996388.db2.gz FSMDNCDQMHKILI-AWEZNQCLSA-N 1 1 284.359 3.830 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479577611 1119124742 /nfs/dbraw/zinc/12/47/42/1119124742.db2.gz JFUHQOMBNNBILO-LBPRGKRZSA-N 1 1 262.353 3.604 20 5 CHBDMO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1CC1 ZINC000122912978 1120049735 /nfs/dbraw/zinc/04/97/35/1120049735.db2.gz LBYWUCLWTOGLBP-UHFFFAOYSA-N 1 1 286.331 3.697 20 5 CHBDMO CC(C)[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCC1 ZINC000255625845 1120388055 /nfs/dbraw/zinc/38/80/55/1120388055.db2.gz SWLWBPKGRGHPDW-VURMDHGXSA-N 1 1 274.364 3.871 20 5 CHBDMO C[N@@H+](CCCNc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000037859949 1120497565 /nfs/dbraw/zinc/49/75/65/1120497565.db2.gz DBGANYYVRITWDE-UHFFFAOYSA-N 1 1 291.395 3.661 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000091900463 1120535979 /nfs/dbraw/zinc/53/59/79/1120535979.db2.gz FGRJEUNFBZTVSL-GFCCVEGCSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@H](C1CC1)[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000092009426 1120537842 /nfs/dbraw/zinc/53/78/42/1120537842.db2.gz PCIALLMDNUDLTL-DIECRNLCSA-N 1 1 286.375 3.871 20 5 CHBDMO CCC[C@@H](C)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000555339629 1120583290 /nfs/dbraw/zinc/58/32/90/1120583290.db2.gz DAEDSPRLQKFMLU-CYBMUJFWSA-N 1 1 264.369 3.505 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000348540626 1120630929 /nfs/dbraw/zinc/63/09/29/1120630929.db2.gz ZXCWCIHUYRGPKS-MRXNPFEDSA-N 1 1 268.316 3.542 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000348540626 1120630932 /nfs/dbraw/zinc/63/09/32/1120630932.db2.gz ZXCWCIHUYRGPKS-MRXNPFEDSA-N 1 1 268.316 3.542 20 5 CHBDMO C[C@H](c1ccncc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350357665 1120650753 /nfs/dbraw/zinc/65/07/53/1120650753.db2.gz OZYXHTYTCBKHLD-BRLPQQTGSA-N 1 1 297.358 3.696 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC000511855393 1120665612 /nfs/dbraw/zinc/66/56/12/1120665612.db2.gz OAPZQBQDEIWROY-PCKHISNJSA-N 1 1 286.375 3.873 20 5 CHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1OC ZINC001174781596 1121028611 /nfs/dbraw/zinc/02/86/11/1121028611.db2.gz WPIZVLJSFZGEFJ-GXTWGEPZSA-N 1 1 292.379 3.756 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC2(CCC2)C1 ZINC000344210032 1121120537 /nfs/dbraw/zinc/12/05/37/1121120537.db2.gz CTUFJQZFWAGXOG-LBPRGKRZSA-N 1 1 260.337 3.532 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCc2occc2C1 ZINC000344232385 1121126058 /nfs/dbraw/zinc/12/60/58/1121126058.db2.gz GVRUNLIBYJHVHY-GFCCVEGCSA-N 1 1 286.331 3.697 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCc2occc2C1 ZINC000344232385 1121126062 /nfs/dbraw/zinc/12/60/62/1121126062.db2.gz GVRUNLIBYJHVHY-GFCCVEGCSA-N 1 1 286.331 3.697 20 5 CHBDMO C[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000512178392 1121141894 /nfs/dbraw/zinc/14/18/94/1121141894.db2.gz ILQNTWSNVKUJGR-GPAKFWEMSA-N 1 1 274.364 3.730 20 5 CHBDMO C/C=C\C[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001175043991 1121157306 /nfs/dbraw/zinc/15/73/06/1121157306.db2.gz AYAJJOMMZZCGOK-YPQKKHBXSA-N 1 1 288.391 3.816 20 5 CHBDMO CC(C)C[C@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000500501390 1121289077 /nfs/dbraw/zinc/28/90/77/1121289077.db2.gz MCVMNUGCPVMWGQ-MRXNPFEDSA-N 1 1 276.380 3.648 20 5 CHBDMO Cc1ccccc1C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000042977112 1121319516 /nfs/dbraw/zinc/31/95/16/1121319516.db2.gz FHHMGNGQTNRPCC-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@H]2C2CC2)c1 ZINC000706881205 1121443416 /nfs/dbraw/zinc/44/34/16/1121443416.db2.gz BHAJKDVPGGBIFU-AWEZNQCLSA-N 1 1 280.755 3.623 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2C2CCC2)cc1[N+](=O)[O-] ZINC000512622155 1121496110 /nfs/dbraw/zinc/49/61/10/1121496110.db2.gz JRJCEUDGROMYBL-HNNXBMFYSA-N 1 1 274.364 3.668 20 5 CHBDMO C[C@@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@@H]1C ZINC000512647835 1121506220 /nfs/dbraw/zinc/50/62/20/1121506220.db2.gz HTGBOAZWEOWWIW-VAIDBEGPSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1ccc(C)c(C[N@H+](C)Cc2csc([N+](=O)[O-])c2)c1 ZINC000429289891 1121511394 /nfs/dbraw/zinc/51/13/94/1121511394.db2.gz FHJXUHZRUOBZMV-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO Cc1ccc(C)c(C[N@@H+](C)Cc2csc([N+](=O)[O-])c2)c1 ZINC000429289891 1121511403 /nfs/dbraw/zinc/51/14/03/1121511403.db2.gz FHJXUHZRUOBZMV-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543632630 1121539303 /nfs/dbraw/zinc/53/93/03/1121539303.db2.gz VQJNKWRJWXBSNK-GFCCVEGCSA-N 1 1 250.342 3.524 20 5 CHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccsc1 ZINC000619782549 1129013744 /nfs/dbraw/zinc/01/37/44/1129013744.db2.gz CIDJVNXABSWENC-VIFPVBQESA-N 1 1 280.324 3.646 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)CC1CCCC1 ZINC001179989552 1121935351 /nfs/dbraw/zinc/93/53/51/1121935351.db2.gz QYSMFUXZRGCUKT-UHFFFAOYSA-N 1 1 276.380 3.834 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCSC(C)(C)CC1 ZINC000434683733 1122395503 /nfs/dbraw/zinc/39/55/03/1122395503.db2.gz FOJRIOSABQBCEF-LBPRGKRZSA-N 1 1 294.420 3.873 20 5 CHBDMO CC(C)[C@H]1[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000430089033 1122398140 /nfs/dbraw/zinc/39/81/40/1122398140.db2.gz MIRFGJAHRXARGV-OAHLLOKOSA-N 1 1 274.364 3.605 20 5 CHBDMO CC(C)[C@@H]1[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000430089031 1122398173 /nfs/dbraw/zinc/39/81/73/1122398173.db2.gz MIRFGJAHRXARGV-HNNXBMFYSA-N 1 1 274.364 3.605 20 5 CHBDMO CC(C)CC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CC1 ZINC000505640921 1122446963 /nfs/dbraw/zinc/44/69/63/1122446963.db2.gz TVEHBLXVOUIUIU-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO CC(C)CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CC1 ZINC000505640921 1122446964 /nfs/dbraw/zinc/44/69/64/1122446964.db2.gz TVEHBLXVOUIUIU-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CC1CCCC1 ZINC000435418033 1122464642 /nfs/dbraw/zinc/46/46/42/1122464642.db2.gz WAKOQUQTGPKKEO-GFCCVEGCSA-N 1 1 262.353 3.778 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)CCC[C@H]1C ZINC001191070301 1122568117 /nfs/dbraw/zinc/56/81/17/1122568117.db2.gz KCQGVHJGDCZCOV-QWHCGFSZSA-N 1 1 292.379 3.614 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000516217830 1122578921 /nfs/dbraw/zinc/57/89/21/1122578921.db2.gz UEAMCNPUYJIHOL-SNVBAGLBSA-N 1 1 256.371 3.667 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCC[C@@H]1C1CCCC1 ZINC000505898561 1122593608 /nfs/dbraw/zinc/59/36/08/1122593608.db2.gz PYZVJMBTYRURRV-OAHLLOKOSA-N 1 1 292.354 3.889 20 5 CHBDMO Cc1cc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000507132796 1122723862 /nfs/dbraw/zinc/72/38/62/1122723862.db2.gz PGIBRXWEHJHXEG-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO C=C/C=C\CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194478306 1122779120 /nfs/dbraw/zinc/77/91/20/1122779120.db2.gz SOJLVIKKRRBIBZ-MJSXRHKHSA-N 1 1 286.375 3.907 20 5 CHBDMO CCCC[C@H](C)[N@@H+](CCCC)Cc1cn(C)nc1[N+](=O)[O-] ZINC001194570516 1122783927 /nfs/dbraw/zinc/78/39/27/1122783927.db2.gz KIPDMHIMENVJFK-ZDUSSCGKSA-N 1 1 296.415 3.509 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000140540544 1122817372 /nfs/dbraw/zinc/81/73/72/1122817372.db2.gz RNXJVFABCRIOFG-CQSZACIVSA-N 1 1 262.353 3.524 20 5 CHBDMO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000507117267 1122927198 /nfs/dbraw/zinc/92/71/98/1122927198.db2.gz PVHONFFAYVDKPS-UHFFFAOYSA-N 1 1 288.372 3.918 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2[nH]ccc21 ZINC000507158133 1122934253 /nfs/dbraw/zinc/93/42/53/1122934253.db2.gz ZNRSKLSOARKYJN-UHFFFAOYSA-N 1 1 295.342 3.708 20 5 CHBDMO CCCCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000776579245 1123401221 /nfs/dbraw/zinc/40/12/21/1123401221.db2.gz KJCLTFYLNWCRKI-INIZCTEOSA-N 1 1 294.395 3.529 20 5 CHBDMO COc1ccc(C[N@H+]2CCCC[C@H]2C(C)C)cc1[N+](=O)[O-] ZINC000522711713 1123720003 /nfs/dbraw/zinc/72/00/03/1123720003.db2.gz MICZHKZAOCTDLL-AWEZNQCLSA-N 1 1 292.379 3.614 20 5 CHBDMO CC(C)(C)c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])o1 ZINC000865815281 1124015909 /nfs/dbraw/zinc/01/59/09/1124015909.db2.gz YJDOHKPBMPSSBB-UHFFFAOYSA-N 1 1 288.347 3.775 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000444665981 1124050633 /nfs/dbraw/zinc/05/06/33/1124050633.db2.gz QJQVGBUHZXBIHD-TZMCWYRMSA-N 1 1 292.379 3.614 20 5 CHBDMO CC(C)[N@H+](Cc1cccc([N+](=O)[O-])c1)CC1CCC1 ZINC000444765076 1124061530 /nfs/dbraw/zinc/06/15/30/1124061530.db2.gz HZTRQTFRXITCMW-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2c(F)cccc2Cl)cc1 ZINC000037668290 1129165805 /nfs/dbraw/zinc/16/58/05/1129165805.db2.gz GVEPJTIRUVHHTH-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO CC[C@@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C(F)F ZINC000449360118 1124712004 /nfs/dbraw/zinc/71/20/04/1124712004.db2.gz IWCQPUCDLBNTIZ-CMPLNLGQSA-N 1 1 286.322 3.549 20 5 CHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC001307498831 1125001017 /nfs/dbraw/zinc/00/10/17/1125001017.db2.gz FMCGOISAPDAQRH-ZYHUDNBSSA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@@H]2c2ccccn2)cccc1[N+](=O)[O-] ZINC000530963490 1125189794 /nfs/dbraw/zinc/18/97/94/1125189794.db2.gz VRJBKOWPQMLUNE-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000531441467 1125220035 /nfs/dbraw/zinc/22/00/35/1125220035.db2.gz NOXYHJJFFXODIL-KBXCAEBGSA-N 1 1 296.370 3.973 20 5 CHBDMO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000879748644 1125229269 /nfs/dbraw/zinc/22/92/69/1125229269.db2.gz MLKAYRKCSURCDS-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1cncc([C@@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000879748644 1125229274 /nfs/dbraw/zinc/22/92/74/1125229274.db2.gz MLKAYRKCSURCDS-KRWDZBQOSA-N 1 1 297.358 3.635 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c(F)c1 ZINC000509663745 1125419648 /nfs/dbraw/zinc/41/96/48/1125419648.db2.gz DONAOQWEEVWHMS-ZUZCIYMTSA-N 1 1 296.317 3.638 20 5 CHBDMO O=[N+]([O-])c1cc(F)c(C[N@H+]2CCC[C@@H]3CCC[C@H]32)c(F)c1 ZINC000509663745 1125419649 /nfs/dbraw/zinc/41/96/49/1125419649.db2.gz DONAOQWEEVWHMS-ZUZCIYMTSA-N 1 1 296.317 3.638 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000037775547 1129268760 /nfs/dbraw/zinc/26/87/60/1129268760.db2.gz AILKGQMTTRHQIV-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094774538 1129451604 /nfs/dbraw/zinc/45/16/04/1129451604.db2.gz JTDHEEBWYRQVLH-DGCLKSJQSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000741795666 1129454205 /nfs/dbraw/zinc/45/42/05/1129454205.db2.gz QKBHONMNCFYQCU-VXGBXAGGSA-N 1 1 280.343 3.744 20 5 CHBDMO CCCCCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000796116480 1129467356 /nfs/dbraw/zinc/46/73/56/1129467356.db2.gz UVOFAPMIWTVWNB-UHFFFAOYSA-N 1 1 264.369 3.649 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC2(CCCC2)C1 ZINC000743864070 1129542227 /nfs/dbraw/zinc/54/22/27/1129542227.db2.gz IBHKRVIDJLXQBF-ZDUSSCGKSA-N 1 1 274.364 3.922 20 5 CHBDMO CCC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])CC(C)C ZINC000746144555 1129627528 /nfs/dbraw/zinc/62/75/28/1129627528.db2.gz BQMLAIFYXRJNMG-UHFFFAOYSA-N 1 1 268.332 3.602 20 5 CHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCCC[C@@H]2c2ccccc2)C1 ZINC001169006018 1129689441 /nfs/dbraw/zinc/68/94/41/1129689441.db2.gz FIPBYULVNOJYAP-HYVNUMGLSA-N 1 1 288.391 3.659 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccccc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169011215 1129690084 /nfs/dbraw/zinc/69/00/84/1129690084.db2.gz ILVYCMZQMZDTIA-DLBZAZTESA-N 1 1 290.407 3.590 20 5 CHBDMO CC[N@@H+](Cc1ccc(Cl)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169039777 1129690577 /nfs/dbraw/zinc/69/05/77/1129690577.db2.gz TWABAGUDJOHTAM-HIFRSBDPSA-N 1 1 296.798 3.607 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)c(C)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169050084 1129692138 /nfs/dbraw/zinc/69/21/38/1129692138.db2.gz YLRCWSAUWKJNFP-DLBZAZTESA-N 1 1 290.407 3.571 20 5 CHBDMO CC(C)C[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001169665266 1129744863 /nfs/dbraw/zinc/74/48/63/1129744863.db2.gz BGILCNVBTWHBCZ-CYBMUJFWSA-N 1 1 264.369 3.504 20 5 CHBDMO COC(=O)C[N@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000768400946 1129855250 /nfs/dbraw/zinc/85/52/50/1129855250.db2.gz NNRPSNQDKIQSIZ-UHFFFAOYSA-N 1 1 293.366 3.598 20 5 CHBDMO COC(=O)C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000768400946 1129855254 /nfs/dbraw/zinc/85/52/54/1129855254.db2.gz NNRPSNQDKIQSIZ-UHFFFAOYSA-N 1 1 293.366 3.598 20 5 CHBDMO CCC(CC)[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CC1 ZINC000801515015 1129923613 /nfs/dbraw/zinc/92/36/13/1129923613.db2.gz SBJAQMUTJGTOSD-UHFFFAOYSA-N 1 1 280.343 3.887 20 5 CHBDMO CC[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCC1 ZINC000746675328 1130146031 /nfs/dbraw/zinc/14/60/31/1130146031.db2.gz SYPWIAVGGICTAA-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CC[N@H+](Cc1ccoc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783559064 1130838355 /nfs/dbraw/zinc/83/83/55/1130838355.db2.gz XTLLJZFZXTYXEK-UHFFFAOYSA-N 1 1 294.738 3.863 20 5 CHBDMO CC[N@@H+](Cc1ccoc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783559064 1130838361 /nfs/dbraw/zinc/83/83/61/1130838361.db2.gz XTLLJZFZXTYXEK-UHFFFAOYSA-N 1 1 294.738 3.863 20 5 CHBDMO C[N@H+]1CCCC[C@@H]1CCOc1ccc([N+](=O)[O-])cc1Cl ZINC000798213012 1131030060 /nfs/dbraw/zinc/03/00/60/1131030060.db2.gz HVHGHKKSSFNUQV-LLVKDONJSA-N 1 1 298.770 3.501 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799193239 1131075664 /nfs/dbraw/zinc/07/56/64/1131075664.db2.gz MFESSYTUKCUMPJ-ZIAGYGMSSA-N 1 1 297.358 3.540 20 5 CHBDMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000816646318 1131117122 /nfs/dbraw/zinc/11/71/22/1131117122.db2.gz BTWORNNSSHVNIU-NWDGAFQWSA-N 1 1 286.331 3.695 20 5 CHBDMO O[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@@H]1F ZINC001141722505 1132239635 /nfs/dbraw/zinc/23/96/35/1132239635.db2.gz AKNGCBNUALJHDC-RBUKOAKNSA-N 1 1 295.357 3.508 20 5 CHBDMO C[N@@H+](CC1CCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910450 1132347722 /nfs/dbraw/zinc/34/77/22/1132347722.db2.gz AAKAKLKSLMOWNC-INIZCTEOSA-N 1 1 288.391 3.574 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001173222504 1132411864 /nfs/dbraw/zinc/41/18/64/1132411864.db2.gz SMLROWCUTQZBTF-CWRNSKLLSA-N 1 1 288.391 3.648 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)C[C@@H]1C ZINC001173227600 1132412677 /nfs/dbraw/zinc/41/26/77/1132412677.db2.gz RFTMWBBNKNTULO-HZSPNIEDSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)[C@@H]1C ZINC001173227893 1132412952 /nfs/dbraw/zinc/41/29/52/1132412952.db2.gz SHVXPKZHKMITSG-MCIONIFRSA-N 1 1 276.380 3.646 20 5 CHBDMO Cc1ccccc1C[N@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225519 1132412970 /nfs/dbraw/zinc/41/29/70/1132412970.db2.gz CYOMSKJWNZWAHK-OAHLLOKOSA-N 1 1 298.386 3.966 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@](C)(F)CC1 ZINC001173229115 1132413919 /nfs/dbraw/zinc/41/39/19/1132413919.db2.gz PZRCPOGRUSSVTJ-CZUORRHYSA-N 1 1 294.370 3.740 20 5 CHBDMO Cc1cccc(C[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173229190 1132414040 /nfs/dbraw/zinc/41/40/40/1132414040.db2.gz RISAZNYEYFHJRI-OAHLLOKOSA-N 1 1 298.386 3.966 20 5 CHBDMO CC(C)(C)C(=[NH2+])Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC001162664451 1133102813 /nfs/dbraw/zinc/10/28/13/1133102813.db2.gz GBOGIGQPPYUHOS-UHFFFAOYSA-N 1 1 272.308 3.578 20 5 CHBDMO CC1(C[N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001205883426 1133627387 /nfs/dbraw/zinc/62/73/87/1133627387.db2.gz VASOJOXWFJTFRE-AWEZNQCLSA-N 1 1 274.364 3.574 20 5 CHBDMO Cc1cc[nH+]c(C)c1Nc1c(F)ccc([N+](=O)[O-])c1F ZINC001215287843 1134614809 /nfs/dbraw/zinc/61/48/09/1134614809.db2.gz YTVKLWRVBDGZFO-UHFFFAOYSA-N 1 1 279.246 3.628 20 5 CHBDMO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000035013445 260003724 /nfs/dbraw/zinc/00/37/24/260003724.db2.gz CPUFAZCQJOZTNU-LBPRGKRZSA-N 1 1 274.320 3.655 20 5 CHBDMO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)n1 ZINC000080274747 260179703 /nfs/dbraw/zinc/17/97/03/260179703.db2.gz GLYCHHWZHSBVKF-GHMZBOCLSA-N 1 1 291.376 3.772 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCCCCC1 ZINC000313547898 260302499 /nfs/dbraw/zinc/30/24/99/260302499.db2.gz RJKSQBRCJOLWJO-UHFFFAOYSA-N 1 1 280.343 3.889 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CC(C)(C)C ZINC000517901050 260316131 /nfs/dbraw/zinc/31/61/31/260316131.db2.gz GYELVTJXTHEZKB-UHFFFAOYSA-N 1 1 294.395 3.860 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000514083984 261353791 /nfs/dbraw/zinc/35/37/91/261353791.db2.gz NOSKLCQGQBODCR-NSHDSACASA-N 1 1 268.382 3.667 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC(C)(C)C1 ZINC000497363414 262146715 /nfs/dbraw/zinc/14/67/15/262146715.db2.gz JHLHSUJBDIVVKZ-GFCCVEGCSA-N 1 1 262.353 3.778 20 5 CHBDMO CC(C)(C)c1ccncc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000414493975 328188152 /nfs/dbraw/zinc/18/81/52/328188152.db2.gz DBIBTBQMNJDDAI-UHFFFAOYSA-N 1 1 299.374 3.577 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccccc1[N+](=O)[O-] ZINC000111405503 328354628 /nfs/dbraw/zinc/35/46/28/328354628.db2.gz RNCUQXPKJAQCPJ-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc(F)c2)c(Cl)c1 ZINC000049963291 328379931 /nfs/dbraw/zinc/37/99/31/328379931.db2.gz DLNHKHPRPGVGHL-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(F)cc1Cl ZINC000050015832 328381899 /nfs/dbraw/zinc/38/18/99/328381899.db2.gz IWXMPANBHQZNMT-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000559635992 327255986 /nfs/dbraw/zinc/25/59/86/327255986.db2.gz CZMLPHIGQXMFKK-BBRMVZONSA-N 1 1 297.358 3.540 20 5 CHBDMO CCC[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000118970534 330369257 /nfs/dbraw/zinc/36/92/57/330369257.db2.gz OZMIYVSSOYYEGR-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CCC[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000118970534 330369258 /nfs/dbraw/zinc/36/92/58/330369258.db2.gz OZMIYVSSOYYEGR-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C(C)(F)F ZINC000449414418 330923757 /nfs/dbraw/zinc/92/37/57/330923757.db2.gz LXWAFSSKHQPPOG-QWRGUYRKSA-N 1 1 286.322 3.549 20 5 CHBDMO CC[N@@H+](CC(C)C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000488597220 332019997 /nfs/dbraw/zinc/01/99/97/332019997.db2.gz ZONIVHQYAFHQMH-GFCCVEGCSA-N 1 1 250.342 3.634 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CC(C)C ZINC000489101410 332041453 /nfs/dbraw/zinc/04/14/53/332041453.db2.gz HBMUWTPYLQEDCI-LBPRGKRZSA-N 1 1 250.342 3.552 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000490551768 332091347 /nfs/dbraw/zinc/09/13/47/332091347.db2.gz ZJQKRJKTPPJZNU-BFQNTYOBSA-N 1 1 292.354 3.887 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)cc1 ZINC000303538200 333343386 /nfs/dbraw/zinc/34/33/86/333343386.db2.gz HJBADPFFVPEUBD-QGZVFWFLSA-N 1 1 286.375 3.917 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000524609368 333368369 /nfs/dbraw/zinc/36/83/69/333368369.db2.gz VEIFKNIRXQMRMY-OAHLLOKOSA-N 1 1 276.380 3.792 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC3(C2)CCCCC3)cc1 ZINC000525122339 333399986 /nfs/dbraw/zinc/39/99/86/333399986.db2.gz BVOQUJRCOMKAFS-UHFFFAOYSA-N 1 1 274.364 3.751 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCCC[C@@H]1C ZINC000548586794 334162996 /nfs/dbraw/zinc/16/29/96/334162996.db2.gz JNHRDIVDKOBTJL-ZDUSSCGKSA-N 1 1 262.353 3.668 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@H](CC2CC2)C1 ZINC000550032828 334211751 /nfs/dbraw/zinc/21/17/51/334211751.db2.gz ZBERDLNXWTWHGK-GFCCVEGCSA-N 1 1 294.782 3.870 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C1CCCC1 ZINC000551827471 334263592 /nfs/dbraw/zinc/26/35/92/334263592.db2.gz SPGCGBQZLUXCBO-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H](C)CC2)cc1[N+](=O)[O-] ZINC000352801687 533928041 /nfs/dbraw/zinc/92/80/41/533928041.db2.gz TZCAQTLXUJBASE-LBPRGKRZSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CCC1(F)F ZINC000291489509 524568619 /nfs/dbraw/zinc/56/86/19/524568619.db2.gz GMCMBCZWTSJDFW-FUEXJSSKSA-N 1 1 296.317 3.585 20 5 CHBDMO Cc1ccc(CNc2cccc(C3CC3)[nH+]2)cc1[N+](=O)[O-] ZINC000339428241 524617309 /nfs/dbraw/zinc/61/73/09/524617309.db2.gz FNJFMBAGMHDDOE-UHFFFAOYSA-N 1 1 283.331 3.788 20 5 CHBDMO CSC[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000292453504 525653157 /nfs/dbraw/zinc/65/31/57/525653157.db2.gz PQTBXNRCVVKRHP-CHWSQXEVSA-N 1 1 294.420 3.731 20 5 CHBDMO C[C@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001193509511 1122696202 /nfs/dbraw/zinc/69/62/02/1122696202.db2.gz ZZRDWWTWMDEWOO-NSHDSACASA-N 1 1 282.771 3.870 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OCC ZINC000506993993 1122917675 /nfs/dbraw/zinc/91/76/75/1122917675.db2.gz CCWPKMYHXNZIFS-LBPRGKRZSA-N 1 1 280.368 3.614 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CC(C)(C)C ZINC000532550726 1125410878 /nfs/dbraw/zinc/41/08/78/1125410878.db2.gz AQEISARNYOVATF-LLVKDONJSA-N 1 1 250.342 3.634 20 5 CHBDMO CC(C)(C)[N@@H+](Cc1ccccc1)Cc1cccnc1[N+](=O)[O-] ZINC000886042140 1125639314 /nfs/dbraw/zinc/63/93/14/1125639314.db2.gz WLLIMSURGAZVQU-UHFFFAOYSA-N 1 1 299.374 3.791 20 5 CHBDMO Cc1cccnc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000093159833 1125766570 /nfs/dbraw/zinc/76/65/70/1125766570.db2.gz OOIRMHPVNUCNFK-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000482304837 1126750088 /nfs/dbraw/zinc/75/00/88/1126750088.db2.gz BCBPXTZLYSDICF-LBPRGKRZSA-N 1 1 262.353 3.525 20 5 CHBDMO CC[N@@H+](CC1CCC1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000483131826 1126769038 /nfs/dbraw/zinc/76/90/38/1126769038.db2.gz RZXQNUSINSFEIT-LBPRGKRZSA-N 1 1 262.353 3.778 20 5 CHBDMO Cc1cc[nH+]c(N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000182638516 1126874408 /nfs/dbraw/zinc/87/44/08/1126874408.db2.gz DZFOJDTVKPCTFG-LBPRGKRZSA-N 1 1 271.320 3.780 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCc1ccccn1 ZINC000182939866 1126879717 /nfs/dbraw/zinc/87/97/17/1126879717.db2.gz YMKGTUKCINQOIF-CQSZACIVSA-N 1 1 299.374 3.534 20 5 CHBDMO CC[N@@H+](CC(C)C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485718683 1126946054 /nfs/dbraw/zinc/94/60/54/1126946054.db2.gz SEZATZILKRFDEC-CYBMUJFWSA-N 1 1 264.369 3.942 20 5 CHBDMO C[C@H](Nc1ccc2c(c1)[nH+]cn2C)c1ccc([N+](=O)[O-])cc1 ZINC000348806164 1127128336 /nfs/dbraw/zinc/12/83/36/1127128336.db2.gz SMEMPFVEOYGORW-NSHDSACASA-N 1 1 296.330 3.655 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000285199873 1127219333 /nfs/dbraw/zinc/21/93/33/1127219333.db2.gz CYERPANPURRUFX-UHFFFAOYSA-N 1 1 290.344 3.539 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCC=C(c3ccco3)C2)cs1 ZINC000285199873 1127219337 /nfs/dbraw/zinc/21/93/37/1127219337.db2.gz CYERPANPURRUFX-UHFFFAOYSA-N 1 1 290.344 3.539 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000590204438 1127251592 /nfs/dbraw/zinc/25/15/92/1127251592.db2.gz MMPXQBMFCIKLGR-HUUCEWRRSA-N 1 1 274.364 3.605 20 5 CHBDMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC001168400615 1127298379 /nfs/dbraw/zinc/29/83/79/1127298379.db2.gz BZSOBHUPGSWDDL-CWRNSKLLSA-N 1 1 288.391 3.914 20 5 CHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C(C)C ZINC000355401587 1127338841 /nfs/dbraw/zinc/33/88/41/1127338841.db2.gz PMQQZSITQFEEGA-UHFFFAOYSA-N 1 1 280.368 3.612 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CCF)C1 ZINC000595754387 1127475250 /nfs/dbraw/zinc/47/52/50/1127475250.db2.gz APBKLWMIZUGQNI-STQMWFEESA-N 1 1 280.343 3.727 20 5 CHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000360028749 1127487275 /nfs/dbraw/zinc/48/72/75/1127487275.db2.gz XJNHDQXMVKAZBX-AOOOYVTPSA-N 1 1 268.744 3.621 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1Cc2ccccc2C2(CC2)C1 ZINC000360725211 1127508448 /nfs/dbraw/zinc/50/84/48/1127508448.db2.gz IZSNHUIVKDODCI-UHFFFAOYSA-N 1 1 294.354 3.642 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1Cc2ccccc2C2(CC2)C1 ZINC000360725211 1127508451 /nfs/dbraw/zinc/50/84/51/1127508451.db2.gz IZSNHUIVKDODCI-UHFFFAOYSA-N 1 1 294.354 3.642 20 5 CHBDMO Cc1cc(C)c(CNc2cccc([N+](=O)[O-])c2)c(C)[nH+]1 ZINC000601924568 1127551971 /nfs/dbraw/zinc/55/19/71/1127551971.db2.gz BSFWOPUZRQKQED-UHFFFAOYSA-N 1 1 271.320 3.527 20 5 CHBDMO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC1CCC1 ZINC000361480952 1127566678 /nfs/dbraw/zinc/56/66/78/1127566678.db2.gz IBJWOGISOMKFDP-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO CSc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000603428171 1127648320 /nfs/dbraw/zinc/64/83/20/1127648320.db2.gz QAJRYQCQYNLHRQ-JTQLQIEISA-N 1 1 292.360 3.761 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](C1CC1)C1CCCCC1 ZINC000061163085 1127659181 /nfs/dbraw/zinc/65/91/81/1127659181.db2.gz CFFVPZYHWBTKNG-UHFFFAOYSA-N 1 1 274.364 3.892 20 5 CHBDMO CC[N@@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000603837810 1127675400 /nfs/dbraw/zinc/67/54/00/1127675400.db2.gz IFVJOYWUQQJUBS-UHFFFAOYSA-N 1 1 284.359 3.925 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000603843508 1127675565 /nfs/dbraw/zinc/67/55/65/1127675565.db2.gz GFRCSGVYCPTQHQ-ZDUSSCGKSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000603873871 1127679830 /nfs/dbraw/zinc/67/98/30/1127679830.db2.gz JAXMJRSVWSNIIP-CJNGLKHVSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552446 1127680524 /nfs/dbraw/zinc/68/05/24/1127680524.db2.gz CYTNFEUVLZQIAK-UPJWGTAASA-N 1 1 292.404 3.626 20 5 CHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1ccsc1[N+](=O)[O-] ZINC000604433516 1127705663 /nfs/dbraw/zinc/70/56/63/1127705663.db2.gz SWXRDDQBUULGPO-LBPRGKRZSA-N 1 1 297.424 3.723 20 5 CHBDMO CCC(CC)[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000604434809 1127705681 /nfs/dbraw/zinc/70/56/81/1127705681.db2.gz QTDRVSPHHXFPBS-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO CCC(CC)[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)C1CC1 ZINC000604434831 1127705753 /nfs/dbraw/zinc/70/57/53/1127705753.db2.gz YJLNABALQPOBGK-UHFFFAOYSA-N 1 1 292.379 3.756 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000604484441 1127706511 /nfs/dbraw/zinc/70/65/11/1127706511.db2.gz NECXRDKVRCWMHH-KRWDZBQOSA-N 1 1 298.342 3.638 20 5 CHBDMO CC[N@H+](Cc1cccc(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000061799826 1127718413 /nfs/dbraw/zinc/71/84/13/1127718413.db2.gz SOILPMNKDBGHFG-UHFFFAOYSA-N 1 1 288.322 3.756 20 5 CHBDMO CC[N@@H+](Cc1cccc(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000061799826 1127718417 /nfs/dbraw/zinc/71/84/17/1127718417.db2.gz SOILPMNKDBGHFG-UHFFFAOYSA-N 1 1 288.322 3.756 20 5 CHBDMO CC[C@H]1C[C@H](C)C[N@H+]1Cc1cccc([N+](=O)[O-])c1C ZINC000466903937 1127949602 /nfs/dbraw/zinc/94/96/02/1127949602.db2.gz BALZSDCOPXRKLB-FZMZJTMJSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[N@@H+](CCC1CC1)Cc1ccc([N+](=O)[O-])cc1C ZINC000544942477 1127991324 /nfs/dbraw/zinc/99/13/24/1127991324.db2.gz YMPKGISDXGRWNX-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO Cc1cccc([C@@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000541388676 1128020489 /nfs/dbraw/zinc/02/04/89/1128020489.db2.gz CMLJBHTZMKEULQ-QGZVFWFLSA-N 1 1 296.370 3.893 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-])C(C)(C)C ZINC000609144530 1128049486 /nfs/dbraw/zinc/04/94/86/1128049486.db2.gz BYJFFFOBQXUBCO-JTQLQIEISA-N 1 1 268.332 3.600 20 5 CHBDMO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609145472 1128050975 /nfs/dbraw/zinc/05/09/75/1128050975.db2.gz FGVVEXSHQVAQOD-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@@H]1c2ccccc2OCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609145472 1128050976 /nfs/dbraw/zinc/05/09/76/1128050976.db2.gz FGVVEXSHQVAQOD-CYBMUJFWSA-N 1 1 298.342 3.550 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC2(CCC2)C1 ZINC000470179404 1128064659 /nfs/dbraw/zinc/06/46/59/1128064659.db2.gz XEFBYCZGELMXCN-UVTDQMKNSA-N 1 1 286.375 3.874 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C2CC2)C1 ZINC000470179227 1128065338 /nfs/dbraw/zinc/06/53/38/1128065338.db2.gz URHSLBGGJUBKFZ-WQMJKPAKSA-N 1 1 286.375 3.730 20 5 CHBDMO CCOc1cc(C[N@H+]2CCCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492633265 1128107312 /nfs/dbraw/zinc/10/73/12/1128107312.db2.gz UWXLCGLNNJIKJD-ZDUSSCGKSA-N 1 1 292.379 3.758 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC=C(C)CC1 ZINC000492784150 1128113154 /nfs/dbraw/zinc/11/31/54/1128113154.db2.gz OMBNNKYGOQDDMY-CYBMUJFWSA-N 1 1 260.337 3.616 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC[C@H](C)[C@H]2C)ccc1[N+](=O)[O-] ZINC000492788072 1128113325 /nfs/dbraw/zinc/11/33/25/1128113325.db2.gz HQSQJKIUSRRMQT-QWHCGFSZSA-N 1 1 292.379 3.614 20 5 CHBDMO CCC(C)(C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000074320918 1128125804 /nfs/dbraw/zinc/12/58/04/1128125804.db2.gz MLOQBSIVJNZPAX-UHFFFAOYSA-N 1 1 250.342 3.524 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761507756 1128131787 /nfs/dbraw/zinc/13/17/87/1128131787.db2.gz VXKFNMQSBFABNS-JTQLQIEISA-N 1 1 270.760 3.725 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761506005 1128132337 /nfs/dbraw/zinc/13/23/37/1128132337.db2.gz LNUQOKILWMNWKK-SNVBAGLBSA-N 1 1 270.760 3.869 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609195426 1128170843 /nfs/dbraw/zinc/17/08/43/1128170843.db2.gz ORDLVCDIBNYRGF-AWEZNQCLSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000032252264 1128265182 /nfs/dbraw/zinc/26/51/82/1128265182.db2.gz KZEGVDKVDBOOQJ-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO Cc1c(C[N@H+](C)[C@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000917096886 1128480962 /nfs/dbraw/zinc/48/09/62/1128480962.db2.gz HKIPXWYTNBDCGR-DOMZBBRYSA-N 1 1 276.380 3.914 20 5 CHBDMO CCCC[N@@H+](CC)Cc1ccc([N+](=O)[O-])cc1C ZINC000569858833 1128610703 /nfs/dbraw/zinc/61/07/03/1128610703.db2.gz QATQQPSALSSNDB-UHFFFAOYSA-N 1 1 250.342 3.525 20 5 CHBDMO Cc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC000601112696 1128698885 /nfs/dbraw/zinc/69/88/85/1128698885.db2.gz ASQOQOFSGOEGKN-GFCCVEGCSA-N 1 1 288.322 3.893 20 5 CHBDMO C[C@@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609672505 1128721394 /nfs/dbraw/zinc/72/13/94/1128721394.db2.gz HLZRRCDVNYGBBU-RHSMWYFYSA-N 1 1 296.370 3.973 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000609705255 1128722872 /nfs/dbraw/zinc/72/28/72/1128722872.db2.gz MIOCLTRSAIVUQF-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000072555883 1117762557 /nfs/dbraw/zinc/76/25/57/1117762557.db2.gz MIGALLXZBZSEAX-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000072555883 1117762560 /nfs/dbraw/zinc/76/25/60/1117762560.db2.gz MIGALLXZBZSEAX-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC001307686303 1117928773 /nfs/dbraw/zinc/92/87/73/1117928773.db2.gz SPJRODKFXSNRBZ-MEBBXXQBSA-N 1 1 298.333 3.884 20 5 CHBDMO CC1=C[C@H](C)C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000430289064 1117998230 /nfs/dbraw/zinc/99/82/30/1117998230.db2.gz LKVSNJUUMVQENC-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@H](C)C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000430289064 1117998232 /nfs/dbraw/zinc/99/82/32/1117998232.db2.gz LKVSNJUUMVQENC-JTQLQIEISA-N 1 1 280.755 3.646 20 5 CHBDMO Cc1cc(N[C@H]2C[N@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000536021127 1118299567 /nfs/dbraw/zinc/29/95/67/1118299567.db2.gz BBHQKJBIJVHULZ-INIZCTEOSA-N 1 1 297.358 3.502 20 5 CHBDMO CCc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000478476881 1119069813 /nfs/dbraw/zinc/06/98/13/1119069813.db2.gz CYWHFVMYADOXPQ-LBPRGKRZSA-N 1 1 288.347 3.909 20 5 CHBDMO CC(C)[N@@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000158724909 1119153156 /nfs/dbraw/zinc/15/31/56/1119153156.db2.gz NBTPSHGWSMOKKH-UHFFFAOYSA-N 1 1 274.320 3.695 20 5 CHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC=CCC3)o2)cc1 ZINC000611521120 1119164848 /nfs/dbraw/zinc/16/48/48/1119164848.db2.gz AIDLFHSBLSFTDZ-UHFFFAOYSA-N 1 1 284.315 3.617 20 5 CHBDMO CC1(C)CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000000019146 1119295243 /nfs/dbraw/zinc/29/52/43/1119295243.db2.gz NFXKBHAAVPRMTH-UHFFFAOYSA-N 1 1 276.380 3.649 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1ccsc1 ZINC000612576476 1119800206 /nfs/dbraw/zinc/80/02/06/1119800206.db2.gz HOFQXJQEDOKSJU-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000181369412 1120044230 /nfs/dbraw/zinc/04/42/30/1120044230.db2.gz CBXPKAJJCYYVJM-NSHDSACASA-N 1 1 274.295 3.585 20 5 CHBDMO C[C@H](c1cccnc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350390726 1120074632 /nfs/dbraw/zinc/07/46/32/1120074632.db2.gz KZWLLEZXCVFUJX-DEBLGDTFSA-N 1 1 297.358 3.696 20 5 CHBDMO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000091437160 1120171346 /nfs/dbraw/zinc/17/13/46/1120171346.db2.gz DAAHKBFQOMWELW-UWVGGRQHSA-N 1 1 289.335 3.611 20 5 CHBDMO CC[C@H](C)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000481077480 1120262914 /nfs/dbraw/zinc/26/29/14/1120262914.db2.gz QEUZHCNFOMJOTG-LBPRGKRZSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1cccc([C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000541388095 1120323185 /nfs/dbraw/zinc/32/31/85/1120323185.db2.gz ZRJBWRAHASTTMW-KRWDZBQOSA-N 1 1 296.370 3.893 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2C2CCCC2)c(F)c1 ZINC000313868536 1120415317 /nfs/dbraw/zinc/41/53/17/1120415317.db2.gz YIMVJLZQEWVHCG-MRXNPFEDSA-N 1 1 292.354 3.889 20 5 CHBDMO C[C@@H](c1cccs1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000053428462 1120497729 /nfs/dbraw/zinc/49/77/29/1120497729.db2.gz IYFGTEMPODXBFK-NSHDSACASA-N 1 1 276.361 3.849 20 5 CHBDMO Cc1cc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)c(C)o1 ZINC000044729995 1120731214 /nfs/dbraw/zinc/73/12/14/1120731214.db2.gz WZGGWKNKAYVBEY-SECBINFHSA-N 1 1 280.349 3.717 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1C ZINC000059403225 1121062528 /nfs/dbraw/zinc/06/25/28/1121062528.db2.gz NJVZTEFEEKYYGH-UHFFFAOYSA-N 1 1 298.386 3.968 20 5 CHBDMO C[C@H]1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000512178396 1121141781 /nfs/dbraw/zinc/14/17/81/1121141781.db2.gz ILQNTWSNVKUJGR-PODYEWJSSA-N 1 1 274.364 3.730 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000500495112 1121286716 /nfs/dbraw/zinc/28/67/16/1121286716.db2.gz ATXMEDJRPDBCNW-HNNXBMFYSA-N 1 1 276.380 3.914 20 5 CHBDMO Cc1c(C[N@@H+]2CC[C@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000466705815 1121556588 /nfs/dbraw/zinc/55/65/88/1121556588.db2.gz ADCYIHVEGIUGKC-CQSZACIVSA-N 1 1 276.380 3.771 20 5 CHBDMO CC1(C)CCC[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000063067152 1121623132 /nfs/dbraw/zinc/62/31/32/1121623132.db2.gz PSMPTXSDQMBFBG-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CC2(C1)CC(F)(F)C2 ZINC000611516959 1121654199 /nfs/dbraw/zinc/65/41/99/1121654199.db2.gz ZQNJLFAZZUVHSP-LLVKDONJSA-N 1 1 296.317 3.695 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611516948 1121654232 /nfs/dbraw/zinc/65/42/32/1121654232.db2.gz QAEBHUAKZBSNKK-WDEREUQCSA-N 1 1 284.306 3.551 20 5 CHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000542632229 1121714085 /nfs/dbraw/zinc/71/40/85/1121714085.db2.gz PQTFPNCDPKUVED-CQSZACIVSA-N 1 1 262.353 3.749 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccsc1 ZINC000619782584 1129013076 /nfs/dbraw/zinc/01/30/76/1129013076.db2.gz FFXSDKVLQGXDDE-JTQLQIEISA-N 1 1 292.360 3.516 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2sccc2C1 ZINC000183250107 1129036153 /nfs/dbraw/zinc/03/61/53/1129036153.db2.gz QCVSGMOLVKHBCW-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2sccc2C1 ZINC000183250107 1129036156 /nfs/dbraw/zinc/03/61/56/1129036156.db2.gz QCVSGMOLVKHBCW-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H]3CCCC[C@H]32)cc1Cl ZINC001182742750 1122187221 /nfs/dbraw/zinc/18/72/21/1122187221.db2.gz IYOHQOSDWMOQNC-DGCLKSJQSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@H]3CCCC[C@H]32)cc1Cl ZINC001182742750 1122187223 /nfs/dbraw/zinc/18/72/23/1122187223.db2.gz IYOHQOSDWMOQNC-DGCLKSJQSA-N 1 1 280.755 3.623 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@@H]2CCCC[C@H]12 ZINC000515548294 1122509389 /nfs/dbraw/zinc/50/93/89/1122509389.db2.gz RHIXYHKHOLELLH-KBRIMQKVSA-N 1 1 288.391 3.995 20 5 CHBDMO C[C@H]1CCCC[C@@H]1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001191521338 1122604416 /nfs/dbraw/zinc/60/44/16/1122604416.db2.gz PTNYHDIHEHTMDF-DZGCQCFKSA-N 1 1 288.391 3.779 20 5 CHBDMO C[C@H]1CCCC[C@H]1C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001191521341 1122604741 /nfs/dbraw/zinc/60/47/41/1122604741.db2.gz PTNYHDIHEHTMDF-ZFWWWQNUSA-N 1 1 288.391 3.779 20 5 CHBDMO Cc1cccc(C[N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000506205313 1122690988 /nfs/dbraw/zinc/69/09/88/1122690988.db2.gz RMSVGEHDMAONOH-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCCC3(CCCC3)C2)c1 ZINC000438368485 1122694896 /nfs/dbraw/zinc/69/48/96/1122694896.db2.gz BNPZTRJPODXYAD-UHFFFAOYSA-N 1 1 274.364 3.751 20 5 CHBDMO CCc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC001193743772 1122712245 /nfs/dbraw/zinc/71/22/45/1122712245.db2.gz UKJAEOVZPHOTLS-UHFFFAOYSA-N 1 1 298.386 3.832 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1CC=CCC1 ZINC000506741886 1122819039 /nfs/dbraw/zinc/81/90/39/1122819039.db2.gz CARHOOMEKFPMDU-KGLIPLIRSA-N 1 1 274.364 3.944 20 5 CHBDMO COc1cc(C[N@@H+](C(C)C)C2CCC2)c([N+](=O)[O-])cc1F ZINC000184262519 1122885945 /nfs/dbraw/zinc/88/59/45/1122885945.db2.gz FIGLOTPINIBIPA-UHFFFAOYSA-N 1 1 296.342 3.505 20 5 CHBDMO CCCC1(CCC)CCC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001197514496 1122958061 /nfs/dbraw/zinc/95/80/61/1122958061.db2.gz NEDNVKQNDYCWRL-UHFFFAOYSA-N 1 1 291.395 3.925 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](C3CCCC3)C2)c1 ZINC001198706125 1123008616 /nfs/dbraw/zinc/00/86/16/1123008616.db2.gz OJTBEGGSPXFGHV-MRXNPFEDSA-N 1 1 288.391 3.997 20 5 CHBDMO O=[N+]([O-])c1cc(O)cc(Nc2ccc3c[nH+]ccc3c2)c1 ZINC001201222696 1123079738 /nfs/dbraw/zinc/07/97/38/1123079738.db2.gz PLTQKVOIUBEUHR-UHFFFAOYSA-N 1 1 281.271 3.592 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)nc1 ZINC000930235888 1123402954 /nfs/dbraw/zinc/40/29/54/1123402954.db2.gz RSLGJYDHLPKERZ-GHMZBOCLSA-N 1 1 289.310 3.541 20 5 CHBDMO CC(C)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccco1 ZINC000346321944 1123678279 /nfs/dbraw/zinc/67/82/79/1123678279.db2.gz UFAYBNSLFJOTDX-UHFFFAOYSA-N 1 1 288.347 3.641 20 5 CHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCC2(CC2)CC1 ZINC000860069153 1123720252 /nfs/dbraw/zinc/72/02/52/1123720252.db2.gz DUWBTEZRSQFAEQ-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCC(C)(C)C1 ZINC000475552094 1124008700 /nfs/dbraw/zinc/00/87/00/1124008700.db2.gz QNURFAVDRUQXJH-ZDUSSCGKSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000037668282 1129164721 /nfs/dbraw/zinc/16/47/21/1129164721.db2.gz LJSQBSMGMOHHCJ-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1C ZINC000525636062 1124451297 /nfs/dbraw/zinc/45/12/97/1124451297.db2.gz DBJLNJRZWIYSKV-GHMZBOCLSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000525637135 1124451673 /nfs/dbraw/zinc/45/16/73/1124451673.db2.gz ZVKMQFGYLFLHPB-OLZOCXBDSA-N 1 1 262.353 3.605 20 5 CHBDMO COc1ccsc1C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000873183969 1124746871 /nfs/dbraw/zinc/74/68/71/1124746871.db2.gz UJBKOSONHKRIJB-SNVBAGLBSA-N 1 1 292.360 3.516 20 5 CHBDMO C[C@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000531441449 1125219985 /nfs/dbraw/zinc/21/99/85/1125219985.db2.gz GBYIDNQVIQDRSZ-WMLDXEAASA-N 1 1 296.370 3.973 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000037775548 1129269000 /nfs/dbraw/zinc/26/90/00/1129269000.db2.gz AILKGQMTTRHQIV-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000734152219 1129296335 /nfs/dbraw/zinc/29/63/35/1129296335.db2.gz HLTFWLKLIKNNIA-ZDUSSCGKSA-N 1 1 294.370 3.992 20 5 CHBDMO CC1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774520 1129451628 /nfs/dbraw/zinc/45/16/28/1129451628.db2.gz XFJKVPBITUYPIX-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@]3(CC=CCC3)C2)c1 ZINC000303529718 1129546826 /nfs/dbraw/zinc/54/68/26/1129546826.db2.gz FORHGTGTOUTXSV-QGZVFWFLSA-N 1 1 286.375 3.917 20 5 CHBDMO Cc1ccc(C[C@@H](C)[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000303755047 1129556475 /nfs/dbraw/zinc/55/64/75/1129556475.db2.gz MUKMBMWHXWWOQF-OAHLLOKOSA-N 1 1 298.386 3.966 20 5 CHBDMO CC(F)(F)CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168858691 1129677979 /nfs/dbraw/zinc/67/79/79/1129677979.db2.gz GAKVOTKQRYRVTK-UHFFFAOYSA-N 1 1 298.333 3.995 20 5 CHBDMO CC[C@H](c1ccccc1)[N@@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169040124 1129690499 /nfs/dbraw/zinc/69/04/99/1129690499.db2.gz YAXHZEHYVCNEAN-NUEKZKHPSA-N 1 1 276.380 3.515 20 5 CHBDMO Cc1ccc([C@@H]2CCC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001169025020 1129691391 /nfs/dbraw/zinc/69/13/91/1129691391.db2.gz ILURVVJBSNOLED-XIRDDKMYSA-N 1 1 288.391 3.577 20 5 CHBDMO CC[N@@H+](CCO)Cc1c2ccccc2cc2ccccc21 ZINC000768140801 1129836290 /nfs/dbraw/zinc/83/62/90/1129836290.db2.gz KVNUGVUVHBPBJA-UHFFFAOYSA-N 1 1 279.383 3.807 20 5 CHBDMO CC(C)CCC(N)=[NH+]OCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768520854 1129860583 /nfs/dbraw/zinc/86/05/83/1129860583.db2.gz FEUSFHISGDKQQR-UHFFFAOYSA-N 1 1 299.758 3.683 20 5 CHBDMO CC(C)CC[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746662075 1130138547 /nfs/dbraw/zinc/13/85/47/1130138547.db2.gz REULPNUSDPNEPQ-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001170281139 1130477899 /nfs/dbraw/zinc/47/78/99/1130477899.db2.gz VVOLLXKWZHHDSD-QWHCGFSZSA-N 1 1 262.353 3.605 20 5 CHBDMO CC1(C)C[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1C1CC1 ZINC000811512964 1130618157 /nfs/dbraw/zinc/61/81/57/1130618157.db2.gz BPZYPILBXUAWCD-AWEZNQCLSA-N 1 1 294.782 3.869 20 5 CHBDMO CC1(C)C[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1C1CC1 ZINC000811512964 1130618160 /nfs/dbraw/zinc/61/81/60/1130618160.db2.gz BPZYPILBXUAWCD-AWEZNQCLSA-N 1 1 294.782 3.869 20 5 CHBDMO Cc1cc(C)c2ccc3cccc(OC4C[NH+](C)C4)c3c2n1 ZINC001234911827 1130691164 /nfs/dbraw/zinc/69/11/64/1130691164.db2.gz FYHYLJLNNAICCM-UHFFFAOYSA-N 1 1 292.382 3.698 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844436102 1131563612 /nfs/dbraw/zinc/56/36/12/1131563612.db2.gz GQIKIGALNHFCQW-FZMZJTMJSA-N 1 1 296.317 3.777 20 5 CHBDMO CC[C@H](C)[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172906303 1132347063 /nfs/dbraw/zinc/34/70/63/1132347063.db2.gz XAQBKBACKQGTJS-WFASDCNBSA-N 1 1 276.380 3.573 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CCCCC1 ZINC001173220410 1132411931 /nfs/dbraw/zinc/41/19/31/1132411931.db2.gz AAFBSUBGLDGPHU-CYBMUJFWSA-N 1 1 276.380 3.790 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001173223101 1132412656 /nfs/dbraw/zinc/41/26/56/1132412656.db2.gz XRQXYDQSGOXQRC-BMFZPTHFSA-N 1 1 288.391 3.648 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001173233716 1132413745 /nfs/dbraw/zinc/41/37/45/1132413745.db2.gz MLBDIBLCQIOCAQ-KMFMINBZSA-N 1 1 288.391 3.790 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)[C@H](C)C1 ZINC001173230485 1132414200 /nfs/dbraw/zinc/41/42/00/1132414200.db2.gz YJKMVHSBWKVOHC-KFWWJZLASA-N 1 1 290.407 3.894 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](C3CCC3)C2)cc1Cl ZINC001206288964 1133683979 /nfs/dbraw/zinc/68/39/79/1133683979.db2.gz YIFDPLKSFIWYQO-CYBMUJFWSA-N 1 1 294.782 3.870 20 5 CHBDMO COc1ccc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000519968914 260035365 /nfs/dbraw/zinc/03/53/65/260035365.db2.gz VXLRSALXGJSINS-GXTWGEPZSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H]1C[C@@H](C)[C@H](C)[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355078909 227375927 /nfs/dbraw/zinc/37/59/27/227375927.db2.gz BVVKVBWRXAHYFW-MXWKQRLJSA-N 1 1 268.382 3.523 20 5 CHBDMO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000035140400 172008183 /nfs/dbraw/zinc/00/81/83/172008183.db2.gz IKGVWSFUTIZWCN-QWRGUYRKSA-N 1 1 260.293 3.600 20 5 CHBDMO Cc1ccc(F)cc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000179933392 260080656 /nfs/dbraw/zinc/08/06/56/260080656.db2.gz WCSIZVGPKZMYOB-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccc(F)cc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000179933392 260080659 /nfs/dbraw/zinc/08/06/59/260080659.db2.gz WCSIZVGPKZMYOB-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000312606426 260177677 /nfs/dbraw/zinc/17/76/77/260177677.db2.gz TVYCGKBTUZIBSH-UHFFFAOYSA-N 1 1 280.343 3.889 20 5 CHBDMO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000080273524 260179778 /nfs/dbraw/zinc/17/97/78/260179778.db2.gz MOWNQRYNIYURAD-QWRGUYRKSA-N 1 1 291.376 3.772 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000426773464 260351784 /nfs/dbraw/zinc/35/17/84/260351784.db2.gz JUAKLAKNOVVOIS-MCIONIFRSA-N 1 1 274.364 3.778 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000525786445 262236260 /nfs/dbraw/zinc/23/62/60/262236260.db2.gz JPEMDEYOVTYTBF-HNNXBMFYSA-N 1 1 276.380 3.648 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000430269255 263018450 /nfs/dbraw/zinc/01/84/50/263018450.db2.gz PYZJMWWOJKDOIJ-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@@H](C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000430269255 263018451 /nfs/dbraw/zinc/01/84/51/263018451.db2.gz PYZJMWWOJKDOIJ-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC12CCC2 ZINC000357023182 266233705 /nfs/dbraw/zinc/23/37/05/266233705.db2.gz LBCBCZSYUCGPCK-GFCCVEGCSA-N 1 1 292.354 3.746 20 5 CHBDMO Cc1cnc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000124320001 327982890 /nfs/dbraw/zinc/98/28/90/327982890.db2.gz XVDVMRILLBVJDH-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO Cc1ccc(C[N@H+](CC2CC2)C(C)C)cc1[N+](=O)[O-] ZINC000534337050 328049242 /nfs/dbraw/zinc/04/92/42/328049242.db2.gz NOCXVANVRRQZOE-UHFFFAOYSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H](C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccccc1 ZINC000534513141 328304969 /nfs/dbraw/zinc/30/49/69/328304969.db2.gz KKHLUWKPFFWFEL-AWEZNQCLSA-N 1 1 296.370 3.757 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303681240 328357626 /nfs/dbraw/zinc/35/76/26/328357626.db2.gz JCMLRCIOENVNIA-UKPHBRMFSA-N 1 1 288.391 3.790 20 5 CHBDMO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])o1 ZINC000048068853 327277292 /nfs/dbraw/zinc/27/72/92/327277292.db2.gz FHKHCQPBJKHZBB-RISCZKNCSA-N 1 1 286.331 3.601 20 5 CHBDMO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])o1 ZINC000048068857 327277382 /nfs/dbraw/zinc/27/73/82/327277382.db2.gz FHKHCQPBJKHZBB-BXUZGUMPSA-N 1 1 286.331 3.601 20 5 CHBDMO CCS[C@@H]1CC[C@H]([N@@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000174352855 329157681 /nfs/dbraw/zinc/15/76/81/329157681.db2.gz KSQKMLOTRUSIDM-UONOGXRCSA-N 1 1 294.420 3.701 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2c2cccn2C)cc1[N+](=O)[O-] ZINC000179705902 329207977 /nfs/dbraw/zinc/20/79/77/329207977.db2.gz BYDKOAOHBCJEBN-INIZCTEOSA-N 1 1 299.374 3.579 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(C(F)F)cc2)cs1 ZINC000185177897 329267037 /nfs/dbraw/zinc/26/70/37/329267037.db2.gz RRNYWAXNNIPWRH-UHFFFAOYSA-N 1 1 298.314 3.884 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(Cl)s2)cs1 ZINC000070218127 329855390 /nfs/dbraw/zinc/85/53/90/329855390.db2.gz DLPHYBZGZJQPTR-UHFFFAOYSA-N 1 1 288.781 3.661 20 5 CHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCCCCF)C2)cc1 ZINC000451545546 331033484 /nfs/dbraw/zinc/03/34/84/331033484.db2.gz HRSMHMLYXWQSLI-OAHLLOKOSA-N 1 1 294.370 3.914 20 5 CHBDMO CC[C@H]1CCC[N@H+]1C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470173825 331035621 /nfs/dbraw/zinc/03/56/21/331035621.db2.gz GCONPAXSKGHBMN-WVUXNXBLSA-N 1 1 274.364 3.873 20 5 CHBDMO CCC1(CC)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CCS1 ZINC000464582682 331363163 /nfs/dbraw/zinc/36/31/63/331363163.db2.gz XDLKVVBOONWGHA-UHFFFAOYSA-N 1 1 294.420 3.702 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000464772607 331367164 /nfs/dbraw/zinc/36/71/64/331367164.db2.gz IESLJUJPBWYMQW-HNNXBMFYSA-N 1 1 280.343 3.746 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000464774804 331367382 /nfs/dbraw/zinc/36/73/82/331367382.db2.gz IXYSNECXRPMPIL-MRXNPFEDSA-N 1 1 292.379 3.616 20 5 CHBDMO CC(C)[C@H]1C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])CCS1 ZINC000464774711 331367446 /nfs/dbraw/zinc/36/74/46/331367446.db2.gz PZZIPVWKMKMHTI-SWLSCSKDSA-N 1 1 294.420 3.729 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC(C)(C)C1 ZINC000490092080 332081209 /nfs/dbraw/zinc/08/12/09/332081209.db2.gz XYACLOMXGBMLBM-LBPRGKRZSA-N 1 1 262.353 3.696 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCSC(C)(C)C1 ZINC000490099147 332081335 /nfs/dbraw/zinc/08/13/35/332081335.db2.gz GCPLOAWAMKNQBA-GFCCVEGCSA-N 1 1 294.420 3.792 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CCCC1 ZINC000491091614 332147876 /nfs/dbraw/zinc/14/78/76/332147876.db2.gz POWWUDKSPVYVHE-UHFFFAOYSA-N 1 1 280.343 3.887 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000523702137 333340180 /nfs/dbraw/zinc/34/01/80/333340180.db2.gz VPKZBJSQIJHCCM-UHFFFAOYSA-N 1 1 284.359 3.659 20 5 CHBDMO CC[N@@H+](CCC1CC1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000546227427 334020737 /nfs/dbraw/zinc/02/07/37/334020737.db2.gz WWDYSRBNMFDMFQ-LBPRGKRZSA-N 1 1 262.353 3.778 20 5 CHBDMO CS[C@@H]1CCCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000134579514 334095860 /nfs/dbraw/zinc/09/58/60/334095860.db2.gz JBRZOIIFKBTPMS-CQSZACIVSA-N 1 1 294.420 3.621 20 5 CHBDMO CS[C@H]1CCCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000134579489 334095945 /nfs/dbraw/zinc/09/59/45/334095945.db2.gz JBRZOIIFKBTPMS-AWEZNQCLSA-N 1 1 294.420 3.621 20 5 CHBDMO CCC(C)(C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000547771647 334116631 /nfs/dbraw/zinc/11/66/31/334116631.db2.gz QADNVARDCFTWMK-UHFFFAOYSA-N 1 1 270.760 3.869 20 5 CHBDMO Cc1nc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000135128633 334116838 /nfs/dbraw/zinc/11/68/38/334116838.db2.gz UURAKIZPRJQIAE-VIFPVBQESA-N 1 1 291.376 3.519 20 5 CHBDMO CC(C)[N@@H+](CCCCCF)Cc1ccc([N+](=O)[O-])cc1 ZINC000577198726 335321405 /nfs/dbraw/zinc/32/14/05/335321405.db2.gz KEJKMPKWMPNABG-UHFFFAOYSA-N 1 1 282.359 3.945 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)C1(C)CC1 ZINC000355083158 528612260 /nfs/dbraw/zinc/61/22/60/528612260.db2.gz SIMBJVBMMBLFNT-GFCCVEGCSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[C@@H](C)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000215663649 1118915754 /nfs/dbraw/zinc/91/57/54/1118915754.db2.gz BCYTUWDFYXRLTQ-GFCCVEGCSA-N 1 1 262.353 3.605 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000562059280 1119092261 /nfs/dbraw/zinc/09/22/61/1119092261.db2.gz YDQBFHJXEDPYEM-JTQLQIEISA-N 1 1 286.322 3.884 20 5 CHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC(C)(C)C ZINC000092217602 1120095809 /nfs/dbraw/zinc/09/58/09/1120095809.db2.gz ALTCYMIKYZDZKZ-VQHVLOKHSA-N 1 1 262.353 3.586 20 5 CHBDMO CC[C@@H](C)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000215664270 1120660839 /nfs/dbraw/zinc/66/08/39/1120660839.db2.gz LADPTGRPFOEBKT-GFCCVEGCSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001190660483 1122549203 /nfs/dbraw/zinc/54/92/03/1122549203.db2.gz KEHREJCNUDZGOP-NSHDSACASA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@@H]1C[C@H](c2ccccc2)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886205089 1125661018 /nfs/dbraw/zinc/66/10/18/1125661018.db2.gz ZLNNMXKYECYVTL-CZUORRHYSA-N 1 1 297.358 3.573 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccncc1F)c1ccc([N+](=O)[O-])cc1 ZINC000338015395 1126710656 /nfs/dbraw/zinc/71/06/56/1126710656.db2.gz SAMVRRDXEHPAQN-MNOVXSKESA-N 1 1 289.310 3.541 20 5 CHBDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000159889721 1126757013 /nfs/dbraw/zinc/75/70/13/1126757013.db2.gz GKFPWTPTGJZANX-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000159889721 1126757014 /nfs/dbraw/zinc/75/70/14/1126757014.db2.gz GKFPWTPTGJZANX-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO CC1=C(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000482462734 1126758831 /nfs/dbraw/zinc/75/88/31/1126758831.db2.gz WPQNQFWLBDJUOY-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO CC1=C(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000482462734 1126758834 /nfs/dbraw/zinc/75/88/34/1126758834.db2.gz WPQNQFWLBDJUOY-UHFFFAOYSA-N 1 1 280.755 3.790 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](CC1CC1)CC1CCC1 ZINC000483273428 1126777168 /nfs/dbraw/zinc/77/71/68/1126777168.db2.gz YPQZTEOCPIUVMX-UHFFFAOYSA-N 1 1 274.364 3.607 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)c1ccco1 ZINC000183258335 1126883634 /nfs/dbraw/zinc/88/36/34/1126883634.db2.gz ZHAVKCQADGAHAX-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1occc1C[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000266514575 1126983174 /nfs/dbraw/zinc/98/31/74/1126983174.db2.gz FTVFBAVNUIFXPT-LLVKDONJSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1occc1C[N@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000266514575 1126983176 /nfs/dbraw/zinc/98/31/76/1126983176.db2.gz FTVFBAVNUIFXPT-LLVKDONJSA-N 1 1 274.320 3.689 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000487291785 1127030629 /nfs/dbraw/zinc/03/06/29/1127030629.db2.gz RZMRUPQBBCPLQX-NWDGAFQWSA-N 1 1 250.342 3.634 20 5 CHBDMO Cc1ccoc1C[N@@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000271035450 1127065419 /nfs/dbraw/zinc/06/54/19/1127065419.db2.gz KCKOVMCPNDOABI-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccoc1C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000271035450 1127065421 /nfs/dbraw/zinc/06/54/21/1127065421.db2.gz KCKOVMCPNDOABI-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000570248423 1127082140 /nfs/dbraw/zinc/08/21/40/1127082140.db2.gz MEBPJNAPJZNBHL-QGZVFWFLSA-N 1 1 299.374 3.881 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)s1 ZINC000283451785 1127139167 /nfs/dbraw/zinc/13/91/67/1127139167.db2.gz HJULBFDNIXMAGG-UHFFFAOYSA-N 1 1 294.351 3.736 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)s1 ZINC000283451785 1127139169 /nfs/dbraw/zinc/13/91/69/1127139169.db2.gz HJULBFDNIXMAGG-UHFFFAOYSA-N 1 1 294.351 3.736 20 5 CHBDMO O=[N+]([O-])c1ccc([O-])cc1C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000349768055 1127160155 /nfs/dbraw/zinc/16/01/55/1127160155.db2.gz MJYANLYPCRIYNH-INIZCTEOSA-N 1 1 298.342 3.638 20 5 CHBDMO O=[N+]([O-])c1ccc([O-])cc1CN1CCC[C@H]1c1ccccc1 ZINC000349768055 1127160157 /nfs/dbraw/zinc/16/01/57/1127160157.db2.gz MJYANLYPCRIYNH-INIZCTEOSA-N 1 1 298.342 3.638 20 5 CHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC(C)(C)C ZINC000045073474 1127179210 /nfs/dbraw/zinc/17/92/10/1127179210.db2.gz ZXTGYCCAPKDRBK-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO CC[C@H](CSC)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589206621 1127216234 /nfs/dbraw/zinc/21/62/34/1127216234.db2.gz YBHGOOWJDCYQKO-IUCKJTJTSA-N 1 1 294.420 3.681 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@@H](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000590378135 1127256746 /nfs/dbraw/zinc/25/67/46/1127256746.db2.gz IQNGWCQZFRHOQW-HNNXBMFYSA-N 1 1 274.364 3.525 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC12CCCC2 ZINC000593038289 1127369063 /nfs/dbraw/zinc/36/90/63/1127369063.db2.gz GSALWGWHWMPCLD-UHFFFAOYSA-N 1 1 290.363 3.512 20 5 CHBDMO CC(C)O[C@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000593056118 1127370332 /nfs/dbraw/zinc/37/03/32/1127370332.db2.gz YHKSOAUMOWQJOS-KGLIPLIRSA-N 1 1 292.379 3.545 20 5 CHBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)C1 ZINC000359303807 1127457436 /nfs/dbraw/zinc/45/74/36/1127457436.db2.gz PTNWVJMWCGBYRL-FZMZJTMJSA-N 1 1 280.393 3.668 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000593119388 1127475273 /nfs/dbraw/zinc/47/52/73/1127475273.db2.gz XESNILICCWUTCK-BXUZGUMPSA-N 1 1 296.317 3.695 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC2CC1(c1ccccc1)C2 ZINC000595907391 1127480008 /nfs/dbraw/zinc/48/00/08/1127480008.db2.gz KBMBUFGNFLBCFW-UHFFFAOYSA-N 1 1 294.354 3.716 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC3CC2(c2ccccc2)C3)c1 ZINC000595911135 1127479451 /nfs/dbraw/zinc/47/94/51/1127479451.db2.gz NQLZPCQHYDVZFR-UHFFFAOYSA-N 1 1 294.354 3.716 20 5 CHBDMO CCCCC[C@H]1CCCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595870735 1127479644 /nfs/dbraw/zinc/47/96/44/1127479644.db2.gz KCZYFOYQZUZDEX-ZDUSSCGKSA-N 1 1 295.383 3.826 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](CCF)C1 ZINC000597212102 1127534317 /nfs/dbraw/zinc/53/43/17/1127534317.db2.gz RSKQSCWYAMMDAT-GBXSZLQWSA-N 1 1 292.354 3.680 20 5 CHBDMO Cc1cc(C)c(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)n1 ZINC000602760334 1127611364 /nfs/dbraw/zinc/61/13/64/1127611364.db2.gz QEPYJAYSJHUIIE-UHFFFAOYSA-N 1 1 299.374 3.547 20 5 CHBDMO Cc1cc(C)c(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)n1 ZINC000602760334 1127611365 /nfs/dbraw/zinc/61/13/65/1127611365.db2.gz QEPYJAYSJHUIIE-UHFFFAOYSA-N 1 1 299.374 3.547 20 5 CHBDMO COc1cc(C[NH+]2[C@@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000362325994 1127628630 /nfs/dbraw/zinc/62/86/30/1127628630.db2.gz UODABRWXYGUYBC-QWRGUYRKSA-N 1 1 296.342 3.505 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCOc2ccccc2C1 ZINC000603909667 1127681953 /nfs/dbraw/zinc/68/19/53/1127681953.db2.gz YFGRXHCHFPOWRA-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCOc2ccccc2C1 ZINC000603909667 1127681955 /nfs/dbraw/zinc/68/19/55/1127681955.db2.gz YFGRXHCHFPOWRA-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO CC[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1C ZINC000603934139 1127685562 /nfs/dbraw/zinc/68/55/62/1127685562.db2.gz CBSQJCBOAPCILM-UHFFFAOYSA-N 1 1 290.388 3.987 20 5 CHBDMO CC[N@@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1C ZINC000603934139 1127685564 /nfs/dbraw/zinc/68/55/64/1127685564.db2.gz CBSQJCBOAPCILM-UHFFFAOYSA-N 1 1 290.388 3.987 20 5 CHBDMO Cc1ccccc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000061760090 1127715731 /nfs/dbraw/zinc/71/57/31/1127715731.db2.gz ZWCBBZDGOSLOIP-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000063618922 1127852209 /nfs/dbraw/zinc/85/22/09/1127852209.db2.gz RNXJVFABCRIOFG-AWEZNQCLSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC(C)(C)C1 ZINC000467283492 1127962762 /nfs/dbraw/zinc/96/27/62/1127962762.db2.gz WALBVOBYRNBQLV-LBPRGKRZSA-N 1 1 262.353 3.778 20 5 CHBDMO CC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)C(C)C ZINC000470175011 1128064755 /nfs/dbraw/zinc/06/47/55/1128064755.db2.gz XPXLXIXXLRYZRP-LCYFTJDESA-N 1 1 262.353 3.728 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC(C)C ZINC000470173288 1128064827 /nfs/dbraw/zinc/06/48/27/1128064827.db2.gz AJMIRXTWTXYPOL-MDWZMJQESA-N 1 1 262.353 3.586 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](C)C1 ZINC000470175900 1128064881 /nfs/dbraw/zinc/06/48/81/1128064881.db2.gz TUGRBAIGFWBRIG-CKXDQPNJSA-N 1 1 274.364 3.730 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC12CCC2 ZINC000470181600 1128065029 /nfs/dbraw/zinc/06/50/29/1128065029.db2.gz FQPCZUDGIPIONT-JLHYYAGUSA-N 1 1 272.348 3.627 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC(C)(C)C1 ZINC000470179261 1128065386 /nfs/dbraw/zinc/06/53/86/1128065386.db2.gz VJZQCDPPSSYIRX-UKTHLTGXSA-N 1 1 274.364 3.730 20 5 CHBDMO CCOc1cc(C[N@@H+](C)[C@@H](C)C2CCC2)ccc1[N+](=O)[O-] ZINC000492748630 1128111864 /nfs/dbraw/zinc/11/18/64/1128111864.db2.gz NDGMWBJQLKRNHS-LBPRGKRZSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@H+]2CCC[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000492788071 1128113296 /nfs/dbraw/zinc/11/32/96/1128113296.db2.gz HQSQJKIUSRRMQT-OLZOCXBDSA-N 1 1 292.379 3.614 20 5 CHBDMO CCC[C@H](C)[N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493650963 1128146397 /nfs/dbraw/zinc/14/63/97/1128146397.db2.gz CCLOBOQETWEXBO-JTQLQIEISA-N 1 1 270.760 3.869 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493650963 1128146398 /nfs/dbraw/zinc/14/63/98/1128146398.db2.gz CCLOBOQETWEXBO-JTQLQIEISA-N 1 1 270.760 3.869 20 5 CHBDMO C[N@@H+](CCCC(C)(F)F)CCc1ccccc1[N+](=O)[O-] ZINC000930438883 1128318894 /nfs/dbraw/zinc/31/88/94/1128318894.db2.gz DUIGGCQYPJLETK-UHFFFAOYSA-N 1 1 286.322 3.505 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000562057256 1128375045 /nfs/dbraw/zinc/37/50/45/1128375045.db2.gz SEIBDFAPEWIIFV-ZDUSSCGKSA-N 1 1 264.369 3.648 20 5 CHBDMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CCCCCC1 ZINC000916995241 1128467253 /nfs/dbraw/zinc/46/72/53/1128467253.db2.gz IAQAVGVYDNPWRF-UHFFFAOYSA-N 1 1 280.343 3.889 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2cccnc2)C1 ZINC000564081519 1128492409 /nfs/dbraw/zinc/49/24/09/1128492409.db2.gz WOFLUAGZGPDZFJ-ZFWWWQNUSA-N 1 1 297.358 3.540 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)[C@H]2CCSC2)cc1[N+](=O)[O-] ZINC000130567184 1128586419 /nfs/dbraw/zinc/58/64/19/1128586419.db2.gz LDQIBJIFTJAJST-ZDUSSCGKSA-N 1 1 294.420 3.656 20 5 CHBDMO CC1(C)C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]2CCC[C@@H]21 ZINC000557055458 1128664262 /nfs/dbraw/zinc/66/42/62/1128664262.db2.gz NEUDQBYXNCUSSX-NWDGAFQWSA-N 1 1 280.393 3.667 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000609766669 1128725474 /nfs/dbraw/zinc/72/54/74/1128725474.db2.gz AEJKBDZHCUQNDT-LBPRGKRZSA-N 1 1 280.343 3.746 20 5 CHBDMO Cc1ccc(CC[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000609894439 1128731433 /nfs/dbraw/zinc/73/14/33/1128731433.db2.gz KFUJCJJXNJVSFO-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO COCC(C)(C)[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000430149493 1117781977 /nfs/dbraw/zinc/78/19/77/1117781977.db2.gz WBHCTWUZEJVZSP-UHFFFAOYSA-N 1 1 294.395 3.575 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610215475 1117882270 /nfs/dbraw/zinc/88/22/70/1117882270.db2.gz YFNVAUZJTUMUNJ-NEPJUHHUSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1c(C[N@H+]2C[C@H](C)CCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000610215378 1117882390 /nfs/dbraw/zinc/88/23/90/1117882390.db2.gz JQAJFDHREYJADX-CHWSQXEVSA-N 1 1 276.380 3.914 20 5 CHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000610215477 1117882666 /nfs/dbraw/zinc/88/26/66/1117882666.db2.gz YFNVAUZJTUMUNJ-RYUDHWBXSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC(C)=C[C@H](C)C1 ZINC000430265390 1117957210 /nfs/dbraw/zinc/95/72/10/1117957210.db2.gz DSFAAZINVCMNGW-FZMZJTMJSA-N 1 1 274.364 3.862 20 5 CHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCCC1 ZINC000083168698 1118243532 /nfs/dbraw/zinc/24/35/32/1118243532.db2.gz NPVUXUGCABUYBU-UHFFFAOYSA-N 1 1 289.335 3.501 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1Nc1cccc2[nH+]cn(C)c21 ZINC001211290243 1118498040 /nfs/dbraw/zinc/49/80/40/1118498040.db2.gz VAOZROCUVFAKQH-UHFFFAOYSA-N 1 1 282.303 3.534 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H]2CC=CCC2)C2CC2)c1 ZINC000215663528 1118915670 /nfs/dbraw/zinc/91/56/70/1118915670.db2.gz ZLHKXOMTLAVLDI-CQSZACIVSA-N 1 1 286.375 3.916 20 5 CHBDMO CCC[C@]1(C)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001167508870 1118968675 /nfs/dbraw/zinc/96/86/75/1118968675.db2.gz JLUAUGADUSBKOL-MRXNPFEDSA-N 1 1 276.380 3.997 20 5 CHBDMO C[C@H](c1ccccc1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051428221 1119007571 /nfs/dbraw/zinc/00/75/71/1119007571.db2.gz LYDDJHHJTGYGMC-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051428221 1119007576 /nfs/dbraw/zinc/00/75/76/1119007576.db2.gz LYDDJHHJTGYGMC-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO CC(C)SCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000338276223 1119061566 /nfs/dbraw/zinc/06/15/66/1119061566.db2.gz BPAOBPSRGRAXFC-UHFFFAOYSA-N 1 1 294.420 3.701 20 5 CHBDMO CCCC[C@H](C)[N@H+](C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000562059280 1119092259 /nfs/dbraw/zinc/09/22/59/1119092259.db2.gz YDQBFHJXEDPYEM-JTQLQIEISA-N 1 1 286.322 3.884 20 5 CHBDMO CCC1CCC([N@@H+](C)Cc2cc([O-])ccc2[N+](=O)[O-])CC1 ZINC001167586402 1119120229 /nfs/dbraw/zinc/12/02/29/1119120229.db2.gz MJSCNWADIYRUFP-UHFFFAOYSA-N 1 1 292.379 3.701 20 5 CHBDMO Cc1occc1C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000414450595 1120058159 /nfs/dbraw/zinc/05/81/59/1120058159.db2.gz GQQXVOSQIUVILC-UHFFFAOYSA-N 1 1 274.320 3.521 20 5 CHBDMO Nc1[nH+]cccc1Nc1cccc2nc3ccccc3nc21 ZINC001212404060 1120064314 /nfs/dbraw/zinc/06/43/14/1120064314.db2.gz JQFZRFDQROVUFU-UHFFFAOYSA-N 1 1 287.326 3.504 20 5 CHBDMO C[C@@H](c1cccnc1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000350390727 1120074861 /nfs/dbraw/zinc/07/48/61/1120074861.db2.gz KZWLLEZXCVFUJX-PIZKADEWSA-N 1 1 297.358 3.696 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)CC[C@H]1C ZINC000542701425 1120121813 /nfs/dbraw/zinc/12/18/13/1120121813.db2.gz FDIKXQCYPQTBHL-DGCLKSJQSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000542700437 1120123339 /nfs/dbraw/zinc/12/33/39/1120123339.db2.gz RTZGYYVFMFPOJB-UHFFFAOYSA-N 1 1 284.359 3.925 20 5 CHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC1CC1 ZINC000542932451 1120260377 /nfs/dbraw/zinc/26/03/77/1120260377.db2.gz ATAGDKWVTDMVPL-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@@H](c1ccco1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255049519 1120315406 /nfs/dbraw/zinc/31/54/06/1120315406.db2.gz WTQFZRGHUAGMGT-UJZCVKTISA-N 1 1 286.331 3.894 20 5 CHBDMO C[N@@H+](CCCc1ccsc1)Cc1ccccc1[N+](=O)[O-] ZINC000543020094 1120371080 /nfs/dbraw/zinc/37/10/80/1120371080.db2.gz HQVSPZPFKSODSR-UHFFFAOYSA-N 1 1 290.388 3.721 20 5 CHBDMO C[C@H]1CCC[N@@H+](CCCCNc2sccc2[N+](=O)[O-])C1 ZINC000301984654 1120512170 /nfs/dbraw/zinc/51/21/70/1120512170.db2.gz IZHSLCCVUDMPLD-LBPRGKRZSA-N 1 1 297.424 3.580 20 5 CHBDMO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000092328218 1120541362 /nfs/dbraw/zinc/54/13/62/1120541362.db2.gz XTAQETAOWVSBRD-NXEZZACHSA-N 1 1 289.335 3.611 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000511855395 1120665856 /nfs/dbraw/zinc/66/58/56/1120665856.db2.gz OAPZQBQDEIWROY-SJIIUEBRSA-N 1 1 286.375 3.873 20 5 CHBDMO CCC[C@@H]([NH2+]Cc1cc(C)no1)c1cccc([N+](=O)[O-])c1 ZINC000044986229 1120742600 /nfs/dbraw/zinc/74/26/00/1120742600.db2.gz NTZIXMJQPCMOLG-OAHLLOKOSA-N 1 1 289.335 3.522 20 5 CHBDMO Cc1c(C[N@H+]([C@H](C)C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000047909009 1120797438 /nfs/dbraw/zinc/79/74/38/1120797438.db2.gz NIYMGDHRNYNZNF-GFCCVEGCSA-N 1 1 274.364 3.666 20 5 CHBDMO CCCC[N@@H+](CC)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000216453206 1121334998 /nfs/dbraw/zinc/33/49/98/1121334998.db2.gz RQGVYZABRMWNIC-LBPRGKRZSA-N 1 1 250.342 3.778 20 5 CHBDMO C[C@H]1CC2(CCC2)C[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000433020748 1121519980 /nfs/dbraw/zinc/51/99/80/1121519980.db2.gz DIVYSIPSQKBRST-GBXSZLQWSA-N 1 1 286.375 3.873 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C1CCCCC1 ZINC000543628255 1121533701 /nfs/dbraw/zinc/53/37/01/1121533701.db2.gz NTFZDCUQVMGWNH-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO CC(C)C[C@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000466719580 1121565509 /nfs/dbraw/zinc/56/55/09/1121565509.db2.gz XHKVXIYDKZTZGI-OAHLLOKOSA-N 1 1 276.380 3.505 20 5 CHBDMO CCC[C@@H]1CCCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000542628570 1121716212 /nfs/dbraw/zinc/71/62/12/1121716212.db2.gz WARORVPTYKGRQI-CQSZACIVSA-N 1 1 292.379 3.758 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C(C)(C)C ZINC001182042577 1122106174 /nfs/dbraw/zinc/10/61/74/1122106174.db2.gz ADRFMDJAPQNQFU-UHFFFAOYSA-N 1 1 270.760 3.869 20 5 CHBDMO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000016420707 1122120770 /nfs/dbraw/zinc/12/07/70/1122120770.db2.gz FJJPZLHARLDDPE-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000016420707 1122120774 /nfs/dbraw/zinc/12/07/74/1122120774.db2.gz FJJPZLHARLDDPE-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH+]2CC(C3CCCC3)C2)cc1Cl ZINC001182216868 1122123180 /nfs/dbraw/zinc/12/31/80/1122123180.db2.gz VKSNIVNMRCVRFV-UHFFFAOYSA-N 1 1 294.782 3.870 20 5 CHBDMO Cc1cn2cc(Nc3ccc(C)cc3[N+](=O)[O-])ccc2[nH+]1 ZINC000514171816 1122384360 /nfs/dbraw/zinc/38/43/60/1122384360.db2.gz HUIGGGZORQSTAI-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO CC(C)[C@H]1[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CC12CCC2 ZINC000430095692 1122403539 /nfs/dbraw/zinc/40/35/39/1122403539.db2.gz NPHAVFSNIZWWMY-OAHLLOKOSA-N 1 1 292.354 3.744 20 5 CHBDMO CC(C)[C@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC12CCC2 ZINC000430095692 1122403541 /nfs/dbraw/zinc/40/35/41/1122403541.db2.gz NPHAVFSNIZWWMY-OAHLLOKOSA-N 1 1 292.354 3.744 20 5 CHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505629599 1122442702 /nfs/dbraw/zinc/44/27/02/1122442702.db2.gz BGZQURSKWCLZKL-BXUZGUMPSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[C@@H]1C[C@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001190529224 1122541956 /nfs/dbraw/zinc/54/19/56/1122541956.db2.gz PLVXNNDXRFYIHI-CABCVRRESA-N 1 1 276.380 3.851 20 5 CHBDMO Cc1ccc(C[N@H+](C)C2(C)CCCC2)cc1[N+](=O)[O-] ZINC000426500636 1122806768 /nfs/dbraw/zinc/80/67/68/1122806768.db2.gz VIPRSKZDBXMBPN-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](C3CCC3)C2)c(F)c1 ZINC001196253845 1122913207 /nfs/dbraw/zinc/91/32/07/1122913207.db2.gz HZFSBRDHRLEYQD-CYBMUJFWSA-N 1 1 292.354 3.746 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000507026620 1122920313 /nfs/dbraw/zinc/92/03/13/1122920313.db2.gz PFRAGUODDUWZHW-GFCCVEGCSA-N 1 1 250.342 3.524 20 5 CHBDMO Cc1cc(C[N@@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1F ZINC000507151804 1122932450 /nfs/dbraw/zinc/93/24/50/1122932450.db2.gz KYTMETLURGWTQP-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1cc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])ccc1F ZINC000507151804 1122932453 /nfs/dbraw/zinc/93/24/53/1122932453.db2.gz KYTMETLURGWTQP-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1C ZINC000507169614 1122934830 /nfs/dbraw/zinc/93/48/30/1122934830.db2.gz JPORSFGJFRGCEL-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)C(C)C ZINC000520564848 1123175831 /nfs/dbraw/zinc/17/58/31/1123175831.db2.gz YLFGGMNFNQKQTE-ZDUSSCGKSA-N 1 1 294.395 3.858 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000444747533 1124058395 /nfs/dbraw/zinc/05/83/95/1124058395.db2.gz AIBXRNUGZAZSFJ-HNNXBMFYSA-N 1 1 276.380 3.505 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000444764890 1124060982 /nfs/dbraw/zinc/06/09/82/1124060982.db2.gz COOGOZBUJZLIPE-LBPRGKRZSA-N 1 1 280.343 3.602 20 5 CHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]3C3CC3)o2)cc1 ZINC000449425034 1124734202 /nfs/dbraw/zinc/73/42/02/1124734202.db2.gz MAZCNTRRUWOAHP-INIZCTEOSA-N 1 1 298.342 3.839 20 5 CHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccco3)C2)cc1 ZINC000449498384 1124773356 /nfs/dbraw/zinc/77/33/56/1124773356.db2.gz KJOYGSVTQJJDDX-CQSZACIVSA-N 1 1 286.331 3.567 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000124847440 1124822412 /nfs/dbraw/zinc/82/24/12/1124822412.db2.gz BNWFIJBECUQGOX-CYBMUJFWSA-N 1 1 280.343 3.889 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000531378683 1125212986 /nfs/dbraw/zinc/21/29/86/1125212986.db2.gz JNOMWEJNEZFAPO-SUMWQHHRSA-N 1 1 282.343 3.788 20 5 CHBDMO Cc1cncc([C@@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000879748373 1125230576 /nfs/dbraw/zinc/23/05/76/1125230576.db2.gz ICWLMFRAYJEEBT-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1cncc([C@@H]2CCC[N@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000879748373 1125230583 /nfs/dbraw/zinc/23/05/83/1125230583.db2.gz ICWLMFRAYJEEBT-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1c(F)cccc1F ZINC000037772004 1129266847 /nfs/dbraw/zinc/26/68/47/1129266847.db2.gz MCOGMWATPPTESA-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000743272049 1129518831 /nfs/dbraw/zinc/51/88/31/1129518831.db2.gz LZWGSLXSQSFTPX-NSHDSACASA-N 1 1 268.332 3.600 20 5 CHBDMO C[C@H](c1ccccc1Cl)[N@@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169049593 1129691912 /nfs/dbraw/zinc/69/19/12/1129691912.db2.gz WQKLLLDQLUOGOR-UPJWGTAASA-N 1 1 296.798 3.778 20 5 CHBDMO OCC[N@@H+](Cc1c2ccccc2cc2ccccc21)C1CC1 ZINC000768330160 1129851613 /nfs/dbraw/zinc/85/16/13/1129851613.db2.gz NZTYPSUWMUXBLL-UHFFFAOYSA-N 1 1 291.394 3.950 20 5 CHBDMO CC(C)[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000746656456 1130135338 /nfs/dbraw/zinc/13/53/38/1130135338.db2.gz YYDQANDFFICQEA-UHFFFAOYSA-N 1 1 268.744 3.621 20 5 CHBDMO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@H]1C1CC1 ZINC000811513700 1130619842 /nfs/dbraw/zinc/61/98/42/1130619842.db2.gz MOHHJQQXQNRCLY-AWEZNQCLSA-N 1 1 294.782 3.869 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@H]1C1CC1 ZINC000811513700 1130619845 /nfs/dbraw/zinc/61/98/45/1130619845.db2.gz MOHHJQQXQNRCLY-AWEZNQCLSA-N 1 1 294.782 3.869 20 5 CHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783569074 1130839696 /nfs/dbraw/zinc/83/96/96/1130839696.db2.gz AZCDDLPPHGBXDZ-CMPLNLGQSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)C[C@@H]1N ZINC001236094177 1130857705 /nfs/dbraw/zinc/85/77/05/1130857705.db2.gz RNGKSBPXCWTTST-VLIAUNLRSA-N 1 1 290.410 3.772 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@@H]1N ZINC001236094177 1130857711 /nfs/dbraw/zinc/85/77/11/1130857711.db2.gz RNGKSBPXCWTTST-VLIAUNLRSA-N 1 1 290.410 3.772 20 5 CHBDMO CC(C)[C@H]1CCCC[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000217229249 1130920402 /nfs/dbraw/zinc/92/04/02/1130920402.db2.gz DEVLHQRZMIDTFA-CQSZACIVSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccccn2)C1 ZINC000799193238 1131075380 /nfs/dbraw/zinc/07/53/80/1131075380.db2.gz MFESSYTUKCUMPJ-UONOGXRCSA-N 1 1 297.358 3.540 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1C ZINC000816648932 1131120988 /nfs/dbraw/zinc/12/09/88/1131120988.db2.gz QWSOHKLWVIDRFC-RYUDHWBXSA-N 1 1 286.331 3.695 20 5 CHBDMO Cc1ccc(Nc2ccc3[nH]c[nH+]c3c2)cc1[N+](=O)[O-] ZINC001160224173 1131423017 /nfs/dbraw/zinc/42/30/17/1131423017.db2.gz PQDGFFKEVOAVQL-UHFFFAOYSA-N 1 1 268.276 3.523 20 5 CHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](Cc3ccoc3)C2)cc1 ZINC000824820797 1131485879 /nfs/dbraw/zinc/48/58/79/1131485879.db2.gz NEWWPBYDFNEAEA-OAHLLOKOSA-N 1 1 286.331 3.567 20 5 CHBDMO C[N@H+]1CCC[C@H](Oc2nccc3c4ccccc4ccc32)C1 ZINC001230203230 1132159509 /nfs/dbraw/zinc/15/95/09/1132159509.db2.gz KBDRXYHHPJARIQ-HNNXBMFYSA-N 1 1 292.382 3.861 20 5 CHBDMO CC[N@H+](Cc1occc1C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000839662620 1132229291 /nfs/dbraw/zinc/22/92/91/1132229291.db2.gz IRJIZAIBPDNAFE-UHFFFAOYSA-N 1 1 292.310 3.657 20 5 CHBDMO CC[N@@H+](Cc1occc1C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000839662620 1132229297 /nfs/dbraw/zinc/22/92/97/1132229297.db2.gz IRJIZAIBPDNAFE-UHFFFAOYSA-N 1 1 292.310 3.657 20 5 CHBDMO CCCC[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172909397 1132371311 /nfs/dbraw/zinc/37/13/11/1132371311.db2.gz RNCKRZSHACGUKS-HNNXBMFYSA-N 1 1 276.380 3.574 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173227272 1132412324 /nfs/dbraw/zinc/41/23/24/1132412324.db2.gz PCMQEMFNLUJDPH-OAHLLOKOSA-N 1 1 298.386 3.966 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)C[C@H]1C ZINC001173227601 1132412515 /nfs/dbraw/zinc/41/25/15/1132412515.db2.gz RFTMWBBNKNTULO-MCIONIFRSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCc1ccccc1 ZINC001173229888 1132414278 /nfs/dbraw/zinc/41/42/78/1132414278.db2.gz WBCABZYIBKESJG-HNNXBMFYSA-N 1 1 298.386 3.700 20 5 CHBDMO CC(C)C[N@@H+](C)Cc1ccc2ccc3cccnc3c2n1 ZINC001232219037 1132439088 /nfs/dbraw/zinc/43/90/88/1132439088.db2.gz LXEUJUWUZCFCFG-UHFFFAOYSA-N 1 1 279.387 3.871 20 5 CHBDMO Cc1cc(C)c(COc2ccc([N+](=O)[O-])cc2F)c(C)[nH+]1 ZINC001165532553 1133244298 /nfs/dbraw/zinc/24/42/98/1133244298.db2.gz YBCOVJKAIQUILW-UHFFFAOYSA-N 1 1 290.294 3.633 20 5 CHBDMO Cc1c(C[N@H+]2CC(C)(C)[C@@H]2C2CC2)cccc1[N+](=O)[O-] ZINC001206117075 1133660406 /nfs/dbraw/zinc/66/04/06/1133660406.db2.gz XSFWAGLTDDSJQH-HNNXBMFYSA-N 1 1 274.364 3.524 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000080266578 260179203 /nfs/dbraw/zinc/17/92/03/260179203.db2.gz LVOGURVSNGLRHA-GHMZBOCLSA-N 1 1 291.376 3.772 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1c1cccs1 ZINC000015301425 260362568 /nfs/dbraw/zinc/36/25/68/260362568.db2.gz WMUBNOHUPRYFKD-AWEZNQCLSA-N 1 1 288.372 3.993 20 5 CHBDMO Cc1c(Cn2c[nH+]c3c2C[C@@H](C)[C@@H](C)C3)cccc1[N+](=O)[O-] ZINC000319241065 262187638 /nfs/dbraw/zinc/18/76/38/262187638.db2.gz MPJYBSWVYNYXLH-NWDGAFQWSA-N 1 1 299.374 3.519 20 5 CHBDMO Cc1ccnc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000285496549 263093528 /nfs/dbraw/zinc/09/35/28/263093528.db2.gz APIMMMTZXDQPJQ-STQMWFEESA-N 1 1 285.347 3.710 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1F ZINC000094953037 265279170 /nfs/dbraw/zinc/27/91/70/265279170.db2.gz GUSQRMOKYYWDED-SNVBAGLBSA-N 1 1 294.351 3.955 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1CNc1ccc(C2CCC2)c[nH+]1 ZINC000339572373 328011732 /nfs/dbraw/zinc/01/17/32/328011732.db2.gz RHKOEFOGWRAFOA-UHFFFAOYSA-N 1 1 297.358 3.600 20 5 CHBDMO CC[C@H](C)C[N@@H+](CC)Cc1csc([N+](=O)[O-])c1 ZINC000177858155 329192960 /nfs/dbraw/zinc/19/29/60/329192960.db2.gz PGLNEPSJQFKWAE-JTQLQIEISA-N 1 1 256.371 3.524 20 5 CHBDMO C[C@H](C1CC1)[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000255713868 327006960 /nfs/dbraw/zinc/00/69/60/327006960.db2.gz PCIALLMDNUDLTL-RYWCDNDXSA-N 1 1 286.375 3.871 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CCc2cccs2)cc1[N+](=O)[O-] ZINC000093685405 327199208 /nfs/dbraw/zinc/19/92/08/327199208.db2.gz URMIYCPCAZYJSP-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000037494486 328800287 /nfs/dbraw/zinc/80/02/87/328800287.db2.gz AYJJGQFHRHABPG-NSHDSACASA-N 1 1 274.295 3.585 20 5 CHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000174352884 329157544 /nfs/dbraw/zinc/15/75/44/329157544.db2.gz KSQKMLOTRUSIDM-KGLIPLIRSA-N 1 1 294.420 3.701 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)cs1 ZINC000177187981 329181691 /nfs/dbraw/zinc/18/16/91/329181691.db2.gz RLCOAYAAQJYDRG-RYUDHWBXSA-N 1 1 298.433 3.516 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCS[C@H]3CCCC[C@@H]32)cs1 ZINC000177187981 329181692 /nfs/dbraw/zinc/18/16/92/329181692.db2.gz RLCOAYAAQJYDRG-RYUDHWBXSA-N 1 1 298.433 3.516 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCC2(CC2)C1 ZINC000186994108 329352919 /nfs/dbraw/zinc/35/29/19/329352919.db2.gz QXOPIHATJCCBIG-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCCC2(CC2)C1 ZINC000186994108 329352920 /nfs/dbraw/zinc/35/29/20/329352920.db2.gz QXOPIHATJCCBIG-UHFFFAOYSA-N 1 1 280.755 3.624 20 5 CHBDMO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000188878199 329373982 /nfs/dbraw/zinc/37/39/82/329373982.db2.gz FWMHENYBLGLPCK-OAHLLOKOSA-N 1 1 298.342 3.517 20 5 CHBDMO CC(C)[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CCCC1 ZINC000108364201 330353659 /nfs/dbraw/zinc/35/36/59/330353659.db2.gz IFKQTFXWDGOAMQ-UHFFFAOYSA-N 1 1 268.382 3.809 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(F)cc(Cl)c1 ZINC000160924035 330879805 /nfs/dbraw/zinc/87/98/05/330879805.db2.gz BSOCWQNRGQSMMN-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO C[C@@H](F)CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451553152 331033926 /nfs/dbraw/zinc/03/39/26/331033926.db2.gz XPYAJBMUILJVJM-OCCSQVGLSA-N 1 1 280.343 3.522 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)CCc1ccccc1 ZINC000489122271 332041919 /nfs/dbraw/zinc/04/19/19/332041919.db2.gz JOXOSAVULMCUPV-AWEZNQCLSA-N 1 1 284.359 3.830 20 5 CHBDMO COc1cc(C[N@H+]2C[C@H](C)CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000490029442 332077213 /nfs/dbraw/zinc/07/72/13/332077213.db2.gz KIMCXNCUPXRCHA-CHWSQXEVSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CCCOC(C)C ZINC000490091341 332081067 /nfs/dbraw/zinc/08/10/67/332081067.db2.gz XDKYAWFIZSKYFD-CQSZACIVSA-N 1 1 294.395 3.711 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C2CC2)[C@@H]2C=CCCC2)cc1 ZINC000490838908 332118986 /nfs/dbraw/zinc/11/89/86/332118986.db2.gz BITDPEGDICMFHI-CQSZACIVSA-N 1 1 272.348 3.668 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000491092442 332147917 /nfs/dbraw/zinc/14/79/17/332147917.db2.gz SODCCINZBSUBBV-NSHDSACASA-N 1 1 280.343 3.743 20 5 CHBDMO CCOc1cc(C[N@H+]2CCCC[C@@H]2CC)ccc1[N+](=O)[O-] ZINC000492374238 332394646 /nfs/dbraw/zinc/39/46/46/332394646.db2.gz HFMPRIHVKSIHSY-AWEZNQCLSA-N 1 1 292.379 3.758 20 5 CHBDMO CCCC[N@@H+](CC)Cc1ccc([N+](=O)[O-])c(OCC)c1 ZINC000492415825 332396413 /nfs/dbraw/zinc/39/64/13/332396413.db2.gz HRXJCIKMXWYCQM-UHFFFAOYSA-N 1 1 280.368 3.616 20 5 CHBDMO Cc1cc(NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000517393909 333098792 /nfs/dbraw/zinc/09/87/92/333098792.db2.gz WBYBMXPXSZGCLR-OKILXGFUSA-N 1 1 291.395 3.578 20 5 CHBDMO CC(C)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000521821770 333190296 /nfs/dbraw/zinc/19/02/96/333190296.db2.gz VFCFCXRFSXOMDZ-UHFFFAOYSA-N 1 1 276.380 3.995 20 5 CHBDMO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2C2CCCC2)cc1 ZINC000522269175 333277313 /nfs/dbraw/zinc/27/73/13/333277313.db2.gz YXLYLBLZJUYCMH-KRWDZBQOSA-N 1 1 288.391 3.792 20 5 CHBDMO CC[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCC1 ZINC000524594070 333367693 /nfs/dbraw/zinc/36/76/93/333367693.db2.gz DNIBDEDBVGIRNF-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H](CC2CC2)C1 ZINC000550032835 334211649 /nfs/dbraw/zinc/21/16/49/334211649.db2.gz ZBERDLNXWTWHGK-LBPRGKRZSA-N 1 1 294.782 3.870 20 5 CHBDMO C[C@@H](C[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000551012151 334236307 /nfs/dbraw/zinc/23/63/07/334236307.db2.gz LZURDPIZHNJOLG-HNNXBMFYSA-N 1 1 298.386 3.873 20 5 CHBDMO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000181362738 335759190 /nfs/dbraw/zinc/75/91/90/335759190.db2.gz MVLFIXAHHUPLGB-NSHDSACASA-N 1 1 297.314 3.587 20 5 CHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000381386867 336060948 /nfs/dbraw/zinc/06/09/48/336060948.db2.gz LVAUVDLMQIQQPN-XHDPSFHLSA-N 1 1 280.343 3.744 20 5 CHBDMO C[C@@H]1C[C@H](C)[C@@H](C)[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000355078910 533817436 /nfs/dbraw/zinc/81/74/36/533817436.db2.gz BVVKVBWRXAHYFW-OUAUKWLOSA-N 1 1 268.382 3.523 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H](C)CC2)cc1[N+](=O)[O-] ZINC000352801685 533924110 /nfs/dbraw/zinc/92/41/10/533924110.db2.gz TZCAQTLXUJBASE-GFCCVEGCSA-N 1 1 262.353 3.525 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC000507114825 533928422 /nfs/dbraw/zinc/92/84/22/533928422.db2.gz CGRLDUJVDKGXBG-CQSZACIVSA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1cnc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000122938296 518191615 /nfs/dbraw/zinc/19/16/15/518191615.db2.gz ROAIENWFPKNABA-NSHDSACASA-N 1 1 291.376 3.519 20 5 CHBDMO CSC[C@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000292453508 525706579 /nfs/dbraw/zinc/70/65/79/525706579.db2.gz PQTBXNRCVVKRHP-STQMWFEESA-N 1 1 294.420 3.731 20 5 CHBDMO Cc1ccoc1C[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000292368412 525795900 /nfs/dbraw/zinc/79/59/00/525795900.db2.gz QUHSBTICDCOMDM-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccoc1C[N@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000292368412 525795911 /nfs/dbraw/zinc/79/59/11/525795911.db2.gz QUHSBTICDCOMDM-GFCCVEGCSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccoc1C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000292368413 525797668 /nfs/dbraw/zinc/79/76/68/525797668.db2.gz QUHSBTICDCOMDM-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1ccoc1C[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000292368413 525797675 /nfs/dbraw/zinc/79/76/75/525797675.db2.gz QUHSBTICDCOMDM-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000509155324 1121069374 /nfs/dbraw/zinc/06/93/74/1121069374.db2.gz RYWJLQUAEWSSHM-NSHDSACASA-N 1 1 268.332 3.600 20 5 CHBDMO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)n1 ZINC000159881292 1126755999 /nfs/dbraw/zinc/75/59/99/1126755999.db2.gz IGYIESNDYXJVAW-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1cccc([C@H]2CCC[N@H+]2Cc2cccc([N+](=O)[O-])c2)n1 ZINC000159881292 1126756001 /nfs/dbraw/zinc/75/60/01/1126756001.db2.gz IGYIESNDYXJVAW-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO COc1cc(C[N@H+]2CCCC[C@@H]2C(C)C)ccc1[N+](=O)[O-] ZINC000485554230 1126925291 /nfs/dbraw/zinc/92/52/91/1126925291.db2.gz UTYFCJBSMGSSDD-CQSZACIVSA-N 1 1 292.379 3.614 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1ccc([N+](=O)[O-])cc1F ZINC000588978447 1127209333 /nfs/dbraw/zinc/20/93/33/1127209333.db2.gz NVPPRNIWRMWREM-UHFFFAOYSA-N 1 1 268.332 3.744 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](C3CC3)C2)c(Cl)c1 ZINC000588977723 1127209035 /nfs/dbraw/zinc/20/90/35/1127209035.db2.gz GPAIBIWJGFTOHU-GFCCVEGCSA-N 1 1 294.782 3.870 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000589209280 1127216032 /nfs/dbraw/zinc/21/60/32/1127216032.db2.gz BQERHARHQDWWIM-OAHLLOKOSA-N 1 1 274.364 3.525 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC(C2CC2)CC1 ZINC000590006851 1127242760 /nfs/dbraw/zinc/24/27/60/1127242760.db2.gz VOHLAHXYYPMOLM-UHFFFAOYSA-N 1 1 294.782 3.870 20 5 CHBDMO CC(C)[C@H]1[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CC1(C)C ZINC000590372246 1127256855 /nfs/dbraw/zinc/25/68/55/1127256855.db2.gz ZITFLEWEROGMNI-CQSZACIVSA-N 1 1 280.343 3.600 20 5 CHBDMO CC(C)[C@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC1(C)C ZINC000590372246 1127256858 /nfs/dbraw/zinc/25/68/58/1127256858.db2.gz ZITFLEWEROGMNI-CQSZACIVSA-N 1 1 280.343 3.600 20 5 CHBDMO CC(C)CC[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000057627040 1127269241 /nfs/dbraw/zinc/26/92/41/1127269241.db2.gz GLSCTKVJUHOGIV-GFCCVEGCSA-N 1 1 250.342 3.634 20 5 CHBDMO Cc1ccc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC001168400616 1127298637 /nfs/dbraw/zinc/29/86/37/1127298637.db2.gz BZSOBHUPGSWDDL-IMJJTQAJSA-N 1 1 288.391 3.914 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1C[C@@H]1c1ccccc1 ZINC000355218369 1127326335 /nfs/dbraw/zinc/32/63/35/1127326335.db2.gz HTDDJLDHQPRIQI-NVXWUHKLSA-N 1 1 282.343 3.583 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccsc1 ZINC000595006194 1127445899 /nfs/dbraw/zinc/44/58/99/1127445899.db2.gz GXSCEVQXDRVSRP-SNVBAGLBSA-N 1 1 292.360 3.516 20 5 CHBDMO O=[N+]([O-])c1cc(F)ccc1C[NH2+]C1(c2ccccc2)CC1 ZINC000595416398 1127461511 /nfs/dbraw/zinc/46/15/11/1127461511.db2.gz WVUSJTUNBRXHHL-UHFFFAOYSA-N 1 1 286.306 3.513 20 5 CHBDMO Cc1noc(C[NH+]2CCC(C)(CC(C)C)CC2)c1[N+](=O)[O-] ZINC000595499304 1127464300 /nfs/dbraw/zinc/46/43/00/1127464300.db2.gz WGNTYHPSBCSFCZ-UHFFFAOYSA-N 1 1 295.383 3.539 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CC1=CCSC1 ZINC000595889690 1127479969 /nfs/dbraw/zinc/47/99/69/1127479969.db2.gz VKNHAMRTMAKPEY-LBPRGKRZSA-N 1 1 292.404 3.569 20 5 CHBDMO CCCCC[C@@H]1CCCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-] ZINC000595870734 1127480033 /nfs/dbraw/zinc/48/00/33/1127480033.db2.gz KCZYFOYQZUZDEX-CYBMUJFWSA-N 1 1 295.383 3.826 20 5 CHBDMO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H]4C[C@H]4C3)o2)c1 ZINC000597222050 1127536734 /nfs/dbraw/zinc/53/67/34/1127536734.db2.gz BNHPTGMBXKVFAP-JSGCOSHPSA-N 1 1 298.342 3.697 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+]([C@H]1C[C@H]1c1ccccc1)CC2 ZINC000361314805 1127556334 /nfs/dbraw/zinc/55/63/34/1127556334.db2.gz SLCOROYBYXIPIY-ROUUACIJSA-N 1 1 294.354 3.509 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC12CCCC2 ZINC000593646403 1127647613 /nfs/dbraw/zinc/64/76/13/1127647613.db2.gz WGZRJSAFSJMHFK-FNORWQNLSA-N 1 1 272.348 3.627 20 5 CHBDMO Cc1ccc(C[N@@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])s1 ZINC000171160011 1127692011 /nfs/dbraw/zinc/69/20/11/1127692011.db2.gz REBQXKMZBTYBLJ-UHFFFAOYSA-N 1 1 294.351 3.736 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])s1 ZINC000171160011 1127692014 /nfs/dbraw/zinc/69/20/14/1127692014.db2.gz REBQXKMZBTYBLJ-UHFFFAOYSA-N 1 1 294.351 3.736 20 5 CHBDMO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1CCC1 ZINC000230313508 1127750658 /nfs/dbraw/zinc/75/06/58/1127750658.db2.gz XIKAOOKDOUBWNA-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO CCS[C@H]1CC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000076067355 1127931792 /nfs/dbraw/zinc/93/17/92/1127931792.db2.gz BUOSZHWXDDITOR-CABCVRRESA-N 1 1 294.420 3.701 20 5 CHBDMO Cc1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000539827068 1127945254 /nfs/dbraw/zinc/94/52/54/1127945254.db2.gz WDLUVIJUQPEHSO-GASCZTMLSA-N 1 1 274.364 3.525 20 5 CHBDMO C[N@H+](Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774224 1127956004 /nfs/dbraw/zinc/95/60/04/1127956004.db2.gz XDDWJKBKJXBTDN-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO C[N@@H+](Cc1cccc(F)c1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774224 1127956008 /nfs/dbraw/zinc/95/60/08/1127956008.db2.gz XDDWJKBKJXBTDN-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO CC(C)(C)[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000544188333 1127962981 /nfs/dbraw/zinc/96/29/81/1127962981.db2.gz YEIGUEFPFNLQAO-CQSZACIVSA-N 1 1 276.380 3.505 20 5 CHBDMO CCCC[C@@H](CC)C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000545517333 1128018903 /nfs/dbraw/zinc/01/89/03/1128018903.db2.gz LFGBOJYMVIYUCD-CYBMUJFWSA-N 1 1 291.395 3.564 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470173822 1128064936 /nfs/dbraw/zinc/06/49/36/1128064936.db2.gz GCONPAXSKGHBMN-NRMKIYEFSA-N 1 1 274.364 3.873 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H]2[C@H](C1)C2(C)C ZINC000470184730 1128065430 /nfs/dbraw/zinc/06/54/30/1128065430.db2.gz WNZDCHDDSDZOLQ-WOVASVFFSA-N 1 1 286.375 3.586 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](C2CC2)C1 ZINC000470179226 1128065517 /nfs/dbraw/zinc/06/55/17/1128065517.db2.gz URHSLBGGJUBKFZ-RCBBPTIPSA-N 1 1 286.375 3.730 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCCC2(CC2)C1 ZINC000470214494 1128065931 /nfs/dbraw/zinc/06/59/31/1128065931.db2.gz PKBCBNKGJYSXND-UVTDQMKNSA-N 1 1 286.375 3.874 20 5 CHBDMO CC(C)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761514358 1128132817 /nfs/dbraw/zinc/13/28/17/1128132817.db2.gz IACHBXXQHMSMDC-GFCCVEGCSA-N 1 1 282.771 3.726 20 5 CHBDMO C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC(C)(C)C ZINC000493279201 1128137709 /nfs/dbraw/zinc/13/77/09/1128137709.db2.gz HLEFNEMKELUJND-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])CC(C)(C)C ZINC000493279201 1128137713 /nfs/dbraw/zinc/13/77/13/1128137713.db2.gz HLEFNEMKELUJND-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609195428 1128170775 /nfs/dbraw/zinc/17/07/75/1128170775.db2.gz ORDLVCDIBNYRGF-CQSZACIVSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[C@H](C)[C@H](C)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000609204312 1128173672 /nfs/dbraw/zinc/17/36/72/1128173672.db2.gz FTASCVBBXDRLPF-STQMWFEESA-N 1 1 276.380 3.994 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000563782848 1128478509 /nfs/dbraw/zinc/47/85/09/1128478509.db2.gz ODTXIGVJYUNEJC-GFCCVEGCSA-N 1 1 280.368 3.614 20 5 CHBDMO Cc1ccc(C[N@H+]2CC(C)(C)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000568810341 1128592296 /nfs/dbraw/zinc/59/22/96/1128592296.db2.gz NNIVYCHDZDTKFN-OAHLLOKOSA-N 1 1 274.364 3.524 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@H](CC2CC2)C1 ZINC000556958668 1128651788 /nfs/dbraw/zinc/65/17/88/1128651788.db2.gz JZJFWKVQMFEKTO-UYWPIULCSA-N 1 1 286.375 3.730 20 5 CHBDMO Cc1cc(C)c(CSc2ccc([N+](=O)[O-])cn2)c(C)[nH+]1 ZINC000601080040 1128696772 /nfs/dbraw/zinc/69/67/72/1128696772.db2.gz GVROGKWMEHMYAC-UHFFFAOYSA-N 1 1 289.360 3.602 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1 ZINC000072555221 1117762155 /nfs/dbraw/zinc/76/21/55/1117762155.db2.gz RVBHUEBHNYAHFJ-ZDUSSCGKSA-N 1 1 270.332 3.788 20 5 CHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610001967 1128734113 /nfs/dbraw/zinc/73/41/13/1128734113.db2.gz PVAFRERVEVUQMX-CJNGLKHVSA-N 1 1 276.380 3.995 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000072630849 1117781837 /nfs/dbraw/zinc/78/18/37/1117781837.db2.gz ABDXCMVHHVKULL-NEPJUHHUSA-N 1 1 250.342 3.634 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215375 1117882964 /nfs/dbraw/zinc/88/29/64/1117882964.db2.gz JIPDYLPUUDZLAQ-OLZOCXBDSA-N 1 1 262.353 3.605 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCCC[C@@H]1C ZINC000430240068 1117908662 /nfs/dbraw/zinc/90/86/62/1117908662.db2.gz CBMBWCJDINZAEM-WFASDCNBSA-N 1 1 292.379 3.614 20 5 CHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)C(C)C ZINC000083173906 1117961598 /nfs/dbraw/zinc/96/15/98/1117961598.db2.gz UMRCRKVLMHLUGL-NSHDSACASA-N 1 1 291.351 3.602 20 5 CHBDMO C[C@H]1C[C@H](c2cccnc2)[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000359864336 1118006956 /nfs/dbraw/zinc/00/69/56/1118006956.db2.gz ABOSACPGDLRGCB-SUMWQHHRSA-N 1 1 297.358 3.573 20 5 CHBDMO O=[N+]([O-])c1cccc(Nc2ccc3c[nH+]ccc3c2)c1 ZINC001204456968 1118086847 /nfs/dbraw/zinc/08/68/47/1118086847.db2.gz QQOGIZDQUOXNCU-UHFFFAOYSA-N 1 1 265.272 3.887 20 5 CHBDMO CC(C)c1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)on1 ZINC000610420538 1118421473 /nfs/dbraw/zinc/42/14/73/1118421473.db2.gz OUZJPMRQMXLOHT-LLVKDONJSA-N 1 1 289.335 3.557 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1ccccc1 ZINC000050508411 1118505037 /nfs/dbraw/zinc/50/50/37/1118505037.db2.gz UFZOVAVFXUTPDZ-AWEZNQCLSA-N 1 1 284.359 3.830 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001167457717 1118574525 /nfs/dbraw/zinc/57/45/25/1118574525.db2.gz JFHGEJBNFGSBLF-CQSZACIVSA-N 1 1 280.343 3.889 20 5 CHBDMO Cc1c(C[N@H+](C)C(C2CC2)C2CC2)cccc1[N+](=O)[O-] ZINC000050988757 1118595742 /nfs/dbraw/zinc/59/57/42/1118595742.db2.gz DDJMMVLAUCLFKO-UHFFFAOYSA-N 1 1 274.364 3.524 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CC=CCC2)C2CC2)cc1 ZINC000215663774 1118915778 /nfs/dbraw/zinc/91/57/78/1118915778.db2.gz DPMUOXYVSSEMEK-CQSZACIVSA-N 1 1 286.375 3.916 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H]2CC=CCC2)C2CC2)c1 ZINC000215663579 1118916028 /nfs/dbraw/zinc/91/60/28/1118916028.db2.gz ZLHKXOMTLAVLDI-AWEZNQCLSA-N 1 1 286.375 3.916 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511059948 1118995446 /nfs/dbraw/zinc/99/54/46/1118995446.db2.gz PXYWKEUYOHHWOP-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO CCC[C@@H](C)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000051686148 1119084635 /nfs/dbraw/zinc/08/46/35/1119084635.db2.gz LXZRLEBZHDDOHK-LLVKDONJSA-N 1 1 250.342 3.524 20 5 CHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000219701654 1119511314 /nfs/dbraw/zinc/51/13/14/1119511314.db2.gz GCPYBZDXSAHDSB-TZMCWYRMSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1cccc(F)c1 ZINC000066562822 1119913007 /nfs/dbraw/zinc/91/30/07/1119913007.db2.gz GGIHEFFQJHUVPN-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1F ZINC000066562650 1119913203 /nfs/dbraw/zinc/91/32/03/1119913203.db2.gz UTHFEJHAPZKIMO-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1F ZINC000066562650 1119913205 /nfs/dbraw/zinc/91/32/05/1119913205.db2.gz UTHFEJHAPZKIMO-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(NCCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000094659346 1120053594 /nfs/dbraw/zinc/05/35/94/1120053594.db2.gz JOBBTRYWDNDKMB-CQSZACIVSA-N 1 1 291.395 3.580 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CC1CCCC1 ZINC000542698761 1120122198 /nfs/dbraw/zinc/12/21/98/1120122198.db2.gz AHKLHQBHNAFKML-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c(F)c1 ZINC000313853440 1120153991 /nfs/dbraw/zinc/15/39/91/1120153991.db2.gz SXSKYOGUPODDLC-LRDDRELGSA-N 1 1 292.354 3.889 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]3CCCC[C@H]32)c(F)c1 ZINC000313853443 1120413525 /nfs/dbraw/zinc/41/35/25/1120413525.db2.gz SXSKYOGUPODDLC-MLGOLLRUSA-N 1 1 292.354 3.889 20 5 CHBDMO Cc1ccc(C[N@H+](C)C(C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000092704011 1120546066 /nfs/dbraw/zinc/54/60/66/1120546066.db2.gz SLWMPLARNLYMDM-UHFFFAOYSA-N 1 1 274.364 3.524 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000302754090 1120657040 /nfs/dbraw/zinc/65/70/40/1120657040.db2.gz ZNOODGQOSSLVAM-XQQFMLRXSA-N 1 1 262.353 3.634 20 5 CHBDMO CC(C)c1ccc(C[N@H+]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000511954967 1120864978 /nfs/dbraw/zinc/86/49/78/1120864978.db2.gz DBDKHASBCWYXGF-GFCCVEGCSA-N 1 1 262.353 3.560 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CC3)CC2)cc1F ZINC000702594002 1121206029 /nfs/dbraw/zinc/20/60/29/1121206029.db2.gz GZUKNBHUWCGRJB-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H]1CC(C)C ZINC000500483497 1121285291 /nfs/dbraw/zinc/28/52/91/1121285291.db2.gz YIZWCPRBOGZSCU-CQSZACIVSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)cc1[N+](=O)[O-] ZINC000512653193 1121509636 /nfs/dbraw/zinc/50/96/36/1121509636.db2.gz VGMYTIWHJKWOGZ-DGCLKSJQSA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@@H]2CC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000433035689 1121532816 /nfs/dbraw/zinc/53/28/16/1121532816.db2.gz NRGAOLBONJSEKA-BXUZGUMPSA-N 1 1 262.353 3.524 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000611271343 1121633333 /nfs/dbraw/zinc/63/33/33/1121633333.db2.gz SNRPIEXWYVGVTP-OMVNSRBRSA-N 1 1 298.342 3.691 20 5 CHBDMO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000542978197 1121744890 /nfs/dbraw/zinc/74/48/90/1121744890.db2.gz WXCRPCWFMKQGKU-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1ccc[nH+]c1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000130983311 1129009948 /nfs/dbraw/zinc/00/99/48/1129009948.db2.gz PBQJNPOWWSEFLT-UHFFFAOYSA-N 1 1 277.711 3.564 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1cccn1C ZINC000183238358 1129035329 /nfs/dbraw/zinc/03/53/29/1129035329.db2.gz LTOZBYPRNYSQMG-KRWDZBQOSA-N 1 1 299.374 3.579 20 5 CHBDMO Cc1[nH+]c2cc(Nc3ccsc3[N+](=O)[O-])ccc2n1C ZINC001185518849 1122345891 /nfs/dbraw/zinc/34/58/91/1122345891.db2.gz QEPSNTVDTVKCHY-UHFFFAOYSA-N 1 1 288.332 3.595 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1CCCCC1 ZINC000505309219 1122356155 /nfs/dbraw/zinc/35/61/55/1122356155.db2.gz ZOMGIFQBNSLEPC-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000514086982 1122375222 /nfs/dbraw/zinc/37/52/22/1122375222.db2.gz DYERJIIXNFGNRQ-AWEZNQCLSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000515544529 1122507571 /nfs/dbraw/zinc/50/75/71/1122507571.db2.gz XXXYKSQVZONYAU-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO C[N@H+](C/C=C\c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000515547137 1122509353 /nfs/dbraw/zinc/50/93/53/1122509353.db2.gz PREYGDLNRDOWRM-YFHOEESVSA-N 1 1 282.343 3.740 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000515547137 1122509356 /nfs/dbraw/zinc/50/93/56/1122509356.db2.gz PREYGDLNRDOWRM-YFHOEESVSA-N 1 1 282.343 3.740 20 5 CHBDMO CCCC[N@@H+](CC)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000505842323 1122556306 /nfs/dbraw/zinc/55/63/06/1122556306.db2.gz HSFZWHBJCAWOAR-UHFFFAOYSA-N 1 1 250.342 3.525 20 5 CHBDMO Cc1c(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC001192481526 1122649628 /nfs/dbraw/zinc/64/96/28/1122649628.db2.gz NCVPHPDEZOWGAS-XGWLTEMNSA-N 1 1 288.391 3.914 20 5 CHBDMO CC(C)CC[N@@H+](Cc1csc([N+](=O)[O-])c1)C1CC1 ZINC000054174220 1122792489 /nfs/dbraw/zinc/79/24/89/1122792489.db2.gz SXZQGNWIZSBVFM-UHFFFAOYSA-N 1 1 268.382 3.667 20 5 CHBDMO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000426524699 1122813139 /nfs/dbraw/zinc/81/31/39/1122813139.db2.gz PNQPWWYAGKGMAB-GXFFZTMASA-N 1 1 280.755 3.623 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1CC=CCC1 ZINC000506741885 1122819019 /nfs/dbraw/zinc/81/90/19/1122819019.db2.gz CARHOOMEKFPMDU-KBPBESRZSA-N 1 1 274.364 3.944 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000506741887 1122819633 /nfs/dbraw/zinc/81/96/33/1122819633.db2.gz CARHOOMEKFPMDU-UONOGXRCSA-N 1 1 274.364 3.944 20 5 CHBDMO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000507109789 1122925860 /nfs/dbraw/zinc/92/58/60/1122925860.db2.gz GURGTNNDMSJPBF-UHFFFAOYSA-N 1 1 288.372 3.918 20 5 CHBDMO Cc1cc(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)ccc1F ZINC000507146470 1122929296 /nfs/dbraw/zinc/92/92/96/1122929296.db2.gz WYVDNOLYELIXHD-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO C[C@H](c1cccnc1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183730498 1129090565 /nfs/dbraw/zinc/09/05/65/1129090565.db2.gz KZWLLEZXCVFUJX-VIIAAUOXSA-N 1 1 297.358 3.696 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](c3ccccc3)C2)c1 ZINC000507665544 1122984146 /nfs/dbraw/zinc/98/41/46/1122984146.db2.gz KVDFQOFNDHNEAZ-MRXNPFEDSA-N 1 1 282.343 3.584 20 5 CHBDMO C[C@@H](Cc1ccsc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC000081599883 1122986178 /nfs/dbraw/zinc/98/61/78/1122986178.db2.gz WVXPZIXCAHCBGT-LBPRGKRZSA-N 1 1 290.388 3.719 20 5 CHBDMO Cc1ccc(C[N@H+]([C@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000508010813 1123255026 /nfs/dbraw/zinc/25/50/26/1123255026.db2.gz ZOSMCHYKQXBWMS-GFCCVEGCSA-N 1 1 274.364 3.666 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351754499 1123278810 /nfs/dbraw/zinc/27/88/10/1123278810.db2.gz FRXQLPMBGAREBR-VHSXEESVSA-N 1 1 284.306 3.636 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000351754499 1123278813 /nfs/dbraw/zinc/27/88/13/1123278813.db2.gz FRXQLPMBGAREBR-VHSXEESVSA-N 1 1 284.306 3.636 20 5 CHBDMO C[C@@H](O)C[N@@H+](C)Cc1c2ccccc2cc2ccccc21 ZINC000776520797 1123345815 /nfs/dbraw/zinc/34/58/15/1123345815.db2.gz GQTAPFYPLPOXTR-CQSZACIVSA-N 1 1 279.383 3.806 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783547703 1123749220 /nfs/dbraw/zinc/74/92/20/1123749220.db2.gz UOSQNPZARNKDER-LLVKDONJSA-N 1 1 268.744 3.623 20 5 CHBDMO COc1ccc(C[N@@H+](CC2CCC2)C(C)C)cc1[N+](=O)[O-] ZINC000444769506 1124061037 /nfs/dbraw/zinc/06/10/37/1124061037.db2.gz ZXAXSCDTYJNXFV-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CCc1cccs1 ZINC000525266916 1124120350 /nfs/dbraw/zinc/12/03/50/1124120350.db2.gz ZTDVSTMVLVSAPO-GFCCVEGCSA-N 1 1 290.388 3.892 20 5 CHBDMO COc1ccc(C[N@H+]2C[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000525637969 1124451701 /nfs/dbraw/zinc/45/17/01/1124451701.db2.gz MRVFYOWGTOFCKZ-CHWSQXEVSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1C ZINC000525636064 1124452044 /nfs/dbraw/zinc/45/20/44/1124452044.db2.gz DBJLNJRZWIYSKV-QWRGUYRKSA-N 1 1 282.771 3.869 20 5 CHBDMO Cc1ccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872018174 1124657730 /nfs/dbraw/zinc/65/77/30/1124657730.db2.gz IQDFCNAMVJRULG-LBPRGKRZSA-N 1 1 288.322 3.893 20 5 CHBDMO CCC(C)(C)OCC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872078914 1124676960 /nfs/dbraw/zinc/67/69/60/1124676960.db2.gz UJCBOCASPMEQKV-LLVKDONJSA-N 1 1 298.358 3.590 20 5 CHBDMO C[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000530902742 1125185728 /nfs/dbraw/zinc/18/57/28/1125185728.db2.gz ZYRZRRBTLHDHLS-CXAGYDPISA-N 1 1 282.343 3.788 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000530902742 1125185730 /nfs/dbraw/zinc/18/57/30/1125185730.db2.gz ZYRZRRBTLHDHLS-CXAGYDPISA-N 1 1 282.343 3.788 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000531378681 1125212592 /nfs/dbraw/zinc/21/25/92/1125212592.db2.gz JNOMWEJNEZFAPO-DYVFJYSZSA-N 1 1 282.343 3.788 20 5 CHBDMO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C(C1CC1)C1CC1 ZINC000735490633 1129348804 /nfs/dbraw/zinc/34/88/04/1129348804.db2.gz MDIMUGBDWSZDGE-UHFFFAOYSA-N 1 1 294.782 3.869 20 5 CHBDMO Cc1cccc(C)c1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000738308991 1129392943 /nfs/dbraw/zinc/39/29/43/1129392943.db2.gz JJPJUQDZFDOCJS-UHFFFAOYSA-N 1 1 284.359 3.844 20 5 CHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094774536 1129451705 /nfs/dbraw/zinc/45/17/05/1129451705.db2.gz JTDHEEBWYRQVLH-YPMHNXCESA-N 1 1 280.343 3.744 20 5 CHBDMO CC[C@]1(C)CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743860677 1129541078 /nfs/dbraw/zinc/54/10/78/1129541078.db2.gz POPJFUNYLOFZIV-OAHLLOKOSA-N 1 1 280.343 3.746 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000303529717 1129546759 /nfs/dbraw/zinc/54/67/59/1129546759.db2.gz FORHGTGTOUTXSV-KRWDZBQOSA-N 1 1 286.375 3.917 20 5 CHBDMO C[N@@H+](Cc1cccc2ccccc21)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169023260 1129691207 /nfs/dbraw/zinc/69/12/07/1129691207.db2.gz DVLVVPWEWHUEEV-WMLDXEAASA-N 1 1 298.386 3.717 20 5 CHBDMO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCCC[C@H]2c2ccccc2)C1 ZINC001169051997 1129692697 /nfs/dbraw/zinc/69/26/97/1129692697.db2.gz FIPBYULVNOJYAP-UAGQMJEPSA-N 1 1 288.391 3.659 20 5 CHBDMO CC(C)(C)[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801516031 1129923363 /nfs/dbraw/zinc/92/33/63/1129923363.db2.gz QKMHHPJZLMYILY-CQSZACIVSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801518479 1129923443 /nfs/dbraw/zinc/92/34/43/1129923443.db2.gz JLATUTWSMUQJOQ-HNNXBMFYSA-N 1 1 280.343 3.746 20 5 CHBDMO C[C@@H]1CCC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801517197 1129923604 /nfs/dbraw/zinc/92/36/04/1129923604.db2.gz BHFVYVKSCQFPDI-NEPJUHHUSA-N 1 1 280.343 3.744 20 5 CHBDMO C[N@@H+](CCSC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC000801910988 1129958291 /nfs/dbraw/zinc/95/82/91/1129958291.db2.gz REOQICHHRGQSSB-UHFFFAOYSA-N 1 1 282.409 3.558 20 5 CHBDMO CC(C)C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CC1 ZINC000746653142 1130133870 /nfs/dbraw/zinc/13/38/70/1130133870.db2.gz CKFKMHPLVZPILY-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788480510 1130189930 /nfs/dbraw/zinc/18/99/30/1130189930.db2.gz KXKCNHWOGPDNFW-KYOSRNDESA-N 1 1 292.354 3.887 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000782502359 1130780227 /nfs/dbraw/zinc/78/02/27/1130780227.db2.gz FQYSQQLOPCQYIP-XFJVYGCCSA-N 1 1 292.354 3.744 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CC(C)(C)C1 ZINC001171086746 1131511699 /nfs/dbraw/zinc/51/16/99/1131511699.db2.gz JMBSIQLMWNRHRP-UHFFFAOYSA-N 1 1 280.343 3.744 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@H+]1CCC12COC2 ZINC001141728100 1132242091 /nfs/dbraw/zinc/24/20/91/1132242091.db2.gz LKLSNVHFDMFNDY-UHFFFAOYSA-N 1 1 289.378 3.968 20 5 CHBDMO c1ccc2c(c1)cc1ccccc1c2C[N@@H+]1C[C@H]2C[C@@H](C1)O2 ZINC001141728586 1132242735 /nfs/dbraw/zinc/24/27/35/1132242735.db2.gz YMQNVIVBNJGQIW-CALCHBBNSA-N 1 1 289.378 3.966 20 5 CHBDMO CC1(C)CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172915900 1132359963 /nfs/dbraw/zinc/35/99/63/1132359963.db2.gz PNQCJTPNDNRQMD-HNNXBMFYSA-N 1 1 288.391 3.574 20 5 CHBDMO C[N@@H+]([C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)C(C)(C)C ZINC001172910333 1132372172 /nfs/dbraw/zinc/37/21/72/1132372172.db2.gz LQEKPLULDHCAKC-CQSZACIVSA-N 1 1 276.380 3.573 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@](C)(F)C1 ZINC001173221382 1132411589 /nfs/dbraw/zinc/41/15/89/1132411589.db2.gz HWZZSYPPQUDEEH-CJNGLKHVSA-N 1 1 294.370 3.740 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC001173226221 1132412476 /nfs/dbraw/zinc/41/24/76/1132412476.db2.gz LJFSCTQPGJUUNC-VXGBXAGGSA-N 1 1 298.333 3.503 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC(C)(C)C ZINC001173227255 1132412545 /nfs/dbraw/zinc/41/25/45/1132412545.db2.gz OYBXFHUPMXBJAG-LBPRGKRZSA-N 1 1 264.369 3.504 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001173223102 1132412809 /nfs/dbraw/zinc/41/28/09/1132412809.db2.gz XRQXYDQSGOXQRC-FVQBIDKESA-N 1 1 288.391 3.648 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](C(F)F)C1 ZINC001173225688 1132412836 /nfs/dbraw/zinc/41/28/36/1132412836.db2.gz FISJPSFCCSNFIS-YPMHNXCESA-N 1 1 298.333 3.503 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC2(CCC2)C1 ZINC001173230196 1132413736 /nfs/dbraw/zinc/41/37/36/1132413736.db2.gz COQVRXXHZHMBSC-CQSZACIVSA-N 1 1 288.391 3.792 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC001173231817 1132414333 /nfs/dbraw/zinc/41/43/33/1132414333.db2.gz NKEMCYFJAOZGFC-HZSPNIEDSA-N 1 1 276.380 3.504 20 5 CHBDMO CC[C@@H]1CCC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173235814 1132415565 /nfs/dbraw/zinc/41/55/65/1132415565.db2.gz ZNDHNLDBGBKYGL-UONOGXRCSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@@H]1F ZINC001232219386 1132439175 /nfs/dbraw/zinc/43/91/75/1132439175.db2.gz TUBMEUCLTBJUDO-WBMJQRKESA-N 1 1 295.361 3.573 20 5 CHBDMO C[C@@]1([NH3+])CCN(Cc2c3ccccc3cc3ccccc32)C1 ZINC001204782626 1133485078 /nfs/dbraw/zinc/48/50/78/1133485078.db2.gz HPCNLLNTLVCKMO-HXUWFJFHSA-N 1 1 290.410 3.916 20 5 CHBDMO C[C@@]1(N)CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001204782626 1133485082 /nfs/dbraw/zinc/48/50/82/1133485082.db2.gz HPCNLLNTLVCKMO-HXUWFJFHSA-N 1 1 290.410 3.916 20 5 CHBDMO C[C@@]1(N)CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC001204782626 1133485083 /nfs/dbraw/zinc/48/50/83/1133485083.db2.gz HPCNLLNTLVCKMO-HXUWFJFHSA-N 1 1 290.410 3.916 20 5 CHBDMO Cc1[nH+]c2ccccn2c1Nc1ccc(C)cc1[N+](=O)[O-] ZINC001214167600 1134515421 /nfs/dbraw/zinc/51/54/21/1134515421.db2.gz OTJMVUIGIDTCCD-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO CC(C)[N@H+]1CCC[C@H](O[C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC001224024710 1135411950 /nfs/dbraw/zinc/41/19/50/1135411950.db2.gz KTKVZOWWGQXVPR-CJNGLKHVSA-N 1 1 292.379 3.545 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccco2)cc1[N+](=O)[O-] ZINC000035738644 172392576 /nfs/dbraw/zinc/39/25/76/172392576.db2.gz ZCEOUOYASHCEBI-VXGBXAGGSA-N 1 1 274.320 3.908 20 5 CHBDMO Cc1c(C[N@H+](C)[C@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000519968898 260035572 /nfs/dbraw/zinc/03/55/72/260035572.db2.gz UFZFOHOFEHLEQK-WFASDCNBSA-N 1 1 276.380 3.914 20 5 CHBDMO CC[N@@H+](Cc1ccccn1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182843597 261952600 /nfs/dbraw/zinc/95/26/00/261952600.db2.gz XDMREOYXKSRBPD-CQSZACIVSA-N 1 1 299.374 3.881 20 5 CHBDMO Cc1ccnc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000285496544 263093402 /nfs/dbraw/zinc/09/34/02/263093402.db2.gz APIMMMTZXDQPJQ-QWHCGFSZSA-N 1 1 285.347 3.710 20 5 CHBDMO CC(C)c1ccc(C[NH+]2CC(CC(F)F)C2)cc1[N+](=O)[O-] ZINC000425366200 264211947 /nfs/dbraw/zinc/21/19/47/264211947.db2.gz OQMHHYLXZLKCLB-UHFFFAOYSA-N 1 1 298.333 3.805 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000357034051 266236501 /nfs/dbraw/zinc/23/65/01/266236501.db2.gz GYSJCHNXDJFLRX-ZDUSSCGKSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000049577200 328372680 /nfs/dbraw/zinc/37/26/80/328372680.db2.gz BAEWTMPWJDDFTP-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccccc1[N+](=O)[O-] ZINC000049577199 328372702 /nfs/dbraw/zinc/37/27/02/328372702.db2.gz BAEWTMPWJDDFTP-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO CCC[N@@H+](CC)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000559049735 327138916 /nfs/dbraw/zinc/13/89/16/327138916.db2.gz XFGHRKVYJZPKPL-UHFFFAOYSA-N 1 1 290.285 3.846 20 5 CHBDMO Cc1sccc1C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000560457992 327309718 /nfs/dbraw/zinc/30/97/18/327309718.db2.gz XYERNBKKLWRTFR-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1sccc1C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000560457992 327309720 /nfs/dbraw/zinc/30/97/20/327309720.db2.gz XYERNBKKLWRTFR-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO CCc1cccnc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000507520976 332812047 /nfs/dbraw/zinc/81/20/47/332812047.db2.gz UVAXBLAKOPLPIJ-QWHCGFSZSA-N 1 1 299.374 3.964 20 5 CHBDMO CCS[C@@H]1CC[C@@H]([N@@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000174352876 329157583 /nfs/dbraw/zinc/15/75/83/329157583.db2.gz KSQKMLOTRUSIDM-ZIAGYGMSSA-N 1 1 294.420 3.701 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CC2)C1 ZINC000187002747 329351273 /nfs/dbraw/zinc/35/12/73/329351273.db2.gz SDUQYYWZTUFMIJ-LBPRGKRZSA-N 1 1 260.337 3.532 20 5 CHBDMO CC[C@@H]1C[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])C[C@@H](CC)O1 ZINC000420955978 329791106 /nfs/dbraw/zinc/79/11/06/329791106.db2.gz MKOHIPMKTKSGPT-MGPQQGTHSA-N 1 1 292.379 3.545 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC2(CCC2)C[C@@H]1C ZINC000432814562 330038015 /nfs/dbraw/zinc/03/80/15/330038015.db2.gz AUVUOYHLPDVQGE-ZDUSSCGKSA-N 1 1 274.364 3.668 20 5 CHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000036921793 330313805 /nfs/dbraw/zinc/31/38/05/330313805.db2.gz FLWPDSGXGROHIA-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO CCC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccn1 ZINC000089512085 330385671 /nfs/dbraw/zinc/38/56/71/330385671.db2.gz CZIJSWOQCKXFBU-AWEZNQCLSA-N 1 1 285.347 3.621 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC(F)(F)C1 ZINC000450941016 331008181 /nfs/dbraw/zinc/00/81/81/331008181.db2.gz PGVBZXYQBIRBKS-CYBMUJFWSA-N 1 1 298.333 3.505 20 5 CHBDMO CC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])CC(C)(C)C ZINC000463365338 331346595 /nfs/dbraw/zinc/34/65/95/331346595.db2.gz IXOHPLCQCWQZSL-UHFFFAOYSA-N 1 1 298.358 3.611 20 5 CHBDMO CC[N@@H+](CCc1cccs1)Cc1ccccc1[N+](=O)[O-] ZINC000488364194 332002110 /nfs/dbraw/zinc/00/21/10/332002110.db2.gz VAUCDYGNHRHVIC-UHFFFAOYSA-N 1 1 290.388 3.721 20 5 CHBDMO CC[N@@H+](CC(C)C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000488539015 332016221 /nfs/dbraw/zinc/01/62/21/332016221.db2.gz IAJZRKIHEIZRIJ-GFCCVEGCSA-N 1 1 250.342 3.634 20 5 CHBDMO CC[N@@H+](CC(C)C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000488597221 332020014 /nfs/dbraw/zinc/02/00/14/332020014.db2.gz ZONIVHQYAFHQMH-LBPRGKRZSA-N 1 1 250.342 3.634 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C1CC1 ZINC000491092441 332147963 /nfs/dbraw/zinc/14/79/63/332147963.db2.gz SODCCINZBSUBBV-LLVKDONJSA-N 1 1 280.343 3.743 20 5 CHBDMO CCOc1cc(C[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000492419045 332396591 /nfs/dbraw/zinc/39/65/91/332396591.db2.gz TYOYEWONYWVRDU-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000247305311 334278780 /nfs/dbraw/zinc/27/87/80/334278780.db2.gz GTJYGIXPFIYVCY-SFHVURJKSA-N 1 1 296.370 3.802 20 5 CHBDMO CC(C)C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000307832478 333017678 /nfs/dbraw/zinc/01/76/78/333017678.db2.gz LOIHFRQYOBIGTQ-GFCCVEGCSA-N 1 1 280.343 3.602 20 5 CHBDMO CC[C@@H](C)C[N@@H+](CC)Cc1ccc([N+](=O)[O-])cc1F ZINC000311403750 333067913 /nfs/dbraw/zinc/06/79/13/333067913.db2.gz GRHGJDJNJCSOAD-LLVKDONJSA-N 1 1 268.332 3.602 20 5 CHBDMO CC[N@@H+](CC1CC1)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000182782672 333117607 /nfs/dbraw/zinc/11/76/07/333117607.db2.gz KJLCBLRIHUMLCY-GFCCVEGCSA-N 1 1 262.353 3.696 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC2(CCC2)C1 ZINC000182844564 333117843 /nfs/dbraw/zinc/11/78/43/333117843.db2.gz JEJPFOFTWSCUMT-ZDUSSCGKSA-N 1 1 274.364 3.840 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCC1CC1 ZINC000182916972 333118211 /nfs/dbraw/zinc/11/82/11/333118211.db2.gz QFSOSGJWDFFODW-LBPRGKRZSA-N 1 1 262.353 3.696 20 5 CHBDMO C[C@@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000522466259 333287394 /nfs/dbraw/zinc/28/73/94/333287394.db2.gz IGCYBEARAOFYAP-PBHICJAKSA-N 1 1 296.370 3.973 20 5 CHBDMO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC1CCCC1 ZINC000523857922 333348137 /nfs/dbraw/zinc/34/81/37/333348137.db2.gz IJWJETWFVRMWGB-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000524766853 333387686 /nfs/dbraw/zinc/38/76/86/333387686.db2.gz XKBWFUUUHKTDBD-HNNXBMFYSA-N 1 1 262.353 3.607 20 5 CHBDMO Cc1cnc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000135158973 334118256 /nfs/dbraw/zinc/11/82/56/334118256.db2.gz RHDKOEPMYQDXAX-QWRGUYRKSA-N 1 1 291.376 3.772 20 5 CHBDMO CCC[N@@H+](CC)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000552208977 334303324 /nfs/dbraw/zinc/30/33/24/334303324.db2.gz KTIIKASEYFNLGD-UHFFFAOYSA-N 1 1 280.368 3.614 20 5 CHBDMO CO[C@@]1(C)CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000280495955 523809086 /nfs/dbraw/zinc/80/90/86/523809086.db2.gz MOKFQNORUOMEGB-CJNGLKHVSA-N 1 1 292.379 3.547 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccsc1 ZINC000061363411 525459991 /nfs/dbraw/zinc/45/99/91/525459991.db2.gz LKTTXOXZDVAZHI-JTQLQIEISA-N 1 1 292.360 3.516 20 5 CHBDMO CSC[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000292353687 525706954 /nfs/dbraw/zinc/70/69/54/525706954.db2.gz HONKQYYCTMDVFB-STQMWFEESA-N 1 1 294.420 3.731 20 5 CHBDMO CSC[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000292353679 525708400 /nfs/dbraw/zinc/70/84/00/525708400.db2.gz HONKQYYCTMDVFB-OLZOCXBDSA-N 1 1 294.420 3.731 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC(F)(F)[C@H](C)C1 ZINC000289647968 526107656 /nfs/dbraw/zinc/10/76/56/526107656.db2.gz DPNWYLLAMMMXHU-MNOVXSKESA-N 1 1 284.306 3.633 20 5 CHBDMO CC(C)[C@H]1CC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000135191160 1125581067 /nfs/dbraw/zinc/58/10/67/1125581067.db2.gz RMAFREHOFWTVKO-LBPRGKRZSA-N 1 1 282.771 3.726 20 5 CHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC000483120508 1126767527 /nfs/dbraw/zinc/76/75/27/1126767527.db2.gz UJOPONADPYSTJY-NSHDSACASA-N 1 1 280.343 3.744 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000179680324 1126831508 /nfs/dbraw/zinc/83/15/08/1126831508.db2.gz AYBJCOQMESJUHP-UHFFFAOYSA-N 1 1 286.306 3.513 20 5 CHBDMO Cc1ccsc1C[N@@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000589183623 1127215665 /nfs/dbraw/zinc/21/56/65/1127215665.db2.gz AJWAWANAYWNFHX-UHFFFAOYSA-N 1 1 290.388 3.639 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1CNc1cc(C2CC2)cc[nH+]1 ZINC000353073937 1127260547 /nfs/dbraw/zinc/26/05/47/1127260547.db2.gz RJCMBRUVBBCYLR-UHFFFAOYSA-N 1 1 283.331 3.788 20 5 CHBDMO CC[N@@H+](CCC1CC1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000760889884 1127316509 /nfs/dbraw/zinc/31/65/09/1127316509.db2.gz WMXQXGPNPYERSR-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO CC[N@@H+](CCSC)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000592204056 1127345145 /nfs/dbraw/zinc/34/51/45/1127345145.db2.gz QZAZEPAENDCWHV-LBPRGKRZSA-N 1 1 282.409 3.649 20 5 CHBDMO C[C@H]1CC[C@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000359293440 1127456873 /nfs/dbraw/zinc/45/68/73/1127456873.db2.gz FLEHWNOBCZSDNQ-BBRMVZONSA-N 1 1 274.364 3.607 20 5 CHBDMO Cc1noc(C[N@@H+]2CCCCC[C@H]2CC(C)C)c1[N+](=O)[O-] ZINC000595334817 1127458858 /nfs/dbraw/zinc/45/88/58/1127458858.db2.gz WBLGJIHMUGZYMN-ZDUSSCGKSA-N 1 1 295.383 3.682 20 5 CHBDMO CC(C)c1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)on1 ZINC000169273620 1127502445 /nfs/dbraw/zinc/50/24/45/1127502445.db2.gz YWIZFMOIRIAZPY-LLVKDONJSA-N 1 1 289.335 3.557 20 5 CHBDMO Cc1ccc2c(c1)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)C2 ZINC000361114997 1127539520 /nfs/dbraw/zinc/53/95/20/1127539520.db2.gz VQPNMAJPRCUHQZ-UHFFFAOYSA-N 1 1 282.343 3.727 20 5 CHBDMO Cc1ccc2c(c1)C[N@H+](Cc1ccc([N+](=O)[O-])cc1C)C2 ZINC000361114997 1127539524 /nfs/dbraw/zinc/53/95/24/1127539524.db2.gz VQPNMAJPRCUHQZ-UHFFFAOYSA-N 1 1 282.343 3.727 20 5 CHBDMO CC(C)c1ccc(C[NH2+][C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000061014268 1127634549 /nfs/dbraw/zinc/63/45/49/1127634549.db2.gz ABPQWUVSTITJQF-ZDUSSCGKSA-N 1 1 299.374 3.964 20 5 CHBDMO CSc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000603424857 1127648600 /nfs/dbraw/zinc/64/86/00/1127648600.db2.gz QPOMZQKNWBWKPC-JTQLQIEISA-N 1 1 292.360 3.761 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599553514 1127680671 /nfs/dbraw/zinc/68/06/71/1127680671.db2.gz XYXICHFNSNRDEX-DFBGVHRSSA-N 1 1 292.404 3.626 20 5 CHBDMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC2(CC2)CC1 ZINC000599673305 1127685613 /nfs/dbraw/zinc/68/56/13/1127685613.db2.gz OKFYWMPYFUUORR-UHFFFAOYSA-N 1 1 278.327 3.500 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000604012898 1127689586 /nfs/dbraw/zinc/68/95/86/1127689586.db2.gz CNZMEIAHLGRYFB-MRXNPFEDSA-N 1 1 274.364 3.749 20 5 CHBDMO CCCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000604427986 1127705722 /nfs/dbraw/zinc/70/57/22/1127705722.db2.gz VBQCVDSSRKHUBV-UHFFFAOYSA-N 1 1 250.342 3.605 20 5 CHBDMO C[N@H+](Cc1cccc(Cl)c1)Cc1ccccc1[N+](=O)[O-] ZINC000061778799 1127716660 /nfs/dbraw/zinc/71/66/60/1127716660.db2.gz AXOXZGYCARJSMI-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO C[N@@H+](Cc1cccc(Cl)c1)Cc1ccccc1[N+](=O)[O-] ZINC000061778799 1127716663 /nfs/dbraw/zinc/71/66/63/1127716663.db2.gz AXOXZGYCARJSMI-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO Cc1c(C[N@@H+]2CCC[C@@H](C)CC2)cccc1[N+](=O)[O-] ZINC000063302475 1127811148 /nfs/dbraw/zinc/81/11/48/1127811148.db2.gz OSBHDKHXJVQWAD-GFCCVEGCSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@H]1C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000539826810 1127944599 /nfs/dbraw/zinc/94/45/99/1127944599.db2.gz ZBVOIPDTGWRQGG-FWPCIQOSSA-N 1 1 274.364 3.728 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]12 ZINC000543897982 1127952768 /nfs/dbraw/zinc/95/27/68/1127952768.db2.gz GHBHNVSRHPIAHA-KCXAZCMYSA-N 1 1 274.364 3.605 20 5 CHBDMO CC[C@@H]1C[C@@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000544612064 1127979402 /nfs/dbraw/zinc/97/94/02/1127979402.db2.gz XCLWUGLXMADCNQ-BXUZGUMPSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@@H](C)[N@@H+](CC)Cc1cccc([N+](=O)[O-])c1C ZINC000595592000 1128010266 /nfs/dbraw/zinc/01/02/66/1128010266.db2.gz AHVYFIDNUPBAHP-LLVKDONJSA-N 1 1 250.342 3.524 20 5 CHBDMO CC[C@@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000541773663 1128039106 /nfs/dbraw/zinc/03/91/06/1128039106.db2.gz HSMJCVFDTBCAFY-HNNXBMFYSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@H]1c2ccccc2OCC[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609145813 1128049681 /nfs/dbraw/zinc/04/96/81/1128049681.db2.gz QEWVFMPEESGIJH-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@H]1c2ccccc2OCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000609145813 1128049687 /nfs/dbraw/zinc/04/96/87/1128049687.db2.gz QEWVFMPEESGIJH-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542001322 1128047016 /nfs/dbraw/zinc/04/70/16/1128047016.db2.gz IIRASHYJFVSQOG-JTQLQIEISA-N 1 1 270.760 3.726 20 5 CHBDMO CCC(CC)[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CC1 ZINC000609144376 1128050982 /nfs/dbraw/zinc/05/09/82/1128050982.db2.gz RZIQYGMHSIZFOB-UHFFFAOYSA-N 1 1 280.343 3.887 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccoc1 ZINC000470173515 1128065057 /nfs/dbraw/zinc/06/50/57/1128065057.db2.gz CDKFWHTUPUZHSJ-JYRVWZFOSA-N 1 1 286.331 3.723 20 5 CHBDMO CCOc1cc(C[N@H+]2[C@H](C)CC[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492603725 1128105559 /nfs/dbraw/zinc/10/55/59/1128105559.db2.gz CGQNTPDDSIPKTK-TZMCWYRMSA-N 1 1 292.379 3.756 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@@H](C)C[C@H]2CC)ccc1[N+](=O)[O-] ZINC000492629927 1128106832 /nfs/dbraw/zinc/10/68/32/1128106832.db2.gz KZSJRYOLCYNSFO-GXTWGEPZSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@@H+](C)[C@H](C)C2CCC2)ccc1[N+](=O)[O-] ZINC000492748629 1128111909 /nfs/dbraw/zinc/11/19/09/1128111909.db2.gz NDGMWBJQLKRNHS-GFCCVEGCSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493354102 1128139290 /nfs/dbraw/zinc/13/92/90/1128139290.db2.gz BBEKFCKXHFUIIH-AOOOYVTPSA-N 1 1 268.744 3.621 20 5 CHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000609204310 1128173542 /nfs/dbraw/zinc/17/35/42/1128173542.db2.gz FTASCVBBXDRLPF-CHWSQXEVSA-N 1 1 276.380 3.994 20 5 CHBDMO CC[C@H](C)[C@@H](C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000609204553 1128173720 /nfs/dbraw/zinc/17/37/20/1128173720.db2.gz WAOSZAWMZYFBEC-QWHCGFSZSA-N 1 1 276.380 3.994 20 5 CHBDMO C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCCC1 ZINC000174813205 1128361350 /nfs/dbraw/zinc/36/13/50/1128361350.db2.gz ZQAXSFUYJVGTMU-UHFFFAOYSA-N 1 1 268.744 3.623 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000562057252 1128374929 /nfs/dbraw/zinc/37/49/29/1128374929.db2.gz SEIBDFAPEWIIFV-CYBMUJFWSA-N 1 1 264.369 3.648 20 5 CHBDMO C[C@H]1C[C@H](c2ccccc2)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609672507 1128721319 /nfs/dbraw/zinc/72/13/19/1128721319.db2.gz HLZRRCDVNYGBBU-YOEHRIQHSA-N 1 1 296.370 3.973 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705057 1128722677 /nfs/dbraw/zinc/72/26/77/1128722677.db2.gz LPPYOOYNJYTCGX-SNVBAGLBSA-N 1 1 270.760 3.726 20 5 CHBDMO CC[C@@H](C)[C@@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000610001920 1128734105 /nfs/dbraw/zinc/73/41/05/1128734105.db2.gz LZHPQYKFSHOUEW-HIFRSBDPSA-N 1 1 276.380 3.995 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCC(C)(C)C1 ZINC000430243852 1117913871 /nfs/dbraw/zinc/91/38/71/1117913871.db2.gz WBIBMYSKKJALLW-CQSZACIVSA-N 1 1 292.379 3.614 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000430280756 1117989579 /nfs/dbraw/zinc/98/95/79/1117989579.db2.gz YCORPJFFMDXTRF-DGCLKSJQSA-N 1 1 260.337 3.554 20 5 CHBDMO Cc1[nH+]c2cc(Nc3ccccc3[N+](=O)[O-])ccc2n1C ZINC000301419869 1118196516 /nfs/dbraw/zinc/19/65/16/1118196516.db2.gz DNOKJAPNHDXGPP-UHFFFAOYSA-N 1 1 282.303 3.534 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCCC[C@@H]2C(C)C)cc1[N+](=O)[O-] ZINC001167405237 1118460494 /nfs/dbraw/zinc/46/04/94/1118460494.db2.gz BDXRIJHAYXWVFN-OAHLLOKOSA-N 1 1 276.380 3.914 20 5 CHBDMO CC(C)[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1 ZINC000178004036 1118595452 /nfs/dbraw/zinc/59/54/52/1118595452.db2.gz ZLOMNJODGNRVMF-UHFFFAOYSA-N 1 1 268.744 3.621 20 5 CHBDMO CCn1ccc(C[N@@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000616737729 1128798102 /nfs/dbraw/zinc/79/81/02/1128798102.db2.gz FHAKECOFAHILEP-VURMDHGXSA-N 1 1 299.374 3.561 20 5 CHBDMO C[C@H](c1ccccc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000071951767 1118978187 /nfs/dbraw/zinc/97/81/87/1118978187.db2.gz JWKHAXNWBUZZEV-CQSZACIVSA-N 1 1 284.359 3.830 20 5 CHBDMO Cc1cn2cc(Nc3ccc([N+](=O)[O-])c(C)c3)ccc2[nH+]1 ZINC000540035761 1119026207 /nfs/dbraw/zinc/02/62/07/1119026207.db2.gz VGMNGMVZKRUYRY-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1C ZINC000479581066 1119124634 /nfs/dbraw/zinc/12/46/34/1119124634.db2.gz SONTVIJUWYQKAS-UHFFFAOYSA-N 1 1 284.359 3.925 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@@H]2C2CCC2)cccc1[N+](=O)[O-] ZINC000343016862 1119282141 /nfs/dbraw/zinc/28/21/41/1119282141.db2.gz YDZRNMBOTCFVAU-MRXNPFEDSA-N 1 1 274.364 3.668 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001167656135 1119302352 /nfs/dbraw/zinc/30/23/52/1119302352.db2.gz GRTCICMTZRLTIW-UHFFFAOYSA-N 1 1 280.343 3.746 20 5 CHBDMO CC(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000611774600 1119369416 /nfs/dbraw/zinc/36/94/16/1119369416.db2.gz DTZGFKNHULHOQW-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000219697410 1119511294 /nfs/dbraw/zinc/51/12/94/1119511294.db2.gz FINOUWLVCUQVAS-DOMZBBRYSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1occc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000414374394 1120004932 /nfs/dbraw/zinc/00/49/32/1120004932.db2.gz VISPOYFMHNGCLV-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO Cc1occc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000414374394 1120004936 /nfs/dbraw/zinc/00/49/36/1120004936.db2.gz VISPOYFMHNGCLV-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO CC[C@@H](C)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000481077478 1120264837 /nfs/dbraw/zinc/26/48/37/1120264837.db2.gz QEUZHCNFOMJOTG-GFCCVEGCSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@H](c1ccco1)[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255049518 1120315788 /nfs/dbraw/zinc/31/57/88/1120315788.db2.gz WTQFZRGHUAGMGT-DMTLFAOVSA-N 1 1 286.331 3.894 20 5 CHBDMO C[C@H](C[N@@H+](C)Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000066853534 1120595328 /nfs/dbraw/zinc/59/53/28/1120595328.db2.gz HSAQBXUTDARBIR-GFCCVEGCSA-N 1 1 290.388 3.892 20 5 CHBDMO C[C@H](Nc1ccc2c(c1)[nH+]cn2C)c1cccc([N+](=O)[O-])c1 ZINC000348803172 1120995735 /nfs/dbraw/zinc/99/57/35/1120995735.db2.gz PSOPVFUFYPSAMW-NSHDSACASA-N 1 1 296.330 3.655 20 5 CHBDMO C/C=C/C[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001175043990 1121157524 /nfs/dbraw/zinc/15/75/24/1121157524.db2.gz AYAJJOMMZZCGOK-WOMSROEHSA-N 1 1 288.391 3.816 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H]1CC(C)C ZINC000500483495 1121285574 /nfs/dbraw/zinc/28/55/74/1121285574.db2.gz YIZWCPRBOGZSCU-AWEZNQCLSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000042977624 1121321707 /nfs/dbraw/zinc/32/17/07/1121321707.db2.gz REJQLWNFJZFPQO-UHFFFAOYSA-N 1 1 270.332 3.535 20 5 CHBDMO C[C@@H]1CC[C@H]([N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000429583664 1121340844 /nfs/dbraw/zinc/34/08/44/1121340844.db2.gz KYVKCWABYDOPKX-MFKMUULPSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000509377979 1121559717 /nfs/dbraw/zinc/55/97/17/1121559717.db2.gz GZKWOTGRBCCWCN-JWJUJFCLSA-N 1 1 262.353 3.586 20 5 CHBDMO CCc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000150996434 1121676152 /nfs/dbraw/zinc/67/61/52/1121676152.db2.gz CJNOKXZUISQGDV-GFCCVEGCSA-N 1 1 288.347 3.909 20 5 CHBDMO CCC[C@H]1CCCC[N@H+]1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000542628569 1121714783 /nfs/dbraw/zinc/71/47/83/1121714783.db2.gz WARORVPTYKGRQI-AWEZNQCLSA-N 1 1 292.379 3.758 20 5 CHBDMO CC(C)[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C1CCCC1 ZINC000731030221 1121843322 /nfs/dbraw/zinc/84/33/22/1121843322.db2.gz LWRJXBBMQVLZQO-UHFFFAOYSA-N 1 1 280.343 3.887 20 5 CHBDMO C[C@@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(C)(C)C ZINC000619843871 1129015591 /nfs/dbraw/zinc/01/55/91/1129015591.db2.gz YIRDIEXYRFSBIW-LBPRGKRZSA-N 1 1 264.369 3.709 20 5 CHBDMO CC[C@H](C)C[N@@H+](C)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180261873 1121970169 /nfs/dbraw/zinc/97/01/69/1121970169.db2.gz CBWTYKFGXPJLBK-NSHDSACASA-N 1 1 264.369 3.690 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC001307450519 1122075534 /nfs/dbraw/zinc/07/55/34/1122075534.db2.gz NNHILEBXVIYHBT-HNNXBMFYSA-N 1 1 276.380 3.914 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001167960564 1122525461 /nfs/dbraw/zinc/52/54/61/1122525461.db2.gz UZLIWNSDHNPNTM-GFCCVEGCSA-N 1 1 280.343 3.746 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC001191986089 1122623484 /nfs/dbraw/zinc/62/34/84/1122623484.db2.gz IWDNXXQUHHNSJR-HNNXBMFYSA-N 1 1 276.380 3.649 20 5 CHBDMO CC1=CCC[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000437339248 1122628397 /nfs/dbraw/zinc/62/83/97/1122628397.db2.gz BTFPOMZRDQPPKT-UHFFFAOYSA-N 1 1 274.364 3.870 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H]2CCC[C@@H]21 ZINC000426488825 1122804926 /nfs/dbraw/zinc/80/49/26/1122804926.db2.gz XYWRPEXWKYCUAJ-MFKMUULPSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3CCC[C@@H]32)c(Cl)c1 ZINC000426525042 1122813968 /nfs/dbraw/zinc/81/39/68/1122813968.db2.gz QCDTYULCFMMBKH-HZMBPMFUSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3CCC[C@@H]32)c(Cl)c1 ZINC000426525048 1122814287 /nfs/dbraw/zinc/81/42/87/1122814287.db2.gz QCDTYULCFMMBKH-YGRLFVJLSA-N 1 1 280.755 3.623 20 5 CHBDMO CC(C)[C@@H]1CCC[N@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507187520 1122845434 /nfs/dbraw/zinc/84/54/34/1122845434.db2.gz KUCUGMFMZULRPZ-KKTNHOPESA-N 1 1 274.364 3.728 20 5 CHBDMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCC[C@@H]1C(C)(C)C ZINC001195279149 1122860027 /nfs/dbraw/zinc/86/00/27/1122860027.db2.gz NAKHHFBUDJJEIB-KBPBESRZSA-N 1 1 291.395 3.636 20 5 CHBDMO CCC[C@H]1CCCC[N@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000543556615 1122885926 /nfs/dbraw/zinc/88/59/26/1122885926.db2.gz GKJRGRMBXOIPOK-LBPRGKRZSA-N 1 1 268.382 3.811 20 5 CHBDMO C/C=C/C[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001196612717 1122927211 /nfs/dbraw/zinc/92/72/11/1122927211.db2.gz FFIWYFJSKVSFAU-YWVDXFKGSA-N 1 1 292.354 3.912 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(F)cc(F)c1 ZINC000507151889 1122932189 /nfs/dbraw/zinc/93/21/89/1122932189.db2.gz LXZSDPMDYHCWFD-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cc(F)cc(F)c1 ZINC000507151889 1122932192 /nfs/dbraw/zinc/93/21/92/1122932192.db2.gz LXZSDPMDYHCWFD-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000507233720 1122942234 /nfs/dbraw/zinc/94/22/34/1122942234.db2.gz VUWMGHHZCKAIDF-UHFFFAOYSA-N 1 1 286.331 3.839 20 5 CHBDMO CC1=C[C@@H](C)C[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000797526254 1123184616 /nfs/dbraw/zinc/18/46/16/1123184616.db2.gz KHOBWAQOUNHHBP-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO CC1=C[C@@H](C)C[N@@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000797526254 1123184617 /nfs/dbraw/zinc/18/46/17/1123184617.db2.gz KHOBWAQOUNHHBP-SNVBAGLBSA-N 1 1 280.755 3.646 20 5 CHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1C ZINC000252121434 1123329493 /nfs/dbraw/zinc/32/94/93/1123329493.db2.gz JKNWDXIKNWROJR-MNOVXSKESA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1C ZINC000252121436 1123330026 /nfs/dbraw/zinc/33/00/26/1123330026.db2.gz JKNWDXIKNWROJR-QWRGUYRKSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCC1CC1 ZINC000544940784 1123505522 /nfs/dbraw/zinc/50/55/22/1123505522.db2.gz UAPYKTQHRZWBPE-FNORWQNLSA-N 1 1 274.364 3.730 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC000522713142 1123719706 /nfs/dbraw/zinc/71/97/06/1123719706.db2.gz SFZLONBKFORBTH-ZDUSSCGKSA-N 1 1 292.379 3.616 20 5 CHBDMO COc1ccc(C[N@H+]2C[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000525637970 1124451327 /nfs/dbraw/zinc/45/13/27/1124451327.db2.gz MRVFYOWGTOFCKZ-OLZOCXBDSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1F)c1c(F)cccc1[N+](=O)[O-] ZINC000872090664 1124680675 /nfs/dbraw/zinc/68/06/75/1124680675.db2.gz DQYPEPJHZICXPV-JBLDHEPKSA-N 1 1 284.306 3.665 20 5 CHBDMO CC[C@@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])C(F)F ZINC000449360126 1124711124 /nfs/dbraw/zinc/71/11/24/1124711124.db2.gz IWCQPUCDLBNTIZ-ZYHUDNBSSA-N 1 1 286.322 3.549 20 5 CHBDMO CC[C@@H](C)[C@@H](C)[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000520590530 1125353811 /nfs/dbraw/zinc/35/38/11/1125353811.db2.gz LIGHQTXNIJNEPO-CHWSQXEVSA-N 1 1 276.380 3.994 20 5 CHBDMO C[C@H](c1ccccc1F)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000052074199 1125373997 /nfs/dbraw/zinc/37/39/97/1125373997.db2.gz VAHUDPCFCQIBGW-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1ccccc1F)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000052074199 1125373999 /nfs/dbraw/zinc/37/39/99/1125373999.db2.gz VAHUDPCFCQIBGW-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO CSc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000883198995 1125376409 /nfs/dbraw/zinc/37/64/09/1125376409.db2.gz VBXRQIUNGRLOPJ-UHFFFAOYSA-N 1 1 292.360 3.508 20 5 CHBDMO C[C@H]([N@@H+](C)CCc1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000532491071 1125407723 /nfs/dbraw/zinc/40/77/23/1125407723.db2.gz WQMXURBVVLFVNA-LBPRGKRZSA-N 1 1 264.369 3.504 20 5 CHBDMO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)C1CCCCC1 ZINC000302809396 1129502903 /nfs/dbraw/zinc/50/29/03/1129502903.db2.gz KICOZZLOWZLLDS-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO CC(C)C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000745947056 1129618912 /nfs/dbraw/zinc/61/89/12/1129618912.db2.gz PUFXPWMAJNMWHK-LBPRGKRZSA-N 1 1 280.343 3.602 20 5 CHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169012541 1129690025 /nfs/dbraw/zinc/69/00/25/1129690025.db2.gz QXBXTIXSMMUYRF-INMHGKMJSA-N 1 1 288.391 3.577 20 5 CHBDMO CC[N@@H+](Cc1ccc(Cl)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169039778 1129690431 /nfs/dbraw/zinc/69/04/31/1129690431.db2.gz TWABAGUDJOHTAM-UKRRQHHQSA-N 1 1 296.798 3.607 20 5 CHBDMO C[N@@H+](Cc1cccc2ccccc21)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169023259 1129691420 /nfs/dbraw/zinc/69/14/20/1129691420.db2.gz DVLVVPWEWHUEEV-RHSMWYFYSA-N 1 1 298.386 3.717 20 5 CHBDMO C[N@@H+](CCCC(C)(C)C)CCc1cccc([N+](=O)[O-])c1 ZINC001169666371 1129744840 /nfs/dbraw/zinc/74/48/40/1129744840.db2.gz LCMYHTFFADYLCD-UHFFFAOYSA-N 1 1 278.396 3.895 20 5 CHBDMO Cc1ccc(C[N@H+](CC2CCC2)C(C)C)cc1[N+](=O)[O-] ZINC001169822760 1129758955 /nfs/dbraw/zinc/75/89/55/1129758955.db2.gz WZMHBBDKKHWAMI-UHFFFAOYSA-N 1 1 276.380 3.914 20 5 CHBDMO CCCC[N@@H+](CC)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-] ZINC001170329557 1130482984 /nfs/dbraw/zinc/48/29/84/1130482984.db2.gz RIQSEGHULUTKSJ-ZDUSSCGKSA-N 1 1 294.395 3.656 20 5 CHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC1CCC1 ZINC000793351757 1130549351 /nfs/dbraw/zinc/54/93/51/1130549351.db2.gz GMNWMPOFXDVADZ-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCC2(CCCC2)C1 ZINC000782638798 1130785449 /nfs/dbraw/zinc/78/54/49/1130785449.db2.gz RZMYAHBMZYSZBL-UHFFFAOYSA-N 1 1 292.354 3.890 20 5 CHBDMO C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000784388952 1130903137 /nfs/dbraw/zinc/90/31/37/1130903137.db2.gz BDELDNHFWATTCO-GFCCVEGCSA-N 1 1 278.327 3.522 20 5 CHBDMO C[C@@H]1[C@@H](C)C[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000816648931 1131120625 /nfs/dbraw/zinc/12/06/25/1131120625.db2.gz QWSOHKLWVIDRFC-NWDGAFQWSA-N 1 1 286.331 3.695 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@]3(CC3(F)F)C2)cccc1[N+](=O)[O-] ZINC000844440927 1131564358 /nfs/dbraw/zinc/56/43/58/1131564358.db2.gz WUDNGKNVWGRDLW-AWEZNQCLSA-N 1 1 296.317 3.524 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC2(CCC2)C1 ZINC000348191942 1131896201 /nfs/dbraw/zinc/89/62/01/1131896201.db2.gz GIPQHGGUBZJNNX-CYBMUJFWSA-N 1 1 274.364 3.922 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000036787258 1131975177 /nfs/dbraw/zinc/97/51/77/1131975177.db2.gz TUBALWQZXQFDBF-JTQLQIEISA-N 1 1 270.760 3.725 20 5 CHBDMO C[N@@H+](Cc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000036964888 1131982903 /nfs/dbraw/zinc/98/29/03/1131982903.db2.gz MZSXROIZNBHIMR-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO C[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036964875 1131982927 /nfs/dbraw/zinc/98/29/27/1131982927.db2.gz IELMACCZOXTRMB-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO C[C@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000036964875 1131982932 /nfs/dbraw/zinc/98/29/32/1131982932.db2.gz IELMACCZOXTRMB-JTQLQIEISA-N 1 1 268.744 3.623 20 5 CHBDMO Cc1[nH+]c2c(Nc3ccccc3[N+](=O)[O-])cccn2c1C ZINC001206158204 1132129645 /nfs/dbraw/zinc/12/96/45/1132129645.db2.gz RWFIMDDYSCHLAL-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO C[N@@H+](CC1CCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910451 1132347515 /nfs/dbraw/zinc/34/75/15/1132347515.db2.gz AAKAKLKSLMOWNC-MRXNPFEDSA-N 1 1 288.391 3.574 20 5 CHBDMO CC[C@H](C)[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172906302 1132348344 /nfs/dbraw/zinc/34/83/44/1132348344.db2.gz XAQBKBACKQGTJS-SWLSCSKDSA-N 1 1 276.380 3.573 20 5 CHBDMO CCCCC[N@@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173225898 1132412360 /nfs/dbraw/zinc/41/23/60/1132412360.db2.gz KEJQYBMZUPBNKX-ZDUSSCGKSA-N 1 1 264.369 3.648 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1CCCC1 ZINC001173235666 1132415126 /nfs/dbraw/zinc/41/51/26/1132415126.db2.gz YKAUQLIBNRDLHL-CYBMUJFWSA-N 1 1 276.380 3.648 20 5 CHBDMO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232218812 1132439415 /nfs/dbraw/zinc/43/94/15/1132439415.db2.gz LLGHYPLDXQCKLB-IUODEOHRSA-N 1 1 295.361 3.715 20 5 CHBDMO C[C@@H]1C[C@@H](F)C[N@H+]1Cc1ccc2ccc3cccnc3c2n1 ZINC001232218812 1132439422 /nfs/dbraw/zinc/43/94/22/1132439422.db2.gz LLGHYPLDXQCKLB-IUODEOHRSA-N 1 1 295.361 3.715 20 5 CHBDMO C[N@@H+](CCCCOC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC000354863379 529884894 /nfs/dbraw/zinc/88/48/94/529884894.db2.gz IYLGZIPEWGZUQO-UHFFFAOYSA-N 1 1 294.395 3.622 20 5 CHBDMO C[C@H]1c2ccsc2CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000015144754 260039684 /nfs/dbraw/zinc/03/96/84/260039684.db2.gz FQPKIGPBGCTTQT-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000015144754 260039686 /nfs/dbraw/zinc/03/96/86/260039686.db2.gz FQPKIGPBGCTTQT-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+][C@H]2CSc3ccccc32)cs1 ZINC000344440598 225074932 /nfs/dbraw/zinc/07/49/32/225074932.db2.gz VFWBYDFIVMXHLC-NSHDSACASA-N 1 1 292.385 3.593 20 5 CHBDMO Cc1c(C[N@H+]2CCC[C@@H]2c2cccnc2)cccc1[N+](=O)[O-] ZINC000346978266 226002191 /nfs/dbraw/zinc/00/21/91/226002191.db2.gz IQHMAMPRQZPNGC-QGZVFWFLSA-N 1 1 297.358 3.635 20 5 CHBDMO C[C@@H]1c2ccccc2C[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000353870511 228160900 /nfs/dbraw/zinc/16/09/00/228160900.db2.gz RVBLCIGEESVELB-GFCCVEGCSA-N 1 1 268.316 3.672 20 5 CHBDMO C[C@@H]1c2ccccc2C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000353870511 228160902 /nfs/dbraw/zinc/16/09/02/228160902.db2.gz RVBLCIGEESVELB-GFCCVEGCSA-N 1 1 268.316 3.672 20 5 CHBDMO CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1nccs1 ZINC000080263531 260178619 /nfs/dbraw/zinc/17/86/19/260178619.db2.gz PNJIGQGDUFZUGW-MFKMUULPSA-N 1 1 291.376 3.853 20 5 CHBDMO Cc1c(C[N@H+](C)[C@@H](C)C2(C)CC2)cccc1[N+](=O)[O-] ZINC000177243289 261341732 /nfs/dbraw/zinc/34/17/32/261341732.db2.gz BSZZDVGAOPWQFP-LBPRGKRZSA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525786413 262236035 /nfs/dbraw/zinc/23/60/35/262236035.db2.gz FTWMCLALEGCUAT-VNHYZAJKSA-N 1 1 274.364 3.748 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525786411 262236246 /nfs/dbraw/zinc/23/62/46/262236246.db2.gz FTWMCLALEGCUAT-NFAWXSAZSA-N 1 1 274.364 3.748 20 5 CHBDMO CCC[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000531562283 328018076 /nfs/dbraw/zinc/01/80/76/328018076.db2.gz KNYUGZYLZAECHD-CYBMUJFWSA-N 1 1 262.353 3.607 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000050015658 328381817 /nfs/dbraw/zinc/38/18/17/328381817.db2.gz SJKPNHWBIHDFEU-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C/C=C\c1ccccc1)CC2 ZINC000532038609 328397000 /nfs/dbraw/zinc/39/70/00/328397000.db2.gz CNSWPXURPZMABN-DAXSKMNVSA-N 1 1 294.354 3.666 20 5 CHBDMO O=[N+]([O-])c1ccc2c(c1)C[N@H+](C/C=C\c1ccccc1)CC2 ZINC000532038609 328397001 /nfs/dbraw/zinc/39/70/01/328397001.db2.gz CNSWPXURPZMABN-DAXSKMNVSA-N 1 1 294.354 3.666 20 5 CHBDMO CCc1cccnc1[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000507520974 332812066 /nfs/dbraw/zinc/81/20/66/332812066.db2.gz UVAXBLAKOPLPIJ-CHWSQXEVSA-N 1 1 299.374 3.964 20 5 CHBDMO CCCC[C@@H](CN)[NH2+][C@H](CCC)c1cccc([N+](=O)[O-])c1 ZINC000423301652 330188975 /nfs/dbraw/zinc/18/89/75/330188975.db2.gz UHMWYMNNSWYPOB-GOEBONIOSA-N 1 1 293.411 3.543 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000396778911 330226068 /nfs/dbraw/zinc/22/60/68/330226068.db2.gz LIYFWUQQOVMKOZ-ZDUSSCGKSA-N 1 1 280.343 3.744 20 5 CHBDMO CC(C)[C@H]1CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000445436428 330342643 /nfs/dbraw/zinc/34/26/43/330342643.db2.gz RBVJCHYPCCCBOQ-OLZOCXBDSA-N 1 1 262.353 3.634 20 5 CHBDMO CCC[N@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])CC(C)C ZINC000463505568 331348763 /nfs/dbraw/zinc/34/87/63/331348763.db2.gz DTWUHEIWXLFPNL-UHFFFAOYSA-N 1 1 298.358 3.611 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1 ZINC000464774803 331367401 /nfs/dbraw/zinc/36/74/01/331367401.db2.gz IXYSNECXRPMPIL-INIZCTEOSA-N 1 1 292.379 3.616 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1cccc(C)[nH+]1 ZINC000468628690 331437745 /nfs/dbraw/zinc/43/77/45/331437745.db2.gz BLPNYXFEZULOSR-FMIVXFBMSA-N 1 1 283.331 3.814 20 5 CHBDMO COc1cc(C[N@H+]2CCC[C@@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC000489198466 332043254 /nfs/dbraw/zinc/04/32/54/332043254.db2.gz RARDSKBCXVMERC-OAHLLOKOSA-N 1 1 292.379 3.614 20 5 CHBDMO COc1cc(C[N@H+]2C[C@@H](C)CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000490029445 332077509 /nfs/dbraw/zinc/07/75/09/332077509.db2.gz KIMCXNCUPXRCHA-STQMWFEESA-N 1 1 292.379 3.614 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000522300615 333280773 /nfs/dbraw/zinc/28/07/73/333280773.db2.gz AITYZPZOORCPHZ-ZDUSSCGKSA-N 1 1 282.409 3.914 20 5 CHBDMO Cc1cccc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523701367 333340003 /nfs/dbraw/zinc/34/00/03/333340003.db2.gz IKZYCIUNEVVUKG-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000524766829 333387368 /nfs/dbraw/zinc/38/73/68/333387368.db2.gz PXHLPEOQKNFTAX-HNNXBMFYSA-N 1 1 262.353 3.607 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000564324902 334101202 /nfs/dbraw/zinc/10/12/02/334101202.db2.gz JIVDRTIKERMZED-GXTWGEPZSA-N 1 1 262.353 3.666 20 5 CHBDMO Cc1ccc(CC[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549166969 334186909 /nfs/dbraw/zinc/18/69/09/334186909.db2.gz BPMACGAAGAIQQO-UHFFFAOYSA-N 1 1 298.386 3.620 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC000550079266 334212593 /nfs/dbraw/zinc/21/25/93/334212593.db2.gz LFTFTJIESUGHNM-DZGCQCFKSA-N 1 1 274.364 3.605 20 5 CHBDMO CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@@H]21 ZINC000550442917 334222608 /nfs/dbraw/zinc/22/26/08/334222608.db2.gz BTUXODZBHCEPIJ-JKSUJKDBSA-N 1 1 288.391 3.648 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000248272991 334297768 /nfs/dbraw/zinc/29/77/68/334297768.db2.gz WYXOMCYKBAOTJU-UHFFFAOYSA-N 1 1 262.353 3.749 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000552274179 334311257 /nfs/dbraw/zinc/31/12/57/334311257.db2.gz DSJRJKVPMWUAEO-QGZVFWFLSA-N 1 1 296.370 3.974 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCSC[C@@H](C)C1 ZINC000248943683 334322284 /nfs/dbraw/zinc/32/22/84/334322284.db2.gz AEEIOIUADBJOLX-AAEUAGOBSA-N 1 1 294.420 3.649 20 5 CHBDMO C[C@@H](c1cccc(F)c1)[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000194198931 336009041 /nfs/dbraw/zinc/00/90/41/336009041.db2.gz PARXDMUMHVIRID-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1cccc(F)c1)[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000194198931 336009042 /nfs/dbraw/zinc/00/90/42/336009042.db2.gz PARXDMUMHVIRID-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO Cc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cs1 ZINC000381135834 336051573 /nfs/dbraw/zinc/05/15/73/336051573.db2.gz IFFXISFOLLZOPM-UHFFFAOYSA-N 1 1 296.779 3.908 20 5 CHBDMO C[C@@H](c1ccco1)[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000086234347 526138103 /nfs/dbraw/zinc/13/81/03/526138103.db2.gz QJRRSACSPGLUJI-LBPRGKRZSA-N 1 1 286.331 3.913 20 5 CHBDMO C[C@@H](c1ccco1)[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000086234347 526138115 /nfs/dbraw/zinc/13/81/15/526138115.db2.gz QJRRSACSPGLUJI-LBPRGKRZSA-N 1 1 286.331 3.913 20 5 CHBDMO CC(C)c1ccc(C[N@H+](C)Cc2ccoc2)cc1[N+](=O)[O-] ZINC000352648733 528092013 /nfs/dbraw/zinc/09/20/13/528092013.db2.gz GXJZLZCRZCCCIH-UHFFFAOYSA-N 1 1 288.347 3.943 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)Cc2ccoc2)cc1[N+](=O)[O-] ZINC000352648733 528092016 /nfs/dbraw/zinc/09/20/16/528092016.db2.gz GXJZLZCRZCCCIH-UHFFFAOYSA-N 1 1 288.347 3.943 20 5 CHBDMO CC(C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC001307529068 1125461593 /nfs/dbraw/zinc/46/15/93/1125461593.db2.gz MRYKZZKKLMZECU-UHFFFAOYSA-N 1 1 292.379 3.627 20 5 CHBDMO C[C@H]1CCC[C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000610215377 1117882994 /nfs/dbraw/zinc/88/29/94/1117882994.db2.gz JIPDYLPUUDZLAQ-STQMWFEESA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CC[C@H](C)C1 ZINC000433038370 1121528661 /nfs/dbraw/zinc/52/86/61/1121528661.db2.gz JRPPGAYJAUCADH-SMDDNHRTSA-N 1 1 262.353 3.524 20 5 CHBDMO Cc1ccc([C@@H](C)[N@H+](C)Cc2cccnc2[N+](=O)[O-])c(C)c1 ZINC000885963970 1125632076 /nfs/dbraw/zinc/63/20/76/1125632076.db2.gz UHJBQBUXNCNKDC-CQSZACIVSA-N 1 1 299.374 3.800 20 5 CHBDMO Cc1ccc([C@@H](C)[N@@H+](C)Cc2cccnc2[N+](=O)[O-])c(C)c1 ZINC000885963970 1125632079 /nfs/dbraw/zinc/63/20/79/1125632079.db2.gz UHJBQBUXNCNKDC-CQSZACIVSA-N 1 1 299.374 3.800 20 5 CHBDMO CC(C)[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000886215061 1125661232 /nfs/dbraw/zinc/66/12/32/1125661232.db2.gz CQWNYGWDGAMZFB-CQSZACIVSA-N 1 1 299.374 3.961 20 5 CHBDMO C[C@H]1C[C@@H](c2ccccc2)[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC000886205087 1125661125 /nfs/dbraw/zinc/66/11/25/1125661125.db2.gz ZLNNMXKYECYVTL-BBRMVZONSA-N 1 1 297.358 3.573 20 5 CHBDMO Cc1cccc(N[C@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-] ZINC000614976496 1125703193 /nfs/dbraw/zinc/70/31/93/1125703193.db2.gz DQAULYFOGBLSHV-INIZCTEOSA-N 1 1 297.358 3.502 20 5 CHBDMO CCC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC1CC1 ZINC000000042907 1129711928 /nfs/dbraw/zinc/71/19/28/1129711928.db2.gz XSNTYIHSVFDYBK-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC(C)(C)C1 ZINC000483107784 1126768284 /nfs/dbraw/zinc/76/82/84/1126768284.db2.gz SDBGSNLQQSATOT-HNNXBMFYSA-N 1 1 276.380 3.648 20 5 CHBDMO CC[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000485541319 1126924540 /nfs/dbraw/zinc/92/45/40/1126924540.db2.gz HYIIMIXZEAYUHO-ZDUSSCGKSA-N 1 1 292.379 3.616 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000348917978 1127134843 /nfs/dbraw/zinc/13/48/43/1127134843.db2.gz ANJDXDYTOUDZLM-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000348917978 1127134845 /nfs/dbraw/zinc/13/48/45/1127134845.db2.gz ANJDXDYTOUDZLM-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO CC(C)[N@H+](Cc1ccco1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283386888 1127135564 /nfs/dbraw/zinc/13/55/64/1127135564.db2.gz DAMTVJQCUQRAOI-UHFFFAOYSA-N 1 1 292.310 3.738 20 5 CHBDMO CC(C)[N@@H+](Cc1ccco1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283386888 1127135566 /nfs/dbraw/zinc/13/55/66/1127135566.db2.gz DAMTVJQCUQRAOI-UHFFFAOYSA-N 1 1 292.310 3.738 20 5 CHBDMO O=[N+]([O-])c1ccc([O-])cc1C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000349768056 1127160394 /nfs/dbraw/zinc/16/03/94/1127160394.db2.gz MJYANLYPCRIYNH-MRXNPFEDSA-N 1 1 298.342 3.638 20 5 CHBDMO O=[N+]([O-])c1ccc([O-])cc1CN1CCC[C@@H]1c1ccccc1 ZINC000349768056 1127160396 /nfs/dbraw/zinc/16/03/96/1127160396.db2.gz MJYANLYPCRIYNH-MRXNPFEDSA-N 1 1 298.342 3.638 20 5 CHBDMO C[C@@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000571890687 1127179467 /nfs/dbraw/zinc/17/94/67/1127179467.db2.gz YPEDMPCVCOIYKL-HNNXBMFYSA-N 1 1 298.386 3.873 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](C2CC2)C1 ZINC000588977945 1127209314 /nfs/dbraw/zinc/20/93/14/1127209314.db2.gz DZMAALWBHWEIQM-JSGCOSHPSA-N 1 1 274.364 3.778 20 5 CHBDMO CC(C)[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCC1 ZINC000351872974 1127213202 /nfs/dbraw/zinc/21/32/02/1127213202.db2.gz GCECIFNZIAHXDA-UHFFFAOYSA-N 1 1 284.306 3.636 20 5 CHBDMO CC(C)[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCC1 ZINC000351872974 1127213205 /nfs/dbraw/zinc/21/32/05/1127213205.db2.gz GCECIFNZIAHXDA-UHFFFAOYSA-N 1 1 284.306 3.636 20 5 CHBDMO C[N@@H+](Cc1csc([N+](=O)[O-])c1)[C@@H]1CCC(C)(C)C1 ZINC000355582363 1127350125 /nfs/dbraw/zinc/35/01/25/1127350125.db2.gz LLNKRPBHJHUDHC-LLVKDONJSA-N 1 1 268.382 3.667 20 5 CHBDMO CC(C)O[C@@H]1CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000593056120 1127369665 /nfs/dbraw/zinc/36/96/65/1127369665.db2.gz YHKSOAUMOWQJOS-ZIAGYGMSSA-N 1 1 292.379 3.545 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](CCF)C1 ZINC000595754354 1127474902 /nfs/dbraw/zinc/47/49/02/1127474902.db2.gz ACKRLZNFXOEFEI-QWHCGFSZSA-N 1 1 280.343 3.727 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](CCF)C1 ZINC000595754353 1127475177 /nfs/dbraw/zinc/47/51/77/1127475177.db2.gz ACKRLZNFXOEFEI-OLZOCXBDSA-N 1 1 280.343 3.727 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@@H+](CCC2CC2)CC2CC2)cs1 ZINC000595872357 1127479521 /nfs/dbraw/zinc/47/95/21/1127479521.db2.gz WLLFEDQAFFGNBM-UHFFFAOYSA-N 1 1 280.393 3.668 20 5 CHBDMO CC(C)c1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)on1 ZINC000169273539 1127502465 /nfs/dbraw/zinc/50/24/65/1127502465.db2.gz YWIZFMOIRIAZPY-NSHDSACASA-N 1 1 289.335 3.557 20 5 CHBDMO C[C@H]1CCC[N@H+]1Cc1cccc(-c2ccc([N+](=O)[O-])nc2)c1 ZINC000596637412 1127513869 /nfs/dbraw/zinc/51/38/69/1127513869.db2.gz KTGLZCNZQGMCAD-ZDUSSCGKSA-N 1 1 297.358 3.641 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H](CCF)C1 ZINC000597212100 1127534042 /nfs/dbraw/zinc/53/40/42/1127534042.db2.gz RSKQSCWYAMMDAT-BTKRWWFXSA-N 1 1 292.354 3.680 20 5 CHBDMO CSc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000603431187 1127649525 /nfs/dbraw/zinc/64/95/25/1127649525.db2.gz KJRKWYZYWJZUOZ-UHFFFAOYSA-N 1 1 292.360 3.508 20 5 CHBDMO C[C@H]1CCC[C@H]([N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000603873870 1127679807 /nfs/dbraw/zinc/67/98/07/1127679807.db2.gz JAXMJRSVWSNIIP-BBRMVZONSA-N 1 1 276.380 3.648 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)s1 ZINC000604439066 1127706109 /nfs/dbraw/zinc/70/61/09/1127706109.db2.gz ZUBGWJAKLWZJRP-UHFFFAOYSA-N 1 1 290.388 3.905 20 5 CHBDMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](C1CC1)C1CCCC1 ZINC000171616970 1127717420 /nfs/dbraw/zinc/71/74/20/1127717420.db2.gz JZTRXTQUXJMATA-UHFFFAOYSA-N 1 1 278.327 3.641 20 5 CHBDMO CSCCC[N@@H+](C)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000467554103 1127973605 /nfs/dbraw/zinc/97/36/05/1127973605.db2.gz NXBFIUUYCCNSQA-RAXLEYEMSA-N 1 1 294.420 3.683 20 5 CHBDMO CC[N@@H+](CCC1CC1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000544896329 1127989145 /nfs/dbraw/zinc/98/91/45/1127989145.db2.gz AXRANWKTBXKAMA-GFCCVEGCSA-N 1 1 262.353 3.778 20 5 CHBDMO CS[C@H]1CCCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468258101 1128000179 /nfs/dbraw/zinc/00/01/79/1128000179.db2.gz AVGHYVXOISAXKT-OLZOCXBDSA-N 1 1 294.420 3.873 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCCC[C@@H](C)C1 ZINC000468260562 1128000261 /nfs/dbraw/zinc/00/02/61/1128000261.db2.gz KYKAOOKDXIHWFW-CHWSQXEVSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542003456 1128046838 /nfs/dbraw/zinc/04/68/38/1128046838.db2.gz YDWBENZPLTZNPU-SNVBAGLBSA-N 1 1 268.744 3.623 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccoc1 ZINC000470173520 1128064114 /nfs/dbraw/zinc/06/41/14/1128064114.db2.gz CDKFWHTUPUZHSJ-MDWZMJQESA-N 1 1 286.331 3.723 20 5 CHBDMO CC[C@H]1CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000470182637 1128065067 /nfs/dbraw/zinc/06/50/67/1128065067.db2.gz MHPHNKSZKIWHQU-SSUFTNFISA-N 1 1 274.364 3.730 20 5 CHBDMO CCC[N@@H+](CC)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000470172787 1128065091 /nfs/dbraw/zinc/06/50/91/1128065091.db2.gz CEBOKEGYMGSXPH-JLHYYAGUSA-N 1 1 262.353 3.730 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cn1 ZINC000271805500 1128065295 /nfs/dbraw/zinc/06/52/95/1128065295.db2.gz PZXASVDDQNRHRR-GHMZBOCLSA-N 1 1 289.310 3.541 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC(C)(C)C ZINC000470173570 1128065439 /nfs/dbraw/zinc/06/54/39/1128065439.db2.gz CTXUSSFBJGLCFS-LCYFTJDESA-N 1 1 276.380 3.976 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H]2CCC[C@H]21 ZINC000470207397 1128066007 /nfs/dbraw/zinc/06/60/07/1128066007.db2.gz VPJYJULEFUBZRM-UJDGICINSA-N 1 1 286.375 3.873 20 5 CHBDMO CCOc1cc(C[N@H+]2C[C@H](C)CC2(C)C)ccc1[N+](=O)[O-] ZINC000492789868 1128113191 /nfs/dbraw/zinc/11/31/91/1128113191.db2.gz NRBANUSMXIWSAQ-GFCCVEGCSA-N 1 1 292.379 3.614 20 5 CHBDMO CCOc1cc(C[N@@H+](CC)CCC2CC2)ccc1[N+](=O)[O-] ZINC000492847980 1128114497 /nfs/dbraw/zinc/11/44/97/1128114497.db2.gz RAEJEXFAHDDVFV-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494189613 1128159539 /nfs/dbraw/zinc/15/95/39/1128159539.db2.gz STYIKJIYIYIZRD-JTQLQIEISA-N 1 1 270.760 3.725 20 5 CHBDMO CC1(C)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])[C@H]1C1CC1 ZINC000565984241 1128535548 /nfs/dbraw/zinc/53/55/48/1128535548.db2.gz SPRWGVDLRFMWLV-YERXGYGTSA-N 1 1 286.375 3.728 20 5 CHBDMO C[N@H+](Cc1csc([N+](=O)[O-])c1)CC1CCCCC1 ZINC000047265571 1128668452 /nfs/dbraw/zinc/66/84/52/1128668452.db2.gz SYDNHBNLGRXHMP-UHFFFAOYSA-N 1 1 268.382 3.668 20 5 CHBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000609672506 1128720993 /nfs/dbraw/zinc/72/09/93/1128720993.db2.gz HLZRRCDVNYGBBU-WMLDXEAASA-N 1 1 296.370 3.973 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000609766787 1128724529 /nfs/dbraw/zinc/72/45/29/1128724529.db2.gz QOJZRKRBEKCKEL-CYBMUJFWSA-N 1 1 262.353 3.607 20 5 CHBDMO CC[C@@H]1CC[N@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000430190014 1117827260 /nfs/dbraw/zinc/82/72/60/1117827260.db2.gz FFYVSEUTJCYKGF-GFCCVEGCSA-N 1 1 286.331 3.839 20 5 CHBDMO CC[C@@H]1CCCCC[N@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000610080159 1128738151 /nfs/dbraw/zinc/73/81/51/1128738151.db2.gz JVJFFUDYFAMSTN-GFCCVEGCSA-N 1 1 280.343 3.889 20 5 CHBDMO Cc1ccc2oc(C[NH2+]Cc3ccccc3[N+](=O)[O-])cc2c1 ZINC000610088865 1128738769 /nfs/dbraw/zinc/73/87/69/1128738769.db2.gz IYPIOOMWPAVPRQ-UHFFFAOYSA-N 1 1 296.326 3.939 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000430265389 1117956901 /nfs/dbraw/zinc/95/69/01/1117956901.db2.gz DSFAAZINVCMNGW-BXUZGUMPSA-N 1 1 274.364 3.862 20 5 CHBDMO Cc1cc[nH+]c(N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000182636438 1118026325 /nfs/dbraw/zinc/02/63/25/1118026325.db2.gz VOWHKQKDBLUJJP-GFCCVEGCSA-N 1 1 271.320 3.780 20 5 CHBDMO C[C@H]1CCCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083173421 1118026949 /nfs/dbraw/zinc/02/69/49/1118026949.db2.gz KKCHSQXJDBXJLU-NSHDSACASA-N 1 1 289.335 3.501 20 5 CHBDMO CC[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC1CCC1 ZINC000230313533 1118146849 /nfs/dbraw/zinc/14/68/49/1118146849.db2.gz BAHCZCRJIXZBGS-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1(C)C ZINC000801539818 1128759352 /nfs/dbraw/zinc/75/93/52/1128759352.db2.gz BEHAFUNFNLXLQZ-NSHDSACASA-N 1 1 280.343 3.602 20 5 CHBDMO CC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)C(C)C ZINC000083173907 1118251030 /nfs/dbraw/zinc/25/10/30/1118251030.db2.gz UMRCRKVLMHLUGL-LLVKDONJSA-N 1 1 291.351 3.602 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000610369522 1118362835 /nfs/dbraw/zinc/36/28/35/1118362835.db2.gz KUFNWEVDXSFLNZ-QWHCGFSZSA-N 1 1 286.331 3.738 20 5 CHBDMO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC(C)(C)C ZINC000510676634 1118785677 /nfs/dbraw/zinc/78/56/77/1118785677.db2.gz ALTCYMIKYZDZKZ-CLFYSBASSA-N 1 1 262.353 3.586 20 5 CHBDMO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000091959808 1118933529 /nfs/dbraw/zinc/93/35/29/1118933529.db2.gz IALPRXRJMFNUBK-ZJUUUORDSA-N 1 1 289.335 3.611 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1cncs1 ZINC000934197161 1118963308 /nfs/dbraw/zinc/96/33/08/1118963308.db2.gz BADUZQZJHGBUMP-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])CCC(C)(C)C ZINC000511065359 1119001043 /nfs/dbraw/zinc/00/10/43/1119001043.db2.gz OESQYXFWVYFHKO-UHFFFAOYSA-N 1 1 264.369 3.505 20 5 CHBDMO C[N@H+](CCc1ccccc1[N+](=O)[O-])CCC1CCCC1 ZINC000511095179 1119043242 /nfs/dbraw/zinc/04/32/42/1119043242.db2.gz JFFWGIHULRYTRY-UHFFFAOYSA-N 1 1 276.380 3.649 20 5 CHBDMO CCC1(CC)CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC001167657510 1119306275 /nfs/dbraw/zinc/30/62/75/1119306275.db2.gz XUONRYYVTLXDCB-UHFFFAOYSA-N 1 1 276.380 3.915 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3CCCC[C@H]3C2)cc1F ZINC000250894022 1119534908 /nfs/dbraw/zinc/53/49/08/1119534908.db2.gz OEABWWHGLOXPMM-KBPBESRZSA-N 1 1 292.354 3.746 20 5 CHBDMO C[N@H+](Cc1coc2ccccc12)Cc1ccccc1[N+](=O)[O-] ZINC000179315301 1119709921 /nfs/dbraw/zinc/70/99/21/1119709921.db2.gz TVFIBZKUGILNSG-UHFFFAOYSA-N 1 1 296.326 3.973 20 5 CHBDMO C[N@@H+](Cc1coc2ccccc12)Cc1ccccc1[N+](=O)[O-] ZINC000179315301 1119709922 /nfs/dbraw/zinc/70/99/22/1119709922.db2.gz TVFIBZKUGILNSG-UHFFFAOYSA-N 1 1 296.326 3.973 20 5 CHBDMO Cc1ccc(C[N@H+](C)C2CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000582233741 1119912859 /nfs/dbraw/zinc/91/28/59/1119912859.db2.gz ACQBFCFPTFEINO-UHFFFAOYSA-N 1 1 298.333 3.913 20 5 CHBDMO Cc1c(C[N@@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000051258490 1120256065 /nfs/dbraw/zinc/25/60/65/1120256065.db2.gz XEQNEMXZZMMDCA-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1cc(C)nc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000930554947 1120276389 /nfs/dbraw/zinc/27/63/89/1120276389.db2.gz QYKYNYJQLNDNHQ-UHFFFAOYSA-N 1 1 299.374 3.632 20 5 CHBDMO Cc1c(C[N@@H+](C)[C@@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069066484 1120492083 /nfs/dbraw/zinc/49/20/83/1120492083.db2.gz FFULTBAKWLSLLS-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO Cc1c(C[N@H+](C)[C@@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069066484 1120492085 /nfs/dbraw/zinc/49/20/85/1120492085.db2.gz FFULTBAKWLSLLS-LBPRGKRZSA-N 1 1 274.320 3.689 20 5 CHBDMO C[C@H]1CCCC[N@H+]1CCCCNc1sccc1[N+](=O)[O-] ZINC000301979459 1120511935 /nfs/dbraw/zinc/51/19/35/1120511935.db2.gz FZIGITDRRJPYTR-LBPRGKRZSA-N 1 1 297.424 3.723 20 5 CHBDMO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000922664889 1120576988 /nfs/dbraw/zinc/57/69/88/1120576988.db2.gz JIMGIVAZHXDIIH-SNVBAGLBSA-N 1 1 294.351 3.955 20 5 CHBDMO CC[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(C)c1 ZINC000500417705 1120618058 /nfs/dbraw/zinc/61/80/58/1120618058.db2.gz AOENRYUULWNZMX-HNNXBMFYSA-N 1 1 291.395 3.580 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Cl)cc2F)cc1 ZINC000157303475 1120644825 /nfs/dbraw/zinc/64/48/25/1120644825.db2.gz MVGHYNQIJABLRL-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@H]3CCC[C@H]32)cc1[N+](=O)[O-] ZINC000511857137 1120666498 /nfs/dbraw/zinc/66/64/98/1120666498.db2.gz BUTDIRLCKXFGOS-HUUCEWRRSA-N 1 1 274.364 3.668 20 5 CHBDMO Cc1c(C[N@@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000049332451 1120856076 /nfs/dbraw/zinc/85/60/76/1120856076.db2.gz BIOOFFTXFUJZFP-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1c(C[N@H+]2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000049332451 1120856079 /nfs/dbraw/zinc/85/60/79/1120856079.db2.gz BIOOFFTXFUJZFP-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000511970114 1120946283 /nfs/dbraw/zinc/94/62/83/1120946283.db2.gz DYRDWXKGTJYSPO-GFCCVEGCSA-N 1 1 286.331 3.697 20 5 CHBDMO CC[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC001174779310 1121027697 /nfs/dbraw/zinc/02/76/97/1121027697.db2.gz DXRJCBXLPSEVDF-GXTWGEPZSA-N 1 1 292.379 3.756 20 5 CHBDMO CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000512230854 1121212581 /nfs/dbraw/zinc/21/25/81/1121212581.db2.gz VJLNWKNJRNKMRF-GDAGCXPBSA-N 1 1 276.380 3.974 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@@H](C)C2(C)CC2)cc1[N+](=O)[O-] ZINC000091900462 1121377916 /nfs/dbraw/zinc/37/79/16/1121377916.db2.gz FGRJEUNFBZTVSL-LBPRGKRZSA-N 1 1 262.353 3.524 20 5 CHBDMO C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000509278341 1121507542 /nfs/dbraw/zinc/50/75/42/1121507542.db2.gz GQXSFASYRQZJOK-UHFFFAOYSA-N 1 1 284.306 3.638 20 5 CHBDMO C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1CCCCC1 ZINC000509278341 1121507544 /nfs/dbraw/zinc/50/75/44/1121507544.db2.gz GQXSFASYRQZJOK-UHFFFAOYSA-N 1 1 284.306 3.638 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H](C)C(C)C ZINC000543628650 1121534838 /nfs/dbraw/zinc/53/48/38/1121534838.db2.gz VNZKDAKYBQUYGW-ZDUSSCGKSA-N 1 1 264.369 3.770 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccccn1)C(C)C ZINC000543629090 1121535664 /nfs/dbraw/zinc/53/56/64/1121535664.db2.gz GIUWZIPLZFPDPV-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO COc1ccc(Nc2cccc3cc[nH+]cc32)cc1[N+](=O)[O-] ZINC001176362226 1121614165 /nfs/dbraw/zinc/61/41/65/1121614165.db2.gz ABMLLVLVYFQFDU-UHFFFAOYSA-N 1 1 295.298 3.895 20 5 CHBDMO C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCC(F)(F)C1 ZINC000450977320 1121621096 /nfs/dbraw/zinc/62/10/96/1121621096.db2.gz VIIIRLLDMAPMOB-LBPRGKRZSA-N 1 1 298.333 3.505 20 5 CHBDMO Cc1c(C[N@@H+](C)CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000052000173 1121631416 /nfs/dbraw/zinc/63/14/16/1121631416.db2.gz FNLWPFVBZHLERA-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCc2ccccc21 ZINC000611549612 1121655900 /nfs/dbraw/zinc/65/59/00/1121655900.db2.gz BYMJVLDICCYQOB-INIZCTEOSA-N 1 1 296.370 3.757 20 5 CHBDMO C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C1CCCCCC1 ZINC000505563540 1122420786 /nfs/dbraw/zinc/42/07/86/1122420786.db2.gz HGOHVKLIAGCLDW-UHFFFAOYSA-N 1 1 280.343 3.889 20 5 CHBDMO C[C@@H]1CCC[C@@H]([N@@H+](C)Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000505617442 1122438424 /nfs/dbraw/zinc/43/84/24/1122438424.db2.gz YWQYBDOJSVCPDH-VXGBXAGGSA-N 1 1 280.343 3.744 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000435772600 1122488115 /nfs/dbraw/zinc/48/81/15/1122488115.db2.gz QGIHJHPYHGGXNZ-IMXKFXGHSA-N 1 1 297.358 3.773 20 5 CHBDMO C[C@H](c1ccc(-c2ccccc2)cc1)[N@@H+](C)CC[N+](=O)[O-] ZINC001191290033 1122589628 /nfs/dbraw/zinc/58/96/28/1122589628.db2.gz YLBGXTRMBSNWNE-CQSZACIVSA-N 1 1 284.359 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2C[C@H]3C[C@H]3C2)C2CC2)cc1 ZINC001192927645 1122664637 /nfs/dbraw/zinc/66/46/37/1122664637.db2.gz ACWQOOLTCQGKIV-QDMKHBRRSA-N 1 1 286.375 3.605 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC3(CCCC3)C2)c(F)c1 ZINC000438348006 1122693598 /nfs/dbraw/zinc/69/35/98/1122693598.db2.gz IMOLWNFKZPBBMY-UHFFFAOYSA-N 1 1 292.354 3.890 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]1Cc1ccccc1 ZINC000437820733 1122705820 /nfs/dbraw/zinc/70/58/20/1122705820.db2.gz HRNAVBZAWFDAPI-GOEBONIOSA-N 1 1 296.370 3.973 20 5 CHBDMO CCC[N@@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000506496373 1122755712 /nfs/dbraw/zinc/75/57/12/1122755712.db2.gz PTRKQCGWPHPJLN-UHFFFAOYSA-N 1 1 274.320 3.697 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@@H](C)[C@@H]1C ZINC001195277906 1122860195 /nfs/dbraw/zinc/86/01/95/1122860195.db2.gz HDJRJOXALBBZSU-FVCCEPFGSA-N 1 1 262.353 3.632 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000348525653 1122892229 /nfs/dbraw/zinc/89/22/29/1122892229.db2.gz PDPZCWMSIIIWCL-HNNXBMFYSA-N 1 1 268.316 3.542 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H]1c1ccccc1 ZINC000348525653 1122892235 /nfs/dbraw/zinc/89/22/35/1122892235.db2.gz PDPZCWMSIIIWCL-HNNXBMFYSA-N 1 1 268.316 3.542 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507106308 1122926169 /nfs/dbraw/zinc/92/61/69/1122926169.db2.gz XHBVNTUXOYNHFW-KRWDZBQOSA-N 1 1 296.370 3.893 20 5 CHBDMO CCCC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CC1 ZINC000507189809 1122938091 /nfs/dbraw/zinc/93/80/91/1122938091.db2.gz CAALWRIXAYRCST-VURMDHGXSA-N 1 1 274.364 3.873 20 5 CHBDMO O=[N+]([O-])c1cc(C[N@H+]2CCCC3(CCCC3)C2)cs1 ZINC000438347601 1122961362 /nfs/dbraw/zinc/96/13/62/1122961362.db2.gz UMOIWIJSUGCCNB-UHFFFAOYSA-N 1 1 280.393 3.813 20 5 CHBDMO CCCCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000776579246 1123401467 /nfs/dbraw/zinc/40/14/67/1123401467.db2.gz KJCLTFYLNWCRKI-MRXNPFEDSA-N 1 1 294.395 3.529 20 5 CHBDMO CC[N@@H+](CCC1CC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000545519101 1123920684 /nfs/dbraw/zinc/92/06/84/1123920684.db2.gz UEBVWSDADQDZBE-UHFFFAOYSA-N 1 1 282.771 3.870 20 5 CHBDMO Cc1nc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000037668337 1129164530 /nfs/dbraw/zinc/16/45/30/1129164530.db2.gz FJBHABLYBIAQBN-VIFPVBQESA-N 1 1 291.376 3.519 20 5 CHBDMO CC[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000446722392 1124120585 /nfs/dbraw/zinc/12/05/85/1124120585.db2.gz FLCIEXGGXBRJAM-ZDUSSCGKSA-N 1 1 292.379 3.614 20 5 CHBDMO COc1ccc(C[N@H+]2C[C@@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] ZINC000525637971 1124451494 /nfs/dbraw/zinc/45/14/94/1124451494.db2.gz MRVFYOWGTOFCKZ-QWHCGFSZSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872017531 1124656703 /nfs/dbraw/zinc/65/67/03/1124656703.db2.gz BGRAUWXDYQQKHN-LBPRGKRZSA-N 1 1 288.322 3.893 20 5 CHBDMO Cc1csc(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1 ZINC000872075954 1124675794 /nfs/dbraw/zinc/67/57/94/1124675794.db2.gz GXJJCJDLEZUGNX-JTQLQIEISA-N 1 1 294.351 3.955 20 5 CHBDMO C[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1c(F)cccc1[N+](=O)[O-] ZINC000872078020 1124676742 /nfs/dbraw/zinc/67/67/42/1124676742.db2.gz DQYPEPJHZICXPV-HOSYDEDBSA-N 1 1 284.306 3.665 20 5 CHBDMO C[C@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000530902748 1125185941 /nfs/dbraw/zinc/18/59/41/1125185941.db2.gz ZYRZRRBTLHDHLS-SUMWQHHRSA-N 1 1 282.343 3.788 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000530902748 1125185947 /nfs/dbraw/zinc/18/59/47/1125185947.db2.gz ZYRZRRBTLHDHLS-SUMWQHHRSA-N 1 1 282.343 3.788 20 5 CHBDMO Cc1ccc(C[N@@H+](CC2CC2)C2CCC2)cc1[N+](=O)[O-] ZINC000475675171 1125196690 /nfs/dbraw/zinc/19/66/90/1125196690.db2.gz RWEDZOKASQPWCG-UHFFFAOYSA-N 1 1 274.364 3.668 20 5 CHBDMO C[C@@H]1[C@H](c2ccccc2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000531202532 1125200734 /nfs/dbraw/zinc/20/07/34/1125200734.db2.gz QSGLMCHWFXHFGL-RDTXWAMCSA-N 1 1 296.370 3.973 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CC2CC2)CC2CCC2)c1 ZINC000475679154 1125222462 /nfs/dbraw/zinc/22/24/62/1125222462.db2.gz YVWUBBLGTMHAFL-UHFFFAOYSA-N 1 1 274.364 3.607 20 5 CHBDMO CCC[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000532326840 1125249222 /nfs/dbraw/zinc/24/92/22/1125249222.db2.gz LMIVVCIVXBYBJG-ZDUSSCGKSA-N 1 1 262.353 3.607 20 5 CHBDMO CC(C)C[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001168146851 1125263190 /nfs/dbraw/zinc/26/31/90/1125263190.db2.gz SUSDHCPLOGGVLN-CQSZACIVSA-N 1 1 276.380 3.853 20 5 CHBDMO C[C@@H]([NH2+]Cc1cnc(Cl)s1)c1ccc([N+](=O)[O-])cc1 ZINC000718188411 1129258097 /nfs/dbraw/zinc/25/80/97/1129258097.db2.gz ATGZISRDYOOBHQ-MRVPVSSYSA-N 1 1 297.767 3.556 20 5 CHBDMO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)CC1CCCCC1 ZINC000094774535 1129452065 /nfs/dbraw/zinc/45/20/65/1129452065.db2.gz SBPVFJGAJNVTIJ-UHFFFAOYSA-N 1 1 280.343 3.746 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCCCC1 ZINC000094774128 1129452079 /nfs/dbraw/zinc/45/20/79/1129452079.db2.gz BKDLRPDPDPBNKK-UHFFFAOYSA-N 1 1 280.343 3.889 20 5 CHBDMO Cc1cscc1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000094877013 1129454751 /nfs/dbraw/zinc/45/47/51/1129454751.db2.gz JBBWRZNZXRYFEV-UHFFFAOYSA-N 1 1 296.779 3.908 20 5 CHBDMO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCCC[C@H]2c2ccccc2)C1 ZINC001169006020 1129689173 /nfs/dbraw/zinc/68/91/73/1129689173.db2.gz FIPBYULVNOJYAP-PVAVHDDUSA-N 1 1 288.391 3.659 20 5 CHBDMO C[N@H+](Cc1cccs1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655260 1130135259 /nfs/dbraw/zinc/13/52/59/1130135259.db2.gz UXZNFTQVSMHHNP-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[N@@H+](Cc1cccs1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746655260 1130135261 /nfs/dbraw/zinc/13/52/61/1130135261.db2.gz UXZNFTQVSMHHNP-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO CC(C)[C@H](C)[N@@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746654668 1130135373 /nfs/dbraw/zinc/13/53/73/1130135373.db2.gz JYYZSNPPWJZJAW-JTQLQIEISA-N 1 1 270.760 3.725 20 5 CHBDMO CC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC(C)C ZINC000746674276 1130145630 /nfs/dbraw/zinc/14/56/30/1130145630.db2.gz SJSDCTBNBWYABK-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC001170281244 1130477822 /nfs/dbraw/zinc/47/78/22/1130477822.db2.gz ZGQNXNLAIZUUAS-GXTWGEPZSA-N 1 1 276.380 3.914 20 5 CHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783678030 1130847170 /nfs/dbraw/zinc/84/71/70/1130847170.db2.gz BCZSWMOMLCIVPU-MFKMUULPSA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@@H](C)C[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000037173076 1132006649 /nfs/dbraw/zinc/00/66/49/1132006649.db2.gz NBGVGJUXHAUOQF-SNVBAGLBSA-N 1 1 270.760 3.726 20 5 CHBDMO CC[C@@H](C)[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172906301 1132348328 /nfs/dbraw/zinc/34/83/28/1132348328.db2.gz XAQBKBACKQGTJS-IUODEOHRSA-N 1 1 276.380 3.573 20 5 CHBDMO CC[C@@H](C)[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172906295 1132348830 /nfs/dbraw/zinc/34/88/30/1132348830.db2.gz XAQBKBACKQGTJS-DOMZBBRYSA-N 1 1 276.380 3.573 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC12CCCC2 ZINC001173220737 1132411751 /nfs/dbraw/zinc/41/17/51/1132411751.db2.gz CCLGFAIKYOAVQY-CYBMUJFWSA-N 1 1 274.364 3.544 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC2(CCCC2)C1 ZINC001173228148 1132412308 /nfs/dbraw/zinc/41/23/08/1132412308.db2.gz UAZDLLNUAVXQSM-CQSZACIVSA-N 1 1 288.391 3.792 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](C)(F)CC1 ZINC001173229114 1132412817 /nfs/dbraw/zinc/41/28/17/1132412817.db2.gz PZRCPOGRUSSVTJ-CJNGLKHVSA-N 1 1 294.370 3.740 20 5 CHBDMO CC[C@@H]1CC[C@@H](C)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001174614575 1132942754 /nfs/dbraw/zinc/94/27/54/1132942754.db2.gz HTAWGZYVHPWIGR-VXGBXAGGSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)CC(C)(C)C ZINC001204374561 1133441266 /nfs/dbraw/zinc/44/12/66/1133441266.db2.gz MTXGNXRTNZIYJB-UHFFFAOYSA-N 1 1 264.369 3.690 20 5 CHBDMO Cc1c(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000519968895 260035534 /nfs/dbraw/zinc/03/55/34/260035534.db2.gz UFZFOHOFEHLEQK-DOMZBBRYSA-N 1 1 276.380 3.914 20 5 CHBDMO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CSc3ccccc32)cs1 ZINC000344440597 225075121 /nfs/dbraw/zinc/07/51/21/225075121.db2.gz VFWBYDFIVMXHLC-LLVKDONJSA-N 1 1 292.385 3.593 20 5 CHBDMO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1nccs1 ZINC000080277432 260179696 /nfs/dbraw/zinc/17/96/96/260179696.db2.gz KYSHZHAUUDXFLV-GFCCVEGCSA-N 1 1 291.376 3.601 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccsc2Cl)cc1 ZINC000312624835 260185391 /nfs/dbraw/zinc/18/53/91/260185391.db2.gz NJCXLAALQHOTQZ-UHFFFAOYSA-N 1 1 282.752 3.600 20 5 CHBDMO CC[N@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1F ZINC000313616372 260305251 /nfs/dbraw/zinc/30/52/51/260305251.db2.gz FAHNWAQVRCOGJN-UHFFFAOYSA-N 1 1 294.351 3.818 20 5 CHBDMO CC[N@@H+](Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1F ZINC000313616372 260305253 /nfs/dbraw/zinc/30/52/53/260305253.db2.gz FAHNWAQVRCOGJN-UHFFFAOYSA-N 1 1 294.351 3.818 20 5 CHBDMO Cc1c(Cn2c[nH+]c3c2C[C@@H](C)[C@H](C)C3)cccc1[N+](=O)[O-] ZINC000319241429 327872030 /nfs/dbraw/zinc/87/20/30/327872030.db2.gz MPJYBSWVYNYXLH-VXGBXAGGSA-N 1 1 299.374 3.519 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCCC[C@H]1C ZINC000255955120 327037231 /nfs/dbraw/zinc/03/72/31/327037231.db2.gz SZAPHYCDVLUGDT-IUODEOHRSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H]1C[C@@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000184897352 329263658 /nfs/dbraw/zinc/26/36/58/329263658.db2.gz YQGWQSWJYJANDW-DYVFJYSZSA-N 1 1 297.358 3.573 20 5 CHBDMO C[C@@H]1C[C@H](c2cccnc2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000184897310 329263731 /nfs/dbraw/zinc/26/37/31/329263731.db2.gz YQGWQSWJYJANDW-CXAGYDPISA-N 1 1 297.358 3.573 20 5 CHBDMO Cc1ccc(C[N@H+](C)[C@@H]2CC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000433035692 330128401 /nfs/dbraw/zinc/12/84/01/330128401.db2.gz NRGAOLBONJSEKA-SMDDNHRTSA-N 1 1 262.353 3.524 20 5 CHBDMO CC(C)[C@H]1CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000445428456 330216115 /nfs/dbraw/zinc/21/61/15/330216115.db2.gz WJGOQIDUDYUYKD-JSGCOSHPSA-N 1 1 262.353 3.634 20 5 CHBDMO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000035256244 330244500 /nfs/dbraw/zinc/24/45/00/330244500.db2.gz BOCOKUWMZQLZME-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCCCCC1 ZINC000108079905 330351812 /nfs/dbraw/zinc/35/18/12/330351812.db2.gz AEUNHGUZPYUVNZ-UHFFFAOYSA-N 1 1 276.380 3.792 20 5 CHBDMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCC(F)(F)C1 ZINC000450941017 331008225 /nfs/dbraw/zinc/00/82/25/331008225.db2.gz PGVBZXYQBIRBKS-ZDUSSCGKSA-N 1 1 298.333 3.505 20 5 CHBDMO Cc1cccc([C@H](C)[NH2+]Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000452089312 331053704 /nfs/dbraw/zinc/05/37/04/331053704.db2.gz PRGZIPUNZFHFEA-LBPRGKRZSA-N 1 1 288.322 3.893 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC(C)(C)C1 ZINC000490092079 332081009 /nfs/dbraw/zinc/08/10/09/332081009.db2.gz XYACLOMXGBMLBM-GFCCVEGCSA-N 1 1 262.353 3.696 20 5 CHBDMO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)CC1CC1 ZINC000492416213 332396552 /nfs/dbraw/zinc/39/65/52/332396552.db2.gz JKPOPMBQOORSRT-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO Cc1c(CNc2cc[nH+]cc2Cl)cccc1[N+](=O)[O-] ZINC000231869059 333330992 /nfs/dbraw/zinc/33/09/92/333330992.db2.gz QDOFGHHLDJAJTJ-UHFFFAOYSA-N 1 1 277.711 3.564 20 5 CHBDMO CC[C@H]1CCCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000524610295 333368749 /nfs/dbraw/zinc/36/87/49/333368749.db2.gz XRLISXNGBRSMOD-AWEZNQCLSA-N 1 1 292.379 3.628 20 5 CHBDMO Cc1cc[nH+]c(N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000538510318 333601728 /nfs/dbraw/zinc/60/17/28/333601728.db2.gz ZPQCJMOCCQUDBD-GFCCVEGCSA-N 1 1 271.320 3.780 20 5 CHBDMO CC[C@H]1CC[C@H](C)[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000564324904 334101141 /nfs/dbraw/zinc/10/11/41/334101141.db2.gz JIVDRTIKERMZED-JSGCOSHPSA-N 1 1 262.353 3.666 20 5 CHBDMO C[C@H]1CCCCC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000547931338 334129889 /nfs/dbraw/zinc/12/98/89/334129889.db2.gz JZHYRYDFUNLXLB-RNVIBTMRSA-N 1 1 274.364 3.873 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1Cc1ccccc1 ZINC000247333956 334279250 /nfs/dbraw/zinc/27/92/50/334279250.db2.gz PZPARNVOTDXTTD-KRWDZBQOSA-N 1 1 296.370 3.802 20 5 CHBDMO C[C@@H](c1ccccc1)[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000581100416 336008281 /nfs/dbraw/zinc/00/82/81/336008281.db2.gz MWCFWRKFDYNUJZ-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO C[C@@H](c1ccccc1)[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1 ZINC000581100416 336008282 /nfs/dbraw/zinc/00/82/82/336008282.db2.gz MWCFWRKFDYNUJZ-ZDUSSCGKSA-N 1 1 298.342 3.550 20 5 CHBDMO CC[C@H](c1ccncc1)[N@@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000130172413 522965081 /nfs/dbraw/zinc/96/50/81/522965081.db2.gz NUKYCZJRQWGDDU-MRXNPFEDSA-N 1 1 299.374 3.881 20 5 CHBDMO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)o1 ZINC000037668277 525509609 /nfs/dbraw/zinc/50/96/09/525509609.db2.gz KBACBOLSOSDTFR-IAQYHMDHSA-N 1 1 286.331 3.601 20 5 CHBDMO CSC[C@@H]1CCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000292453506 525652747 /nfs/dbraw/zinc/65/27/47/525652747.db2.gz PQTBXNRCVVKRHP-QWHCGFSZSA-N 1 1 294.420 3.731 20 5 CHBDMO Cc1csc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)n1 ZINC000069168424 526413302 /nfs/dbraw/zinc/41/33/02/526413302.db2.gz GFOKLLCZRBXPDQ-LLVKDONJSA-N 1 1 291.376 3.519 20 5 CHBDMO C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001190660482 1122548456 /nfs/dbraw/zinc/54/84/56/1122548456.db2.gz KEHREJCNUDZGOP-LLVKDONJSA-N 1 1 282.771 3.870 20 5 CHBDMO Cc1coc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000886010602 1125636965 /nfs/dbraw/zinc/63/69/65/1125636965.db2.gz LURBIRKIFZHUBG-GFCCVEGCSA-N 1 1 274.320 3.655 20 5 CHBDMO C[C@@H](c1ccccc1)[N@H+](Cc1cccnc1[N+](=O)[O-])C1CC1 ZINC000886054420 1125641937 /nfs/dbraw/zinc/64/19/37/1125641937.db2.gz BWLCYWHPDGAQLA-ZDUSSCGKSA-N 1 1 297.358 3.715 20 5 CHBDMO C[C@@H](c1ccccc1)[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CC1 ZINC000886054420 1125641939 /nfs/dbraw/zinc/64/19/39/1125641939.db2.gz BWLCYWHPDGAQLA-ZDUSSCGKSA-N 1 1 297.358 3.715 20 5 CHBDMO C[C@@]1(C2CCCCC2)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC000886312163 1125669041 /nfs/dbraw/zinc/66/90/41/1125669041.db2.gz VIPAVMSPVARUGN-INIZCTEOSA-N 1 1 289.379 3.535 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H](C)C1 ZINC000482293841 1126749514 /nfs/dbraw/zinc/74/95/14/1126749514.db2.gz SHQXIQMASYJZNX-GFCCVEGCSA-N 1 1 262.353 3.525 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC(C)=C(C)C1 ZINC000482457082 1126756891 /nfs/dbraw/zinc/75/68/91/1126756891.db2.gz JBPBQDOBDMXFQM-UHFFFAOYSA-N 1 1 290.363 3.536 20 5 CHBDMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC(C)=C(C)C1 ZINC000482457082 1126756893 /nfs/dbraw/zinc/75/68/93/1126756893.db2.gz JBPBQDOBDMXFQM-UHFFFAOYSA-N 1 1 290.363 3.536 20 5 CHBDMO CC[C@H]1[C@H](C)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000482489455 1126761052 /nfs/dbraw/zinc/76/10/52/1126761052.db2.gz KJWJYVJZIUHWQI-ABAIWWIYSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[C@@H]1[C@H](C)CC[N@H+]1Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000482507479 1126762177 /nfs/dbraw/zinc/76/21/77/1126762177.db2.gz JNLYCRAWSMKSHQ-TZMCWYRMSA-N 1 1 262.353 3.524 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccs1)C1CC1 ZINC000045006613 1127167105 /nfs/dbraw/zinc/16/71/05/1127167105.db2.gz QHPZASKRIAHTLM-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1cccs1)C1CC1 ZINC000045006613 1127167108 /nfs/dbraw/zinc/16/71/08/1127167108.db2.gz QHPZASKRIAHTLM-UHFFFAOYSA-N 1 1 288.372 3.821 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1c(F)cccc1[N+](=O)[O-] ZINC000588977337 1127209194 /nfs/dbraw/zinc/20/91/94/1127209194.db2.gz WEWMUTZSDIWVGF-UHFFFAOYSA-N 1 1 268.332 3.744 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H](C2CC2)C1 ZINC000589209392 1127216223 /nfs/dbraw/zinc/21/62/23/1127216223.db2.gz KXHRHBVMMGDYNU-WUTVXBCWSA-N 1 1 286.375 3.730 20 5 CHBDMO CC1(C)C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCC[C@@H]21 ZINC000590204420 1127251351 /nfs/dbraw/zinc/25/13/51/1127251351.db2.gz IEXOXACGTIRLIE-WFASDCNBSA-N 1 1 292.354 3.744 20 5 CHBDMO CC1(C)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@@H]21 ZINC000590204440 1127251564 /nfs/dbraw/zinc/25/15/64/1127251564.db2.gz MMPXQBMFCIKLGR-LSDHHAIUSA-N 1 1 274.364 3.605 20 5 CHBDMO CCS[C@@H]1CCCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000353611236 1127271265 /nfs/dbraw/zinc/27/12/65/1127271265.db2.gz YEQYOQKPFKENDO-OAHLLOKOSA-N 1 1 294.420 3.702 20 5 CHBDMO O[C@H]1CC[N@@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000157665107 1127349077 /nfs/dbraw/zinc/34/90/77/1127349077.db2.gz OTBAFWFIUQXIGJ-INIZCTEOSA-N 1 1 277.367 3.560 20 5 CHBDMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccsc1 ZINC000595006193 1127445894 /nfs/dbraw/zinc/44/58/94/1127445894.db2.gz GXSCEVQXDRVSRP-JTQLQIEISA-N 1 1 292.360 3.516 20 5 CHBDMO Cc1noc(C[N@H+](CCC(C)C)C2CCCC2)c1[N+](=O)[O-] ZINC000595296741 1127457204 /nfs/dbraw/zinc/45/72/04/1127457204.db2.gz IGXFHAKRDDESQT-UHFFFAOYSA-N 1 1 295.383 3.682 20 5 CHBDMO CC[C@@H](CC(F)F)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000595289093 1127458376 /nfs/dbraw/zinc/45/83/76/1127458376.db2.gz NZBIOCDKTIIFOY-NSHDSACASA-N 1 1 286.322 3.708 20 5 CHBDMO Cc1noc(C[N@H+]2CCC[C@@H](C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000595321182 1127459434 /nfs/dbraw/zinc/45/94/34/1127459434.db2.gz KTIFFIJGHHBYCW-GFCCVEGCSA-N 1 1 295.383 3.539 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595565528 1127465353 /nfs/dbraw/zinc/46/53/53/1127465353.db2.gz AHFVUUVFWRVUGC-WWGRRREGSA-N 1 1 274.364 3.839 20 5 CHBDMO C[C@@H]1CCC[N@H+]1Cc1cccc(-c2ccc([N+](=O)[O-])nc2)c1 ZINC000596637411 1127513993 /nfs/dbraw/zinc/51/39/93/1127513993.db2.gz KTGLZCNZQGMCAD-CYBMUJFWSA-N 1 1 297.358 3.641 20 5 CHBDMO CC[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C[C@H](C)OC ZINC000361025656 1127531518 /nfs/dbraw/zinc/53/15/18/1127531518.db2.gz NWQPSNOVCAYITH-ZDUSSCGKSA-N 1 1 294.395 3.575 20 5 CHBDMO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H]4C[C@H]4C3)o2)cc1 ZINC000597222439 1127536068 /nfs/dbraw/zinc/53/60/68/1127536068.db2.gz CMZYBDVSSKRDQH-KBPBESRZSA-N 1 1 298.342 3.697 20 5 CHBDMO CC[C@@H]1CC[C@@H](C)[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000362187307 1127617947 /nfs/dbraw/zinc/61/79/47/1127617947.db2.gz DBZJOXICYSYMHD-ZYHUDNBSSA-N 1 1 296.342 3.505 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000362187304 1127617961 /nfs/dbraw/zinc/61/79/61/1127617961.db2.gz DBZJOXICYSYMHD-CMPLNLGQSA-N 1 1 296.342 3.505 20 5 CHBDMO COc1cc(C[NH+]2[C@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1F ZINC000362325991 1127628410 /nfs/dbraw/zinc/62/84/10/1127628410.db2.gz UODABRWXYGUYBC-GHMZBOCLSA-N 1 1 296.342 3.505 20 5 CHBDMO CCC(=O)CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000295441103 1127643210 /nfs/dbraw/zinc/64/32/10/1127643210.db2.gz GJXHFAGIWOJRHA-UHFFFAOYSA-N 1 1 292.379 3.565 20 5 CHBDMO CCC(CC)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000604434832 1127705374 /nfs/dbraw/zinc/70/53/74/1127705374.db2.gz YNBOXEKUWLQOHI-UHFFFAOYSA-N 1 1 292.379 3.627 20 5 CHBDMO C[N@H+](Cc1ccc(Cl)s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000061759366 1127715686 /nfs/dbraw/zinc/71/56/86/1127715686.db2.gz CPTOCPULJANMPT-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[N@@H+](Cc1ccc(Cl)s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000061759366 1127715688 /nfs/dbraw/zinc/71/56/88/1127715688.db2.gz CPTOCPULJANMPT-UHFFFAOYSA-N 1 1 296.779 3.942 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)Cc1ccccc1F ZINC000061780211 1127716608 /nfs/dbraw/zinc/71/66/08/1127716608.db2.gz UTHFEJHAPZKIMO-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccccc1F ZINC000061780211 1127716612 /nfs/dbraw/zinc/71/66/12/1127716612.db2.gz UTHFEJHAPZKIMO-GFCCVEGCSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@H](C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000608976740 1127896554 /nfs/dbraw/zinc/89/65/54/1127896554.db2.gz MFNCBMLEDZODOL-CQSZACIVSA-N 1 1 284.359 3.830 20 5 CHBDMO C[C@@H](C[N@@H+](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000608977261 1127895993 /nfs/dbraw/zinc/89/59/93/1127895993.db2.gz WKZSUSWFCJKPLH-AWEZNQCLSA-N 1 1 284.359 3.830 20 5 CHBDMO C[C@@H](C[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000608976710 1127896732 /nfs/dbraw/zinc/89/67/32/1127896732.db2.gz JGMIVFLSDZQIPS-AWEZNQCLSA-N 1 1 284.359 3.830 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000544116848 1127959656 /nfs/dbraw/zinc/95/96/56/1127959656.db2.gz KKGCFDFTKBKRJQ-UONOGXRCSA-N 1 1 274.364 3.944 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000544610925 1127978307 /nfs/dbraw/zinc/97/83/07/1127978307.db2.gz FOEKJJCZEODVTK-GASCZTMLSA-N 1 1 274.364 3.525 20 5 CHBDMO CC[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1C ZINC000544612067 1127979579 /nfs/dbraw/zinc/97/95/79/1127979579.db2.gz XCLWUGLXMADCNQ-SMDDNHRTSA-N 1 1 262.353 3.524 20 5 CHBDMO CC[N@@H+](CCC1CC1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000544896330 1127989321 /nfs/dbraw/zinc/98/93/21/1127989321.db2.gz AXRANWKTBXKAMA-LBPRGKRZSA-N 1 1 262.353 3.778 20 5 CHBDMO CC[C@]1(C)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000468136739 1127995006 /nfs/dbraw/zinc/99/50/06/1127995006.db2.gz AIXQRXXTNGOSSU-OAHLLOKOSA-N 1 1 262.353 3.525 20 5 CHBDMO CS[C@@H]1CCCC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468258102 1128000378 /nfs/dbraw/zinc/00/03/78/1128000378.db2.gz AVGHYVXOISAXKT-QWHCGFSZSA-N 1 1 294.420 3.873 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCCC[C@@H](C)C1 ZINC000468257579 1127999294 /nfs/dbraw/zinc/99/92/94/1127999294.db2.gz SUNANIUJYJEGTC-OLZOCXBDSA-N 1 1 262.353 3.778 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@H](C)C(C)(C)C)c([N+](=O)[O-])cc1F ZINC000545206066 1128004466 /nfs/dbraw/zinc/00/44/66/1128004466.db2.gz IKNCFIIPABOJFX-SNVBAGLBSA-N 1 1 298.358 3.609 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](C)[C@H]1C ZINC000541770315 1128038430 /nfs/dbraw/zinc/03/84/30/1128038430.db2.gz FDVKOJSTSDDTCB-DGCLKSJQSA-N 1 1 262.353 3.524 20 5 CHBDMO CC(C)CSCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000443627466 1128043656 /nfs/dbraw/zinc/04/36/56/1128043656.db2.gz QAHVXQZMTDSGSC-UHFFFAOYSA-N 1 1 296.436 3.806 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C(C1CC1)C1CC1 ZINC000542000351 1128047449 /nfs/dbraw/zinc/04/74/49/1128047449.db2.gz QJDVQODFBHKACM-UHFFFAOYSA-N 1 1 294.782 3.869 20 5 CHBDMO CC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C(C)C ZINC000470175012 1128064698 /nfs/dbraw/zinc/06/46/98/1128064698.db2.gz XPXLXIXXLRYZRP-UKTHLTGXSA-N 1 1 262.353 3.728 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C)[C@@H]1C ZINC000470180542 1128064917 /nfs/dbraw/zinc/06/49/17/1128064917.db2.gz OQZOPUGEGPPXTC-BHBDMTODSA-N 1 1 274.364 3.728 20 5 CHBDMO Cc1cc([NH+](C)C)cc(C)c1NCc1cccc([N+](=O)[O-])c1 ZINC000152380801 1128118559 /nfs/dbraw/zinc/11/85/59/1128118559.db2.gz OQXPYWNWZGRBJF-UHFFFAOYSA-N 1 1 299.374 3.890 20 5 CHBDMO CC[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)CC(C)C ZINC000761505994 1128132215 /nfs/dbraw/zinc/13/22/15/1128132215.db2.gz KZMINJVZOHHIHC-UHFFFAOYSA-N 1 1 270.760 3.726 20 5 CHBDMO C[N@@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761509957 1128132449 /nfs/dbraw/zinc/13/24/49/1128132449.db2.gz DTMUUCRIJJJGAC-UHFFFAOYSA-N 1 1 290.750 3.880 20 5 CHBDMO C[C@H]([N@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-])C1(C)CC1 ZINC000493310366 1128138521 /nfs/dbraw/zinc/13/85/21/1128138521.db2.gz KIMVZFYURLOCAQ-JTQLQIEISA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@H]([N@@H+](C)Cc1c(Cl)cccc1[N+](=O)[O-])C1(C)CC1 ZINC000493310366 1128138522 /nfs/dbraw/zinc/13/85/22/1128138522.db2.gz KIMVZFYURLOCAQ-JTQLQIEISA-N 1 1 282.771 3.869 20 5 CHBDMO CC[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000609194477 1128170674 /nfs/dbraw/zinc/17/06/74/1128170674.db2.gz OHIWICHNTNMWTR-AWEZNQCLSA-N 1 1 292.379 3.756 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C)C1 ZINC000609193717 1128170952 /nfs/dbraw/zinc/17/09/52/1128170952.db2.gz YOMKLKZOQVROCG-CYBMUJFWSA-N 1 1 292.379 3.614 20 5 CHBDMO C[C@@H]1CCCC[N@H+]1CCCCNc1ccccc1[N+](=O)[O-] ZINC000301069829 1128301435 /nfs/dbraw/zinc/30/14/35/1128301435.db2.gz DMBYVDILCAFYIE-CQSZACIVSA-N 1 1 291.395 3.661 20 5 CHBDMO C[C@@H](C[N@H+]1Cc2ccc([N+](=O)[O-])cc2C1)C(C)(C)C ZINC001327187824 1128345213 /nfs/dbraw/zinc/34/52/13/1128345213.db2.gz NGJAEKXTKABHSZ-NSHDSACASA-N 1 1 262.353 3.593 20 5 CHBDMO C[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000154218699 1128460071 /nfs/dbraw/zinc/46/00/71/1128460071.db2.gz DYOMXPPFKYKFSU-AOOOYVTPSA-N 1 1 268.744 3.621 20 5 CHBDMO CC(C)CC[N@@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000072579059 1117769474 /nfs/dbraw/zinc/76/94/74/1117769474.db2.gz YWGMHBHCPDOTAA-GFCCVEGCSA-N 1 1 250.342 3.634 20 5 CHBDMO CC[C@H]1CC[N@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000430193496 1117834559 /nfs/dbraw/zinc/83/45/59/1117834559.db2.gz FJBQNRBUSIOIIH-ZDUSSCGKSA-N 1 1 262.353 3.703 20 5 CHBDMO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)C1CCCCC1 ZINC000430208370 1117870466 /nfs/dbraw/zinc/87/04/66/1117870466.db2.gz OPHVLKLVRLQSMF-UHFFFAOYSA-N 1 1 292.379 3.758 20 5 CHBDMO CC1(C)CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000610216291 1117884033 /nfs/dbraw/zinc/88/40/33/1117884033.db2.gz GOMVZRCAATWAMY-UHFFFAOYSA-N 1 1 262.353 3.607 20 5 CHBDMO CC[C@H]1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000509535926 1117958452 /nfs/dbraw/zinc/95/84/52/1117958452.db2.gz AEDVNCQHEJFENM-MRZGDXHCSA-N 1 1 274.364 3.730 20 5 CHBDMO CC1=C[C@H](C)C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000430284711 1117993061 /nfs/dbraw/zinc/99/30/61/1117993061.db2.gz OVDUSJLZULTVCY-AAEUAGOBSA-N 1 1 260.337 3.554 20 5 CHBDMO CC1=C[C@H](C)C[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000430284714 1117993274 /nfs/dbraw/zinc/99/32/74/1117993274.db2.gz OVDUSJLZULTVCY-WCQYABFASA-N 1 1 260.337 3.554 20 5 CHBDMO C[C@@H]1CCCC[C@H]1[N@@H+](C)Cc1csc([N+](=O)[O-])c1 ZINC000547747057 1117996523 /nfs/dbraw/zinc/99/65/23/1117996523.db2.gz AICDNNCFNFAFRM-ZYHUDNBSSA-N 1 1 268.382 3.667 20 5 CHBDMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H]1C1CC1 ZINC000615835589 1128764249 /nfs/dbraw/zinc/76/42/49/1128764249.db2.gz TYWXAQDVWOAMFW-RTGRKSDTSA-N 1 1 286.375 3.873 20 5 CHBDMO Cc1ccc(C[N@@H+]2CC3(CCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000432789117 1118478629 /nfs/dbraw/zinc/47/86/29/1118478629.db2.gz PMNWMWWOGKUKGW-ZDUSSCGKSA-N 1 1 274.364 3.668 20 5 CHBDMO C[N@@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000493891819 1118644250 /nfs/dbraw/zinc/64/42/50/1118644250.db2.gz PXBAIKHJTULFTG-UHFFFAOYSA-N 1 1 294.782 3.869 20 5 CHBDMO CCn1ccc(C[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000616785305 1128799468 /nfs/dbraw/zinc/79/94/68/1128799468.db2.gz MRHJKKKQBBZFFW-CYBMUJFWSA-N 1 1 287.363 3.609 20 5 CHBDMO CCn1ccc(C[N@@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000616785305 1128799470 /nfs/dbraw/zinc/79/94/70/1128799470.db2.gz MRHJKKKQBBZFFW-CYBMUJFWSA-N 1 1 287.363 3.609 20 5 CHBDMO COC(C)(C)C[N@@H+](C)Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000535850285 1118907142 /nfs/dbraw/zinc/90/71/42/1118907142.db2.gz QEWDXCHZUABJBS-UHFFFAOYSA-N 1 1 294.395 3.575 20 5 CHBDMO C[C@H](C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000511105283 1119062390 /nfs/dbraw/zinc/06/23/90/1119062390.db2.gz IPWOJOIHKJRQOX-OAHLLOKOSA-N 1 1 298.386 3.873 20 5 CHBDMO C[C@H]1CCC[C@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000479579261 1119125354 /nfs/dbraw/zinc/12/53/54/1119125354.db2.gz NTWFDMBBDZSRHX-WFASDCNBSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@H](c1ccccc1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000536000682 1119345006 /nfs/dbraw/zinc/34/50/06/1119345006.db2.gz HVBYUIVZNXIOTC-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2ccncc2)C1 ZINC000583603105 1119384151 /nfs/dbraw/zinc/38/41/51/1119384151.db2.gz UUMXNDKARUPQEH-HIFRSBDPSA-N 1 1 297.358 3.540 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)Cc1ccc(F)cc1 ZINC000066562477 1119912914 /nfs/dbraw/zinc/91/29/14/1119912914.db2.gz VYTIWCHMDIUVPG-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C)CC[C@@H]1C ZINC000542701427 1120122151 /nfs/dbraw/zinc/12/21/51/1120122151.db2.gz FDIKXQCYPQTBHL-YPMHNXCESA-N 1 1 262.353 3.524 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccsc2C1 ZINC000341041344 1120191870 /nfs/dbraw/zinc/19/18/70/1120191870.db2.gz GIHMPYPLTLLWPY-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2ccsc2C1 ZINC000341041344 1120191871 /nfs/dbraw/zinc/19/18/71/1120191871.db2.gz GIHMPYPLTLLWPY-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO Cc1ccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC000077207557 1120318244 /nfs/dbraw/zinc/31/82/44/1120318244.db2.gz AMDWDJTXDHGNBL-UHFFFAOYSA-N 1 1 276.361 3.597 20 5 CHBDMO Cc1ccoc1C[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000312648512 1120522696 /nfs/dbraw/zinc/52/26/96/1120522696.db2.gz FGSAVKGFCBXZQB-UHFFFAOYSA-N 1 1 294.738 3.782 20 5 CHBDMO Cc1ccoc1C[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000312648512 1120522701 /nfs/dbraw/zinc/52/27/01/1120522701.db2.gz FGSAVKGFCBXZQB-UHFFFAOYSA-N 1 1 294.738 3.782 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)C2CCC2)cc1[N+](=O)[O-] ZINC000093475823 1120560672 /nfs/dbraw/zinc/56/06/72/1120560672.db2.gz MKAALIIBKYXBAA-UHFFFAOYSA-N 1 1 262.353 3.703 20 5 CHBDMO CC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)C1CCC1 ZINC000470174892 1120605625 /nfs/dbraw/zinc/60/56/25/1120605625.db2.gz NPNJJMILDPMEMX-JLHYYAGUSA-N 1 1 274.364 3.873 20 5 CHBDMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCCCC2)c1 ZINC000338899805 1120639889 /nfs/dbraw/zinc/63/98/89/1120639889.db2.gz CUKPBGDZBRBTQN-UHFFFAOYSA-N 1 1 288.269 3.600 20 5 CHBDMO CC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000509155322 1120679058 /nfs/dbraw/zinc/67/90/58/1120679058.db2.gz RYWJLQUAEWSSHM-LLVKDONJSA-N 1 1 268.332 3.600 20 5 CHBDMO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1(C)CCCC1 ZINC000618779819 1128938117 /nfs/dbraw/zinc/93/81/17/1128938117.db2.gz DNMYJXNJTFAHEO-UHFFFAOYSA-N 1 1 289.335 3.501 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1CCCC1 ZINC000107701348 1120721703 /nfs/dbraw/zinc/72/17/03/1120721703.db2.gz MYJMRNDGOZBTHL-GFCCVEGCSA-N 1 1 262.353 3.778 20 5 CHBDMO C[C@H]1CC[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000511970254 1120946296 /nfs/dbraw/zinc/94/62/96/1120946296.db2.gz BVRYCWBQXWWRIV-LBPRGKRZSA-N 1 1 286.331 3.697 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC000344004478 1121051234 /nfs/dbraw/zinc/05/12/34/1121051234.db2.gz ZRLUDOCQKCOMER-JTQLQIEISA-N 1 1 268.382 3.524 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)C[C@H]1CC1(C)C ZINC001174908300 1121087982 /nfs/dbraw/zinc/08/79/82/1121087982.db2.gz ZAACLRWAYGBKJU-QWHCGFSZSA-N 1 1 276.380 3.942 20 5 CHBDMO Cc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000051966768 1121481661 /nfs/dbraw/zinc/48/16/61/1121481661.db2.gz LVBQJYBYWCQLMY-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO Cc1ccc(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)o1 ZINC000051966768 1121481664 /nfs/dbraw/zinc/48/16/64/1121481664.db2.gz LVBQJYBYWCQLMY-UHFFFAOYSA-N 1 1 286.331 3.661 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-] ZINC000512653209 1121511186 /nfs/dbraw/zinc/51/11/86/1121511186.db2.gz VGMYTIWHJKWOGZ-YPMHNXCESA-N 1 1 262.353 3.524 20 5 CHBDMO CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccnc1 ZINC000611191207 1121630958 /nfs/dbraw/zinc/63/09/58/1121630958.db2.gz KGQLVFTUCNHIBK-CQSZACIVSA-N 1 1 299.374 3.615 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](C(F)F)C1 ZINC000611516946 1121653731 /nfs/dbraw/zinc/65/37/31/1121653731.db2.gz QAEBHUAKZBSNKK-MNOVXSKESA-N 1 1 284.306 3.551 20 5 CHBDMO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000035010019 1122148003 /nfs/dbraw/zinc/14/80/03/1122148003.db2.gz JUZRDWZZKOTBOU-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC001192481312 1122649997 /nfs/dbraw/zinc/64/99/97/1122649997.db2.gz LKLWKALARQQGME-AWEZNQCLSA-N 1 1 276.380 3.771 20 5 CHBDMO CC1(C)C[NH+](Cc2csc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC001193095204 1122678756 /nfs/dbraw/zinc/67/87/56/1122678756.db2.gz WMEWEWUFFIDJIE-UHFFFAOYSA-N 1 1 282.409 3.914 20 5 CHBDMO C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000438262863 1122689066 /nfs/dbraw/zinc/68/90/66/1122689066.db2.gz UFROPBUVIAOPQJ-UHFFFAOYSA-N 1 1 296.370 3.758 20 5 CHBDMO CC[N@@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000506356825 1122724127 /nfs/dbraw/zinc/72/41/27/1122724127.db2.gz QCAPAZZDCCJROW-UHFFFAOYSA-N 1 1 276.361 3.775 20 5 CHBDMO CC[C@@H]1CC[C@H](C)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC001194323332 1122765385 /nfs/dbraw/zinc/76/53/85/1122765385.db2.gz HTAWGZYVHPWIGR-NWDGAFQWSA-N 1 1 280.343 3.744 20 5 CHBDMO CSCCC[N@@H+](C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000439472201 1122781916 /nfs/dbraw/zinc/78/19/16/1122781916.db2.gz RMZCURCGQVIUHM-LBPRGKRZSA-N 1 1 282.409 3.649 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@@H+](CCc2ccccc2)C2CC2)c1 ZINC000506613556 1122791136 /nfs/dbraw/zinc/79/11/36/1122791136.db2.gz RNFIKPFELYDXKL-UHFFFAOYSA-N 1 1 296.370 3.802 20 5 CHBDMO Cc1ccc(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC001195509435 1122871384 /nfs/dbraw/zinc/87/13/84/1122871384.db2.gz WGTHFTYHBOYFIM-GJZGRUSLSA-N 1 1 274.364 3.668 20 5 CHBDMO Cc1ccc(F)c(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000507116156 1122927310 /nfs/dbraw/zinc/92/73/10/1122927310.db2.gz OEKOGLPLABRFIE-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccc(F)c(C[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000507116156 1122927316 /nfs/dbraw/zinc/92/73/16/1122927316.db2.gz OEKOGLPLABRFIE-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC(C)C[C@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000507170378 1122935079 /nfs/dbraw/zinc/93/50/79/1122935079.db2.gz MXJUQFFOCSILQO-CQSZACIVSA-N 1 1 262.353 3.605 20 5 CHBDMO CC(C)c1ccc(C[N@@H+](C)[C@H](C)C2CC2)cc1[N+](=O)[O-] ZINC000507439650 1122954924 /nfs/dbraw/zinc/95/49/24/1122954924.db2.gz DXAJTHWYSFHUOQ-GFCCVEGCSA-N 1 1 276.380 3.949 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)nc1 ZINC000930235895 1123403252 /nfs/dbraw/zinc/40/32/52/1123403252.db2.gz RSLGJYDHLPKERZ-MNOVXSKESA-N 1 1 289.310 3.541 20 5 CHBDMO Cc1c(C[N@H+](Cc2ccco2)C(C)C)cccc1[N+](=O)[O-] ZINC000346321950 1123678491 /nfs/dbraw/zinc/67/84/91/1123678491.db2.gz UGSUTLTTYYOYAR-UHFFFAOYSA-N 1 1 288.347 3.907 20 5 CHBDMO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000525273839 1124119808 /nfs/dbraw/zinc/11/98/08/1124119808.db2.gz ZKALKBJZKFXEEQ-INWMFGNUSA-N 1 1 274.364 3.748 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC2CCC1CC2 ZINC001119305072 1131250096 /nfs/dbraw/zinc/25/00/96/1131250096.db2.gz APZXVIBRJHVJBM-UHFFFAOYSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC2CCC1CC2 ZINC001119305072 1131250101 /nfs/dbraw/zinc/25/01/01/1131250101.db2.gz APZXVIBRJHVJBM-UHFFFAOYSA-N 1 1 280.755 3.623 20 5 CHBDMO Cc1ccccc1C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872019023 1124658388 /nfs/dbraw/zinc/65/83/88/1124658388.db2.gz SABCIJGJQZXDPJ-GFCCVEGCSA-N 1 1 288.322 3.893 20 5 CHBDMO Cc1ccsc1C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000093443715 1129423857 /nfs/dbraw/zinc/42/38/57/1129423857.db2.gz MLEMWNGZVANQOZ-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO Cc1ccsc1C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000093443715 1129423858 /nfs/dbraw/zinc/42/38/58/1129423858.db2.gz MLEMWNGZVANQOZ-UHFFFAOYSA-N 1 1 288.372 3.523 20 5 CHBDMO C[C@H]1CCC[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000094774539 1129451989 /nfs/dbraw/zinc/45/19/89/1129451989.db2.gz JTDHEEBWYRQVLH-WCQYABFASA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1cccc([C@@H]2CCC[N@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001169006252 1129689426 /nfs/dbraw/zinc/68/94/26/1129689426.db2.gz GJVDZTSIKNPVIS-XIRDDKMYSA-N 1 1 288.391 3.577 20 5 CHBDMO CCCC[N@@H+](Cc1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169030254 1129690731 /nfs/dbraw/zinc/69/07/31/1129690731.db2.gz XJUBTDQGFYXXBO-SJORKVTESA-N 1 1 290.407 3.734 20 5 CHBDMO C[C@H](c1ccc(Cl)cc1)[N@@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035132 1129690745 /nfs/dbraw/zinc/69/07/45/1129690745.db2.gz AJWRXJWHXMXWQL-XUJVJEKNSA-N 1 1 296.798 3.778 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)c(C)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169050093 1129691955 /nfs/dbraw/zinc/69/19/55/1129691955.db2.gz YLRCWSAUWKJNFP-SJORKVTESA-N 1 1 290.407 3.571 20 5 CHBDMO CC(C)[C@@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001169382689 1129721398 /nfs/dbraw/zinc/72/13/98/1129721398.db2.gz LOTFKTWENDPUSA-GFCCVEGCSA-N 1 1 280.343 3.602 20 5 CHBDMO CC[C@@H]1CC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)[C@@H]1C ZINC001462127899 1130202390 /nfs/dbraw/zinc/20/23/90/1130202390.db2.gz SYWQBVABMFILMF-ZIAGYGMSSA-N 1 1 276.380 3.832 20 5 CHBDMO CC[C@@H](C)C[N@@H+](CC)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000748829457 1130249814 /nfs/dbraw/zinc/24/98/14/1130249814.db2.gz ZNJQKUONKMUAJH-LLVKDONJSA-N 1 1 268.332 3.602 20 5 CHBDMO NC[C@@H]1CCC[N@H+]1Cc1c2ccccc2cc2ccccc21 ZINC001235726346 1130772677 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CKRRCBGKEYPCEA-CQSZACIVSA-N 1 1 299.374 3.881 20 5 CHBDMO CC[C@@H](c1ccncc1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000130169557 523122555 /nfs/dbraw/zinc/12/25/55/523122555.db2.gz BAFYBSJDYCFYNG-INIZCTEOSA-N 1 1 285.347 3.573 20 5 CHBDMO CO[C@@]1(C)CCC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000280647272 523809468 /nfs/dbraw/zinc/80/94/68/523809468.db2.gz YUNRUGJUBYLTHQ-CJNGLKHVSA-N 1 1 292.379 3.547 20 5 CHBDMO C[C@H]1c2ccsc2CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000016420712 525132267 /nfs/dbraw/zinc/13/22/67/525132267.db2.gz SQCCGBRJLIRLME-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H]1c2ccsc2CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000016420712 525132274 /nfs/dbraw/zinc/13/22/74/525132274.db2.gz SQCCGBRJLIRLME-NSHDSACASA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccsc1 ZINC000061361711 525483265 /nfs/dbraw/zinc/48/32/65/525483265.db2.gz VRRLKMSXGHSEAS-QMMMGPOBSA-N 1 1 268.363 3.569 20 5 CHBDMO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccccc3F)CC2)cc1 ZINC000076767059 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Cc1cccc([C@@H]2CCC[N@H+]2Cc2cccnc2[N+](=O)[O-])c1 ZINC000885962917 1125631257 /nfs/dbraw/zinc/63/12/57/1125631257.db2.gz IPZUBCPQVJVRQM-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000743272039 1129519096 /nfs/dbraw/zinc/51/90/96/1129519096.db2.gz LZWGSLXSQSFTPX-LLVKDONJSA-N 1 1 268.332 3.600 20 5 CHBDMO CC[C@@H]1[C@@H](C)CC[N@H+]1C/C=C/c1ccccc1[N+](=O)[O-] ZINC000482515262 1126762669 /nfs/dbraw/zinc/76/26/69/1126762669.db2.gz VYLAIAMRJOYIDC-MTENODCZSA-N 1 1 274.364 3.728 20 5 CHBDMO O=[N+]([O-])c1cccc(F)c1C[N@@H+](CC1CC1)CC1CCC1 ZINC000483266996 1126777369 /nfs/dbraw/zinc/77/73/69/1126777369.db2.gz LBZOQJXLJDYVPN-UHFFFAOYSA-N 1 1 292.354 3.746 20 5 CHBDMO CC1=C(C)C[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000483366363 1126783226 /nfs/dbraw/zinc/78/32/26/1126783226.db2.gz IZAMHMAILJEVKE-ZDUSSCGKSA-N 1 1 260.337 3.698 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCc1ccccn1 ZINC000182939890 1126879837 /nfs/dbraw/zinc/87/98/37/1126879837.db2.gz YMKGTUKCINQOIF-AWEZNQCLSA-N 1 1 299.374 3.534 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@@H]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000485733614 1126948376 /nfs/dbraw/zinc/94/83/76/1126948376.db2.gz BMBCJBQFKPEEOI-GXTWGEPZSA-N 1 1 292.379 3.614 20 5 CHBDMO COc1cc(C[N@@H+](CCC(C)C)C2CC2)ccc1[N+](=O)[O-] ZINC000485714672 1126945452 /nfs/dbraw/zinc/94/54/52/1126945452.db2.gz GKDLWFHYEQUWOI-UHFFFAOYSA-N 1 1 292.379 3.614 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000485765822 1126950872 /nfs/dbraw/zinc/95/08/72/1126950872.db2.gz MCBOCMFUXDBOEA-WCQYABFASA-N 1 1 262.353 3.696 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000485765820 1126950954 /nfs/dbraw/zinc/95/09/54/1126950954.db2.gz MCBOCMFUXDBOEA-DGCLKSJQSA-N 1 1 262.353 3.696 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2sccc2C1 ZINC000028174197 1127059200 /nfs/dbraw/zinc/05/92/00/1127059200.db2.gz IORBKSFDOSMUOY-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2sccc2C1 ZINC000028174197 1127059201 /nfs/dbraw/zinc/05/92/01/1127059201.db2.gz IORBKSFDOSMUOY-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO CC[N@H+](Cc1ccccn1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000270707222 1127060721 /nfs/dbraw/zinc/06/07/21/1127060721.db2.gz GXZHAPXIRHBGSL-ZDUSSCGKSA-N 1 1 285.347 3.573 20 5 CHBDMO CC[N@@H+](Cc1ccccn1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000270707222 1127060725 /nfs/dbraw/zinc/06/07/25/1127060725.db2.gz GXZHAPXIRHBGSL-ZDUSSCGKSA-N 1 1 285.347 3.573 20 5 CHBDMO Cc1ccc(C[N@H+](Cc2cccnc2)C(C)C)cc1[N+](=O)[O-] ZINC000349288626 1127146547 /nfs/dbraw/zinc/14/65/47/1127146547.db2.gz WDXRKWPGVJSEGC-UHFFFAOYSA-N 1 1 299.374 3.709 20 5 CHBDMO CCCC[C@H](C)[N@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000589309139 1127218579 /nfs/dbraw/zinc/21/85/79/1127218579.db2.gz DQUYVYUQRMCHHQ-NSHDSACASA-N 1 1 268.332 3.744 20 5 CHBDMO CCCC[C@H](C)[N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-] ZINC000589309139 1127218581 /nfs/dbraw/zinc/21/85/81/1127218581.db2.gz DQUYVYUQRMCHHQ-NSHDSACASA-N 1 1 268.332 3.744 20 5 CHBDMO CC(C)[C@@H]1[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CC1(C)C ZINC000590372240 1127256650 /nfs/dbraw/zinc/25/66/50/1127256650.db2.gz ZITFLEWEROGMNI-AWEZNQCLSA-N 1 1 280.343 3.600 20 5 CHBDMO CC(C)[C@@H]1[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CC1(C)C ZINC000590372240 1127256653 /nfs/dbraw/zinc/25/66/53/1127256653.db2.gz ZITFLEWEROGMNI-AWEZNQCLSA-N 1 1 280.343 3.600 20 5 CHBDMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C3CCCC3)C2)cc1 ZINC000590757614 1127270751 /nfs/dbraw/zinc/27/07/51/1127270751.db2.gz ILJTXMPVDCKLJO-CQSZACIVSA-N 1 1 274.364 3.717 20 5 CHBDMO C[C@@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000354042034 1127288480 /nfs/dbraw/zinc/28/84/80/1127288480.db2.gz JNWWUDQWTFGLHZ-SNVBAGLBSA-N 1 1 268.382 3.524 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000354042034 1127288482 /nfs/dbraw/zinc/28/84/82/1127288482.db2.gz JNWWUDQWTFGLHZ-SNVBAGLBSA-N 1 1 268.382 3.524 20 5 CHBDMO CC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)CC1CCC1 ZINC000355605280 1127353461 /nfs/dbraw/zinc/35/34/61/1127353461.db2.gz IZYAEVZDVNGQCL-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595565277 1127465725 /nfs/dbraw/zinc/46/57/25/1127465725.db2.gz DRMAXKZQSZXAHX-DYEKYZERSA-N 1 1 260.337 3.530 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119389 1127475165 /nfs/dbraw/zinc/47/51/65/1127475165.db2.gz XESNILICCWUTCK-FZMZJTMJSA-N 1 1 296.317 3.695 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](CCF)C1 ZINC000595754352 1127475209 /nfs/dbraw/zinc/47/52/09/1127475209.db2.gz ACKRLZNFXOEFEI-CHWSQXEVSA-N 1 1 280.343 3.727 20 5 CHBDMO C[C@@H]1C[C@@H](C)[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000229394191 1127679988 /nfs/dbraw/zinc/67/99/88/1127679988.db2.gz GIAQQCOBQCJSQC-IJLUTSLNSA-N 1 1 280.343 3.600 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2C2CCCC2)cc1 ZINC000604013221 1127689549 /nfs/dbraw/zinc/68/95/49/1127689549.db2.gz SVKDGXINSYSIRK-INIZCTEOSA-N 1 1 274.364 3.749 20 5 CHBDMO Cc1c(C[N@@H+](C)CC2CCCC2)cccc1[N+](=O)[O-] ZINC000064014402 1127892507 /nfs/dbraw/zinc/89/25/07/1127892507.db2.gz WNUYGNNQTVOUPK-UHFFFAOYSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@H]1CCCC[C@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774664 1127963570 /nfs/dbraw/zinc/96/35/70/1127963570.db2.gz NQHNAHCIITZFIK-SMDDNHRTSA-N 1 1 280.343 3.744 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)Cc1cccc(F)c1 ZINC000544607451 1127978694 /nfs/dbraw/zinc/97/86/94/1127978694.db2.gz XOTQOAWNKFMHQO-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO CC[C@]1(C)CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000468136756 1127994692 /nfs/dbraw/zinc/99/46/92/1127994692.db2.gz AMWIOQOJAWDAGU-SWLSCSKDSA-N 1 1 262.353 3.778 20 5 CHBDMO COc1cc(C[N@@H+](C)[C@@H](C)C(C)(C)C)c([N+](=O)[O-])cc1F ZINC000545206065 1128004889 /nfs/dbraw/zinc/00/48/89/1128004889.db2.gz IKNCFIIPABOJFX-JTQLQIEISA-N 1 1 298.358 3.609 20 5 CHBDMO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1CC=CCC1 ZINC000541553685 1128027122 /nfs/dbraw/zinc/02/71/22/1128027122.db2.gz SRLLOJUMYOZPDA-XKOZXHHJSA-N 1 1 286.375 3.896 20 5 CHBDMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]1c1ccccc1 ZINC000541772203 1128038681 /nfs/dbraw/zinc/03/86/81/1128038681.db2.gz VXNUWEYDFPACET-QGZVFWFLSA-N 1 1 282.343 3.850 20 5 CHBDMO C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)[C@@H]2CCCC[C@H]21 ZINC000542040498 1128048585 /nfs/dbraw/zinc/04/85/85/1128048585.db2.gz LCIRLVLNHXGBGD-KGYLQXTDSA-N 1 1 280.393 3.667 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)[C@H](C)C1 ZINC000470182429 1128064789 /nfs/dbraw/zinc/06/47/89/1128064789.db2.gz LFLQSCROYNBAGZ-IONAJQSGSA-N 1 1 274.364 3.586 20 5 CHBDMO CCOc1cc(C[N@@H+](C)C(C)(C)CC)ccc1[N+](=O)[O-] ZINC000471026624 1128084903 /nfs/dbraw/zinc/08/49/03/1128084903.db2.gz ZUXSTIBVXYQIJO-UHFFFAOYSA-N 1 1 280.368 3.614 20 5 CHBDMO CCOc1cc(C[N@H+]2CCCC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000492767460 1128112088 /nfs/dbraw/zinc/11/20/88/1128112088.db2.gz HGVOIPBCERBMHG-UHFFFAOYSA-N 1 1 292.379 3.616 20 5 CHBDMO CCc1ccc[nH+]c1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761531629 1128133808 /nfs/dbraw/zinc/13/38/08/1128133808.db2.gz GIIZZEKPLUVKHZ-UHFFFAOYSA-N 1 1 291.738 3.818 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]Cc2ccccc2F)c1 ZINC000035368134 1128328259 /nfs/dbraw/zinc/32/82/59/1128328259.db2.gz GKTSTZFOFNGSPC-UHFFFAOYSA-N 1 1 294.713 3.677 20 5 CHBDMO Cc1ncsc1C[N@@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000171750950 1128359734 /nfs/dbraw/zinc/35/97/34/1128359734.db2.gz OYRNQQYBCAQFIA-LLVKDONJSA-N 1 1 291.376 3.553 20 5 CHBDMO Cc1ncsc1C[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000171750950 1128359738 /nfs/dbraw/zinc/35/97/38/1128359738.db2.gz OYRNQQYBCAQFIA-LLVKDONJSA-N 1 1 291.376 3.553 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1nccs1 ZINC000153361020 1128372555 /nfs/dbraw/zinc/37/25/55/1128372555.db2.gz LBPOKQFNJZAFOM-QWRGUYRKSA-N 1 1 291.376 3.772 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)Cc2ccccc21 ZINC000916152976 1128409151 /nfs/dbraw/zinc/40/91/51/1128409151.db2.gz ZYHVBMULOQJYLR-ZDUSSCGKSA-N 1 1 282.343 3.714 20 5 CHBDMO Cc1ccc(C[N@H+]2CC(C)(C)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000568810340 1128592059 /nfs/dbraw/zinc/59/20/59/1128592059.db2.gz NNIVYCHDZDTKFN-HNNXBMFYSA-N 1 1 274.364 3.524 20 5 CHBDMO O=[N+]([O-])c1ccc(C[N@H+]2CCCc3ccccc3C2)cc1 ZINC000498921691 1128620994 /nfs/dbraw/zinc/62/09/94/1128620994.db2.gz HMBWWEFAKOAXHB-UHFFFAOYSA-N 1 1 282.343 3.543 20 5 CHBDMO C[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(F)c(F)c1 ZINC000044437983 1128631058 /nfs/dbraw/zinc/63/10/58/1128631058.db2.gz FOBYBQWUFBYTIP-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(F)c(F)c1 ZINC000044437983 1128631059 /nfs/dbraw/zinc/63/10/59/1128631059.db2.gz FOBYBQWUFBYTIP-UHFFFAOYSA-N 1 1 292.285 3.505 20 5 CHBDMO CCCC[N@H+]1CCCC[C@@H]1CNc1ccsc1[N+](=O)[O-] ZINC000609560995 1128718167 /nfs/dbraw/zinc/71/81/67/1128718167.db2.gz QFFKXAIKXZMFFD-GFCCVEGCSA-N 1 1 297.424 3.723 20 5 CHBDMO CC[C@H](C)[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000610001966 1128734007 /nfs/dbraw/zinc/73/40/07/1128734007.db2.gz PVAFRERVEVUQMX-BBRMVZONSA-N 1 1 276.380 3.995 20 5 CHBDMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)C[C@@H]1C ZINC000610133402 1128739636 /nfs/dbraw/zinc/73/96/36/1128739636.db2.gz MJQCNADJFPAFHX-STQMWFEESA-N 1 1 292.379 3.612 20 5 CHBDMO Cc1c(C[N@H+]2C[C@@H](C)CCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000610215380 1117882115 /nfs/dbraw/zinc/88/21/15/1117882115.db2.gz JQAJFDHREYJADX-QWHCGFSZSA-N 1 1 276.380 3.914 20 5 CHBDMO C[C@@H]([N@@H+](C)Cc1c(F)cccc1[N+](=O)[O-])C(C)(C)C ZINC000609144531 1117965359 /nfs/dbraw/zinc/96/53/59/1117965359.db2.gz BYJFFFOBQXUBCO-SNVBAGLBSA-N 1 1 268.332 3.600 20 5 CHBDMO CC[N@@H+](CCc1ccccn1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000764312725 1118083066 /nfs/dbraw/zinc/08/30/66/1118083066.db2.gz VNSXUPGMUUFPNW-AWEZNQCLSA-N 1 1 299.374 3.615 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H]1C1CC1 ZINC000615835587 1128764359 /nfs/dbraw/zinc/76/43/59/1128764359.db2.gz TYWXAQDVWOAMFW-OJNOIJSXSA-N 1 1 286.375 3.873 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000615837594 1128764602 /nfs/dbraw/zinc/76/46/02/1128764602.db2.gz IDVJVQCSLFEVIK-KANSDYPASA-N 1 1 292.354 3.678 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](C)[C@@H](F)C1 ZINC000615837594 1128764605 /nfs/dbraw/zinc/76/46/05/1128764605.db2.gz IDVJVQCSLFEVIK-KANSDYPASA-N 1 1 292.354 3.678 20 5 CHBDMO C[C@H]([N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])C1(C)CC1 ZINC000255331689 1118415123 /nfs/dbraw/zinc/41/51/23/1118415123.db2.gz DSNUFLJBKYPHLY-WOLRVDTOSA-N 1 1 274.364 3.728 20 5 CHBDMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C)CCC[C@H]1C ZINC000610215386 1118569984 /nfs/dbraw/zinc/56/99/84/1118569984.db2.gz KQEVFCWLXABPRH-QWHCGFSZSA-N 1 1 292.379 3.614 20 5 CHBDMO CCn1ccc(C[N@@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])c1 ZINC000616737728 1128798351 /nfs/dbraw/zinc/79/83/51/1128798351.db2.gz FHAKECOFAHILEP-SOFGYWHQSA-N 1 1 299.374 3.561 20 5 CHBDMO C[C@@H](c1ccccc1)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051428219 1119007689 /nfs/dbraw/zinc/00/76/89/1119007689.db2.gz LYDDJHHJTGYGMC-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO C[C@@H](c1ccccc1)[N@@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000051428219 1119007694 /nfs/dbraw/zinc/00/76/94/1119007694.db2.gz LYDDJHHJTGYGMC-LBPRGKRZSA-N 1 1 288.322 3.927 20 5 CHBDMO CC(C)C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000479582704 1119125173 /nfs/dbraw/zinc/12/51/73/1119125173.db2.gz YTTJSLMTYQTWGA-HNNXBMFYSA-N 1 1 262.353 3.605 20 5 CHBDMO CC(C)c1[nH+]ccn1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000070423050 1119581345 /nfs/dbraw/zinc/58/13/45/1119581345.db2.gz UYPKCRHQKZKIRM-UHFFFAOYSA-N 1 1 279.727 3.616 20 5 CHBDMO CC(C)[N@@H+](CCC1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000480531727 1119591853 /nfs/dbraw/zinc/59/18/53/1119591853.db2.gz XZSPAKWZPVCSAD-UHFFFAOYSA-N 1 1 262.353 3.605 20 5 CHBDMO Cc1ccccc1[C@@H](C)[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000181554319 1120215267 /nfs/dbraw/zinc/21/52/67/1120215267.db2.gz PLSMDDCLUULACC-GFCCVEGCSA-N 1 1 288.322 3.893 20 5 CHBDMO C[C@H]1CC[C@@]2(CC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC000542882663 1120220474 /nfs/dbraw/zinc/22/04/74/1120220474.db2.gz CENHLVYXYMNLBE-WMLDXEAASA-N 1 1 288.391 3.649 20 5 CHBDMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC1CC1 ZINC000542930470 1120258560 /nfs/dbraw/zinc/25/85/60/1120258560.db2.gz PSQBOZIYEBUJRE-UHFFFAOYSA-N 1 1 282.771 3.869 20 5 CHBDMO C[C@@H](C1CC1)[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CC1 ZINC000092009425 1120538420 /nfs/dbraw/zinc/53/84/20/1120538420.db2.gz PCIALLMDNUDLTL-BPJJOFIESA-N 1 1 286.375 3.871 20 5 CHBDMO Cc1ccsc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000352731057 1120694417 /nfs/dbraw/zinc/69/44/17/1120694417.db2.gz LUCLVUOGEGEQHO-UHFFFAOYSA-N 1 1 294.351 3.736 20 5 CHBDMO Cc1ccsc1C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000352731057 1120694418 /nfs/dbraw/zinc/69/44/18/1120694418.db2.gz LUCLVUOGEGEQHO-UHFFFAOYSA-N 1 1 294.351 3.736 20 5 CHBDMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC000585754271 1121029045 /nfs/dbraw/zinc/02/90/45/1121029045.db2.gz CRPSJMYVMCFTEL-UHFFFAOYSA-N 1 1 284.359 3.962 20 5 CHBDMO C[C@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)CC(C)(C)C1 ZINC000344004479 1121050787 /nfs/dbraw/zinc/05/07/87/1121050787.db2.gz ZRLUDOCQKCOMER-SNVBAGLBSA-N 1 1 268.382 3.524 20 5 CHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000512230857 1121212618 /nfs/dbraw/zinc/21/26/18/1121212618.db2.gz VJLNWKNJRNKMRF-QSYFUGGGSA-N 1 1 276.380 3.974 20 5 CHBDMO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H](C)C(C)C ZINC000512224246 1121212669 /nfs/dbraw/zinc/21/26/69/1121212669.db2.gz ARUMYVDTLXJAEA-CYBMUJFWSA-N 1 1 264.369 3.770 20 5 CHBDMO CC1(C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)CCC1 ZINC000432827755 1121396187 /nfs/dbraw/zinc/39/61/87/1121396187.db2.gz GKWCXGAXIABZEM-UHFFFAOYSA-N 1 1 274.364 3.749 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)c1 ZINC000706759260 1121439773 /nfs/dbraw/zinc/43/97/73/1121439773.db2.gz MPRJFMKPZRQVJW-HZMBPMFUSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2C[C@@H]3CCCC[C@@H]32)c1 ZINC000706759260 1121439777 /nfs/dbraw/zinc/43/97/77/1121439777.db2.gz MPRJFMKPZRQVJW-HZMBPMFUSA-N 1 1 280.755 3.623 20 5 CHBDMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H]2C2CC2)c1 ZINC000706881206 1121443231 /nfs/dbraw/zinc/44/32/31/1121443231.db2.gz BHAJKDVPGGBIFU-CQSZACIVSA-N 1 1 280.755 3.623 20 5 CHBDMO CCC[C@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000543632632 1121538654 /nfs/dbraw/zinc/53/86/54/1121538654.db2.gz VQJNKWRJWXBSNK-LBPRGKRZSA-N 1 1 250.342 3.524 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CC[C@@H](c2ccco2)C1 ZINC000611271345 1121634167 /nfs/dbraw/zinc/63/41/67/1121634167.db2.gz SNRPIEXWYVGVTP-YFCVBGDOSA-N 1 1 298.342 3.691 20 5 CHBDMO O=[N+]([O-])c1ccc(CNc2cccc3cc[nH+]cc32)c(F)c1 ZINC000611498459 1121652632 /nfs/dbraw/zinc/65/26/32/1121652632.db2.gz LCLXDDMUUFUDJY-UHFFFAOYSA-N 1 1 297.289 3.894 20 5 CHBDMO Cc1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000619785182 1129013755 /nfs/dbraw/zinc/01/37/55/1129013755.db2.gz RWVSKVBZBSAONM-UHFFFAOYSA-N 1 1 284.359 3.578 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](C)C1 ZINC000501792210 1122009901 /nfs/dbraw/zinc/00/99/01/1122009901.db2.gz CWLNPQCGLYWFAN-JHJVBQTASA-N 1 1 262.353 3.634 20 5 CHBDMO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000035019503 1122150361 /nfs/dbraw/zinc/15/03/61/1122150361.db2.gz QZPZIFYZMCSCQV-VXGBXAGGSA-N 1 1 274.320 3.908 20 5 CHBDMO Cc1ccc(C[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000505355197 1122361755 /nfs/dbraw/zinc/36/17/55/1122361755.db2.gz FLHFQULANOAVKQ-UHFFFAOYSA-N 1 1 262.353 3.668 20 5 CHBDMO C[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC001190661911 1122549194 /nfs/dbraw/zinc/54/91/94/1122549194.db2.gz VSOHEJCOYJFPQV-LLVKDONJSA-N 1 1 282.771 3.870 20 5 CHBDMO C[C@@H]1CCCC[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001193509509 1122696367 /nfs/dbraw/zinc/69/63/67/1122696367.db2.gz ZZRDWWTWMDEWOO-LLVKDONJSA-N 1 1 282.771 3.870 20 5 CHBDMO CC[C@@H]1CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000509546646 1122726321 /nfs/dbraw/zinc/72/63/21/1122726321.db2.gz WOOFNUXLZWRKIF-CYBMUJFWSA-N 1 1 262.353 3.525 20 5 CHBDMO C[C@@H](c1ccccn1)[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000183679117 1129081153 /nfs/dbraw/zinc/08/11/53/1129081153.db2.gz XOPNJWSGGUOVNY-KGXGESDWSA-N 1 1 297.358 3.696 20 5 CHBDMO CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC(C)C ZINC000507116752 1122924862 /nfs/dbraw/zinc/92/48/62/1122924862.db2.gz RIUPPIWQHCWICQ-VQHVLOKHSA-N 1 1 262.353 3.586 20 5 CHBDMO C/C=C\C[C@H]1CCC[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001196612718 1122927637 /nfs/dbraw/zinc/92/76/37/1122927637.db2.gz FFIWYFJSKVSFAU-ZRMMWKCHSA-N 1 1 292.354 3.912 20 5 CHBDMO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC000507135082 1122930821 /nfs/dbraw/zinc/93/08/21/1122930821.db2.gz PRXNNRVMZAXRPU-UHFFFAOYSA-N 1 1 288.322 3.674 20 5 CHBDMO Cc1ccccc1[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000507194401 1122937966 /nfs/dbraw/zinc/93/79/66/1122937966.db2.gz FZGCYJJZWYBYCD-INIZCTEOSA-N 1 1 296.370 3.893 20 5 CHBDMO O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000507673609 1122983824 /nfs/dbraw/zinc/98/38/24/1122983824.db2.gz OZPUWMCMZSKUSQ-QGZVFWFLSA-N 1 1 296.370 3.659 20 5 CHBDMO Cc1ccc(C[N@H+]([C@@H](C)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000508010814 1123254845 /nfs/dbraw/zinc/25/48/45/1123254845.db2.gz ZOSMCHYKQXBWMS-LBPRGKRZSA-N 1 1 274.364 3.666 20 5 CHBDMO C[N@@H+](CCCF)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000895898451 1123527772 /nfs/dbraw/zinc/52/77/72/1123527772.db2.gz SOHWZRYAUFKZIA-UHFFFAOYSA-N 1 1 292.310 3.646 20 5 CHBDMO CC[C@@H](F)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000440699692 1124078047 /nfs/dbraw/zinc/07/80/47/1124078047.db2.gz UKZBUYFDHYBMRA-CYBMUJFWSA-N 1 1 268.332 3.553 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2ccccc2C1 ZINC000144085764 1124095684 /nfs/dbraw/zinc/09/56/84/1124095684.db2.gz YXZHQEQJPNYHOV-CYBMUJFWSA-N 1 1 282.343 3.714 20 5 CHBDMO CS[C@@H]1CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000449446812 1124741384 /nfs/dbraw/zinc/74/13/84/1124741384.db2.gz UJXZGWGHKKGQNG-CYBMUJFWSA-N 1 1 294.420 3.656 20 5 CHBDMO CC[N@@H+](Cc1ccncc1)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000877522954 1125039386 /nfs/dbraw/zinc/03/93/86/1125039386.db2.gz GBZMILBNMOPSIJ-UHFFFAOYSA-N 1 1 299.374 3.629 20 5 CHBDMO Cc1cc[nH+]c(N2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000450760352 1125103682 /nfs/dbraw/zinc/10/36/82/1125103682.db2.gz NRDNKOZDTDFXLE-OAHLLOKOSA-N 1 1 297.358 3.682 20 5 CHBDMO C[C@@H]1CCCC[C@@H]1[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000094774661 1129452085 /nfs/dbraw/zinc/45/20/85/1129452085.db2.gz NQHNAHCIITZFIK-RISCZKNCSA-N 1 1 280.343 3.744 20 5 CHBDMO CC1(C)CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000094774906 1129452104 /nfs/dbraw/zinc/45/21/04/1129452104.db2.gz AOHLFFIQVFHOPT-UHFFFAOYSA-N 1 1 280.343 3.746 20 5 CHBDMO CC1(C)CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000741804219 1129454977 /nfs/dbraw/zinc/45/49/77/1129454977.db2.gz DJWSMWAANMYGPY-UHFFFAOYSA-N 1 1 280.343 3.746 20 5 CHBDMO CC(C)(C)[N@@H+](Cc1ccccc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169005752 1129689331 /nfs/dbraw/zinc/68/93/31/1129689331.db2.gz CSMCRMXTEJMECB-CVEARBPZSA-N 1 1 290.407 3.733 20 5 CHBDMO Cc1ccccc1[C@@H]1CCC[N@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169012544 1129690118 /nfs/dbraw/zinc/69/01/18/1129690118.db2.gz QXBXTIXSMMUYRF-ZOBUZTSGSA-N 1 1 288.391 3.577 20 5 CHBDMO C[N@@H+](Cc1ccc2ccccc2c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046788 1129691172 /nfs/dbraw/zinc/69/11/72/1129691172.db2.gz NANWOJCGYNPXLE-YJBOKZPZSA-N 1 1 298.386 3.717 20 5 CHBDMO C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC000796524674 1129772653 /nfs/dbraw/zinc/77/26/53/1129772653.db2.gz DFLCBMBAQYFGHD-CYBMUJFWSA-N 1 1 280.343 3.744 20 5 CHBDMO CC[C@@]1(C)CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000743860676 1129877931 /nfs/dbraw/zinc/87/79/31/1129877931.db2.gz POPJFUNYLOFZIV-HNNXBMFYSA-N 1 1 280.343 3.746 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC3(CCCC3)C2)cc1[N+](=O)[O-] ZINC000769402599 1129906196 /nfs/dbraw/zinc/90/61/96/1129906196.db2.gz MSPOIJXEPIGJLK-UHFFFAOYSA-N 1 1 274.364 3.669 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CC12CCC2 ZINC000771464618 1129982997 /nfs/dbraw/zinc/98/29/97/1129982997.db2.gz POZUKPNCCJLQAR-GFCCVEGCSA-N 1 1 292.354 3.746 20 5 CHBDMO C[Si](C)(C)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001170409714 1130491830 /nfs/dbraw/zinc/49/18/30/1130491830.db2.gz BCNYMJWYKNJJIS-AWEZNQCLSA-N 1 1 292.455 3.652 20 5 CHBDMO C[C@H]1C[C@H](C(C)(C)C)CC[N@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001170785340 1130989976 /nfs/dbraw/zinc/98/99/76/1130989976.db2.gz ZVTRRTXLPCCJTE-GXTWGEPZSA-N 1 1 291.395 3.636 20 5 CHBDMO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799196890 1131075786 /nfs/dbraw/zinc/07/57/86/1131075786.db2.gz ZDHHDDIRPLAPKS-ZFWWWQNUSA-N 1 1 297.358 3.540 20 5 CHBDMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437068 1131563754 /nfs/dbraw/zinc/56/37/54/1131563754.db2.gz SCJROEOKMWIUEV-RISCZKNCSA-N 1 1 296.317 3.777 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)cc1[N+](=O)[O-] ZINC000846108804 1131686723 /nfs/dbraw/zinc/68/67/23/1131686723.db2.gz QUFXBFPRAKQOJD-CQSZACIVSA-N 1 1 296.317 3.524 20 5 CHBDMO CC(C)[C@@H](C)[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000036787257 1131975265 /nfs/dbraw/zinc/97/52/65/1131975265.db2.gz TUBALWQZXQFDBF-SNVBAGLBSA-N 1 1 270.760 3.725 20 5 CHBDMO Cc1c(C[N@H+]2CC[C@@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC001171532892 1132043538 /nfs/dbraw/zinc/04/35/38/1132043538.db2.gz MJAWJMTYNUQVMN-BBRMVZONSA-N 1 1 274.364 3.668 20 5 CHBDMO CCCC[N@@H+](CC)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908017 1132350706 /nfs/dbraw/zinc/35/07/06/1132350706.db2.gz KGCSSXQIYFUTGY-INIZCTEOSA-N 1 1 290.407 3.964 20 5 CHBDMO CC[C@H]1CCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914559 1132360247 /nfs/dbraw/zinc/36/02/47/1132360247.db2.gz HSOCFMNMDUJHPA-HOTGVXAUSA-N 1 1 288.391 3.717 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC12CCCCC2 ZINC001173220605 1132411812 /nfs/dbraw/zinc/41/18/12/1132411812.db2.gz BCTDDWYNAGCUOL-AWEZNQCLSA-N 1 1 288.391 3.934 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC001173226216 1132412383 /nfs/dbraw/zinc/41/23/83/1132412383.db2.gz LJFSCTQPGJUUNC-NWDGAFQWSA-N 1 1 298.333 3.503 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC001173226218 1132412605 /nfs/dbraw/zinc/41/26/05/1132412605.db2.gz LJFSCTQPGJUUNC-RYUDHWBXSA-N 1 1 298.333 3.503 20 5 CHBDMO Cc1cccc2c1C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173224393 1132412880 /nfs/dbraw/zinc/41/28/80/1132412880.db2.gz FHZPESFTUUNTKV-CQSZACIVSA-N 1 1 296.370 3.850 20 5 CHBDMO CC(C)[C@H]1CCC[N@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230997 1132413564 /nfs/dbraw/zinc/41/35/64/1132413564.db2.gz IBGJWAJHBUDISM-XJKSGUPXSA-N 1 1 276.380 3.646 20 5 CHBDMO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](C)[C@@H](C)C1 ZINC001173230491 1132413935 /nfs/dbraw/zinc/41/39/35/1132413935.db2.gz YJKMVHSBWKVOHC-QLFBSQMISA-N 1 1 290.407 3.894 20 5 CHBDMO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H]1CC1(C)C ZINC001173231262 1132414374 /nfs/dbraw/zinc/41/43/74/1132414374.db2.gz AGJJWIOABFKCSH-GXTWGEPZSA-N 1 1 276.380 3.504 20 5 CHBDMO CC(C)(C)C(=[NH2+])Nc1ccc2cc(F)cc([N+](=O)[O-])c2n1 ZINC001162661247 1133101814 /nfs/dbraw/zinc/10/18/14/1133101814.db2.gz SJBMHLZEGAFVCF-UHFFFAOYSA-N 1 1 290.298 3.717 20 5 CHBDMO Cc1cc(C)c(COc2ccc([N+](=O)[O-])cc2C)c(C)[nH+]1 ZINC001165856738 1133253478 /nfs/dbraw/zinc/25/34/78/1133253478.db2.gz PHRUDCJEGFEUJZ-UHFFFAOYSA-N 1 1 286.331 3.802 20 5 CHBDMO Cc1cc(C)c(COc2ccsc2[N+](=O)[O-])c(C)[nH+]1 ZINC001166202754 1133261766 /nfs/dbraw/zinc/26/17/66/1133261766.db2.gz RLDOMERBWGKZSB-UHFFFAOYSA-N 1 1 278.333 3.556 20 5 CHBDMO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCC[C@H]1C1CCC1 ZINC001204602153 1133466853 /nfs/dbraw/zinc/46/68/53/1133466853.db2.gz SAGWJKRNRGSHQS-KRWDZBQOSA-N 1 1 288.391 3.976 20 5 CHBDMO Cc1cn2cc(Nc3cc([N+](=O)[O-])ccc3C)ccc2[nH+]1 ZINC001211287195 1134402858 /nfs/dbraw/zinc/40/28/58/1134402858.db2.gz GQBHXSLMEYHOEL-UHFFFAOYSA-N 1 1 282.303 3.603 20 5 CHBDMO C[N@H+]1CCC[C@H](Oc2nc3ccccc3c3ccccc32)C1 ZINC001226992499 1135771882 /nfs/dbraw/zinc/77/18/82/1135771882.db2.gz KVHBWRZRWNGRBS-AWEZNQCLSA-N 1 1 292.382 3.861 20 5 CHBDMO CCCC[C@@H](C)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000576553056 335218165 /nfs/dbraw/zinc/21/81/65/335218165.db2.gz LPUHZNFYAQTPKW-GFCCVEGCSA-N 1 1 280.368 3.614 20 5 CHBDMO C[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000035738497 172391766 /nfs/dbraw/zinc/39/17/66/172391766.db2.gz ZOBZJSRJXXTNPU-GHMZBOCLSA-N 1 1 260.293 3.600 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000035738535 172392024 /nfs/dbraw/zinc/39/20/24/172392024.db2.gz APUAQAUABKFODD-WDEREUQCSA-N 1 1 260.293 3.600 20 5 CHBDMO CC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1nccs1 ZINC000078004331 260167638 /nfs/dbraw/zinc/16/76/38/260167638.db2.gz ADMKAVCPIVJKGH-GFCCVEGCSA-N 1 1 291.376 3.601 20 5 CHBDMO COc1ccsc1[C@@H](C)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000186202179 262084782 /nfs/dbraw/zinc/08/47/82/262084782.db2.gz OBQNBHUPVHUYSS-SNVBAGLBSA-N 1 1 292.360 3.516 20 5 CHBDMO CC(C)(C)[C@@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000525784841 262235007 /nfs/dbraw/zinc/23/50/07/262235007.db2.gz XOLCVEQWIZTOIR-AWEZNQCLSA-N 1 1 262.353 3.605 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)CC12CCC2 ZINC000357019727 266233835 /nfs/dbraw/zinc/23/38/35/266233835.db2.gz CSRAAEKVVPFBLV-LLVKDONJSA-N 1 1 280.393 3.668 20 5 CHBDMO C[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC12CCC2 ZINC000357034049 266236368 /nfs/dbraw/zinc/23/63/68/266236368.db2.gz GYSJCHNXDJFLRX-CYBMUJFWSA-N 1 1 274.364 3.607 20 5 CHBDMO C[C@@H]1CC[C@]2(CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)C1 ZINC000359302886 266561800 /nfs/dbraw/zinc/56/18/00/266561800.db2.gz PDALCEXQNIQGRG-CJNGLKHVSA-N 1 1 274.364 3.607 20 5 CHBDMO CC[N@H+](Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C[C@@H](C)OC ZINC000361025654 266771259 /nfs/dbraw/zinc/77/12/59/266771259.db2.gz NWQPSNOVCAYITH-CYBMUJFWSA-N 1 1 294.395 3.575 20 5 CHBDMO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000534331905 328046821 /nfs/dbraw/zinc/04/68/21/328046821.db2.gz OUAQJFVEWJPINV-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO Cc1ccc(C[N@H+]2CCC[C@H]2c2ccccn2)cc1[N+](=O)[O-] ZINC000534331905 328046822 /nfs/dbraw/zinc/04/68/22/328046822.db2.gz OUAQJFVEWJPINV-INIZCTEOSA-N 1 1 297.358 3.635 20 5 CHBDMO CC(C)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000303586662 328354277 /nfs/dbraw/zinc/35/42/77/328354277.db2.gz GLASITINEIHMBB-HNNXBMFYSA-N 1 1 276.380 3.853 20 5 CHBDMO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000303681243 328357678 /nfs/dbraw/zinc/35/76/78/328357678.db2.gz JCMLRCIOENVNIA-UNEWFSDZSA-N 1 1 288.391 3.790 20 5 CHBDMO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000037562789 326855346 /nfs/dbraw/zinc/85/53/46/326855346.db2.gz LHVULZOQUNMSPO-QMMMGPOBSA-N 1 1 298.314 3.785 20 5 CHBDMO CCS[C@H]1CC[C@H]([N@@H+](C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000174352865 329157628 /nfs/dbraw/zinc/15/76/28/329157628.db2.gz KSQKMLOTRUSIDM-KBPBESRZSA-N 1 1 294.420 3.701 20 5 CHBDMO C[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000508978320 332853678 /nfs/dbraw/zinc/85/36/78/332853678.db2.gz PYWUSVFTQCAVGS-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO CC(C)[C@H]1CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000445428458 330216129 /nfs/dbraw/zinc/21/61/29/330216129.db2.gz WJGOQIDUDYUYKD-OCCSQVGLSA-N 1 1 262.353 3.634 20 5 CHBDMO C[C@H]([NH2+]Cc1cccc(F)c1F)c1cccc([N+](=O)[O-])c1 ZINC000107038463 330345995 /nfs/dbraw/zinc/34/59/95/330345995.db2.gz WUZMQFBEYSKTQS-JTQLQIEISA-N 1 1 292.285 3.724 20 5 CHBDMO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000107929183 330351273 /nfs/dbraw/zinc/35/12/73/330351273.db2.gz RFKIICJROFBICU-SNVBAGLBSA-N 1 1 292.285 3.724 20 5 CHBDMO CC[C@@H]1CCC[N@H+]1C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000470173824 331034347 /nfs/dbraw/zinc/03/43/47/331034347.db2.gz GCONPAXSKGHBMN-VSKPTYQZSA-N 1 1 274.364 3.873 20 5 CHBDMO COc1cc(C[N@H+]2CCCCC[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000464676494 331364612 /nfs/dbraw/zinc/36/46/12/331364612.db2.gz HQTTYMWQFSYHGG-NSHDSACASA-N 1 1 296.342 3.507 20 5 CHBDMO CCC(CC)[N@@H+](CC)Cc1cc([N+](=O)[O-])ccc1OC ZINC000516891022 333085543 /nfs/dbraw/zinc/08/55/43/333085543.db2.gz ZWLBGILTFUFJDK-UHFFFAOYSA-N 1 1 280.368 3.614 20 5 CHBDMO CCC(CC)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000517122590 333093002 /nfs/dbraw/zinc/09/30/02/333093002.db2.gz VNRJLQZOVZDUPQ-UHFFFAOYSA-N 1 1 262.353 3.748 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCSC[C@H](C)C1 ZINC000190425442 333206918 /nfs/dbraw/zinc/20/69/18/333206918.db2.gz AEEIOIUADBJOLX-YPMHNXCESA-N 1 1 294.420 3.649 20 5 CHBDMO C[C@H]1C[C@@H](c2ccccc2)C[N@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000522418963 333286712 /nfs/dbraw/zinc/28/67/12/333286712.db2.gz VZDSXMYEIIKKTH-WMLDXEAASA-N 1 1 296.370 3.973 20 5 CHBDMO CC(C)[C@H]1[N@H+](Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000576010857 335141346 /nfs/dbraw/zinc/14/13/46/335141346.db2.gz RBPQDXWWHXSIHN-GFCCVEGCSA-N 1 1 268.382 3.523 20 5 CHBDMO CC(C)[C@H]1[N@@H+](Cc2csc([N+](=O)[O-])c2)CC1(C)C ZINC000576010857 335141348 /nfs/dbraw/zinc/14/13/48/335141348.db2.gz RBPQDXWWHXSIHN-GFCCVEGCSA-N 1 1 268.382 3.523 20 5 CHBDMO Cc1cc[nH+]c(N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000538510319 333601725 /nfs/dbraw/zinc/60/17/25/333601725.db2.gz ZPQCJMOCCQUDBD-LBPRGKRZSA-N 1 1 271.320 3.780 20 5 CHBDMO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccoc1 ZINC000539297340 333664556 /nfs/dbraw/zinc/66/45/56/333664556.db2.gz RFRRTENBJIGJHJ-MNOVXSKESA-N 1 1 260.293 3.600 20 5 CHBDMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCS[C@H](C)CC1 ZINC000249014160 334324557 /nfs/dbraw/zinc/32/45/57/334324557.db2.gz JXUUGIIWKZZXEB-OLZOCXBDSA-N 1 1 294.420 3.792 20 5 CHBDMO C[C@@H]1CCC[C@@H](C)[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000353878476 533733463 /nfs/dbraw/zinc/73/34/63/533733463.db2.gz DEXKCVKVDVTXOY-GHMZBOCLSA-N 1 1 268.382 3.667 20 5 CHBDMO CCC[N@@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000127520480 521502234 /nfs/dbraw/zinc/50/22/34/521502234.db2.gz VWBNCUFVZAWVHL-UHFFFAOYSA-N 1 1 291.376 3.560 20 5 CHBDMO CC[C@H](c1ccncc1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000130244995 522966502 /nfs/dbraw/zinc/96/65/02/522966502.db2.gz PATVBNBOSAEXMD-QGZVFWFLSA-N 1 1 299.374 3.615 20 5 CHBDMO C[C@@H]1CCC[C@H]([N@@H+](C)Cc2csc([N+](=O)[O-])c2)C1 ZINC000339919921 524390088 /nfs/dbraw/zinc/39/00/88/524390088.db2.gz DSCAZKPFLONZNO-PWSUYJOCSA-N 1 1 268.382 3.667 20 5 CHBDMO C[C@@H]1c2ccsc2CC[N@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000016420713 525735164 /nfs/dbraw/zinc/73/51/64/525735164.db2.gz SQCCGBRJLIRLME-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@@H]1c2ccsc2CC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000016420713 525735168 /nfs/dbraw/zinc/73/51/68/525735168.db2.gz SQCCGBRJLIRLME-LLVKDONJSA-N 1 1 288.372 3.776 20 5 CHBDMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000289647976 526118313 /nfs/dbraw/zinc/11/83/13/526118313.db2.gz DPNWYLLAMMMXHU-WDEREUQCSA-N 1 1 284.306 3.633 20 5 CHBDMO O=[N+]([O-])c1ccccc1/C=C/CNc1cccc(C2CC2)[nH+]1 ZINC000339428091 527397385 /nfs/dbraw/zinc/39/73/85/527397385.db2.gz JILJSDCKAXLAST-GQCTYLIASA-N 1 1 295.342 3.993 20 5 CHBDMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)Cc1ccccn1 ZINC000347382319 527500284 /nfs/dbraw/zinc/50/02/84/527500284.db2.gz UYVHGUYXPAFLBP-UVTDQMKNSA-N 1 1 297.358 3.525 20 5 CHBDMO CCS[C@H]1CCCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000353584112 529225493 /nfs/dbraw/zinc/22/54/93/529225493.db2.gz FACQWLHKDUCVDV-HNNXBMFYSA-N 1 1 294.420 3.702 20 5 CHBDMO